data_18792 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18792 _Entry.PDB_ID 2M03 save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 18792 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 4 4 ALA N N 4 124.786 124.786 120.620 4.166 18792 2 1 1 . 1 1 4 4 ALA C C 4 178.272 178.272 178.552 -0.280 18792 3 1 1 . 1 1 4 4 ALA CA C 4 52.566 52.566 53.228 -0.662 18792 4 1 1 . 1 1 4 4 ALA CB C 4 18.234 18.234 19.691 -1.457 18792 5 1 1 . 1 1 4 4 ALA H H 4 8.414 8.414 8.332 0.082 18792 6 1 1 . 1 1 5 5 MET N N 5 119.681 119.681 117.000 2.681 18792 7 1 1 . 1 1 5 5 MET C C 5 176.929 176.929 176.865 0.064 18792 8 1 1 . 1 1 5 5 MET CA C 5 55.594 55.594 55.581 0.014 18792 9 1 1 . 1 1 5 5 MET CB C 5 31.540 31.540 31.886 -0.346 18792 10 1 1 . 1 1 5 5 MET H H 5 8.336 8.336 7.953 0.383 18792 11 1 1 . 1 1 6 6 SER N N 6 116.162 116.162 118.070 -1.908 18792 12 1 1 . 1 1 6 6 SER C C 6 175.924 175.924 176.028 -0.104 18792 13 1 1 . 1 1 6 6 SER CA C 6 59.009 59.009 61.385 -2.376 18792 14 1 1 . 1 1 6 6 SER CB C 6 62.537 62.537 62.744 -0.207 18792 15 1 1 . 1 1 6 6 SER H H 6 8.272 8.272 8.252 0.020 18792 16 1 1 . 1 1 7 7 GLN N N 7 122.263 122.263 120.615 1.648 18792 17 1 1 . 1 1 7 7 GLN C C 7 177.027 177.027 178.313 -1.286 18792 18 1 1 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.989 -2.719 18792 19 1 1 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.653 -0.914 18792 20 1 1 . 1 1 7 7 GLN H H 7 8.314 8.314 8.632 -0.318 18792 21 1 1 . 1 1 8 8 SER N N 8 116.625 116.625 115.608 1.017 18792 22 1 1 . 1 1 8 8 SER C C 8 176.457 176.457 176.573 -0.116 18792 23 1 1 . 1 1 8 8 SER CA C 8 59.650 59.650 62.122 -2.472 18792 24 1 1 . 1 1 8 8 SER CB C 8 62.226 62.226 62.950 -0.724 18792 25 1 1 . 1 1 8 8 SER H H 8 8.333 8.333 7.823 0.510 18792 26 1 1 . 1 1 9 9 ASN N N 9 121.307 121.307 120.442 0.865 18792 27 1 1 . 1 1 9 9 ASN C C 9 177.419 177.419 177.498 -0.079 18792 28 1 1 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.181 -0.694 18792 29 1 1 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.796 -1.663 18792 30 1 1 . 1 1 9 9 ASN H H 9 8.611 8.611 8.008 0.603 18792 31 1 1 . 1 1 10 10 ARG N N 10 119.830 119.830 119.375 0.455 18792 32 1 1 . 1 1 10 10 ARG C C 10 177.615 177.615 178.457 -0.842 18792 33 1 1 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.790 -0.532 18792 34 1 1 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.069 -1.870 18792 35 1 1 . 1 1 10 10 ARG H H 10 7.996 7.996 8.746 -0.750 18792 36 1 1 . 1 1 11 11 GLU N N 11 117.270 117.270 120.564 -3.294 18792 37 1 1 . 1 1 11 11 GLU C C 11 179.649 179.649 178.805 0.844 18792 38 1 1 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.409 -0.400 18792 39 1 1 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.530 -1.409 18792 40 1 1 . 1 1 11 11 GLU H H 11 7.885 7.885 7.979 -0.094 18792 41 1 1 . 1 1 12 12 LEU N N 12 119.900 119.900 119.885 0.015 18792 42 1 1 . 1 1 12 12 LEU C C 12 178.473 178.473 179.127 -0.654 18792 43 1 1 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.128 -0.435 18792 44 1 1 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.925 -1.296 18792 45 1 1 . 1 1 12 12 LEU H H 12 7.691 7.691 8.119 -0.428 18792 46 1 1 . 1 1 13 13 VAL N N 13 117.320 117.320 118.706 -1.386 18792 47 1 1 . 1 1 13 13 VAL C C 13 177.272 177.272 178.525 -1.253 18792 48 1 1 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.584 0.572 18792 49 1 1 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.039 0.190 18792 50 1 1 . 1 1 13 13 VAL H H 13 7.629 7.629 7.778 -0.149 18792 51 1 1 . 1 1 14 14 VAL N N 14 116.659 116.659 120.608 -3.949 18792 52 1 1 . 1 1 14 14 VAL C C 14 178.718 178.718 177.765 0.953 18792 53 1 1 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.760 -0.244 18792 54 1 1 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.519 -1.145 18792 55 1 1 . 1 1 14 14 VAL H H 14 8.210 8.210 7.890 0.320 18792 56 1 1 . 1 1 15 15 ASP N N 15 120.374 120.374 121.183 -0.809 18792 57 1 1 . 1 1 15 15 ASP C C 15 177.557 177.557 178.014 -0.457 18792 58 1 1 . 1 1 15 15 ASP CA C 15 58.476 58.476 56.862 1.614 18792 59 1 1 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.885 1.668 18792 60 1 1 . 1 1 15 15 ASP H H 15 7.967 7.967 8.616 -0.649 18792 61 1 1 . 1 1 16 16 PHE N N 16 119.864 119.864 120.529 -0.665 18792 62 1 1 . 1 1 16 16 PHE C C 16 178.252 178.252 177.237 1.015 18792 63 1 1 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.894 0.886 18792 64 1 1 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.162 -0.102 18792 65 1 1 . 1 1 16 16 PHE H H 16 8.228 8.228 7.879 0.349 18792 66 1 1 . 1 1 17 17 LEU N N 17 116.312 116.312 119.327 -3.015 18792 67 1 1 . 1 1 17 17 LEU C C 17 179.649 179.649 178.968 0.681 18792 68 1 1 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.359 -0.595 18792 69 1 1 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.885 -1.800 18792 70 1 1 . 1 1 17 17 LEU H H 17 8.766 8.766 8.159 0.607 18792 71 1 1 . 1 1 18 18 SER N N 18 113.715 113.715 115.801 -2.086 18792 72 1 1 . 1 1 18 18 SER C C 18 177.362 177.362 176.647 0.715 18792 73 1 1 . 1 1 18 18 SER CA C 18 61.948 61.948 61.567 0.381 18792 74 1 1 . 1 1 18 18 SER CB C 18 63.003 63.003 63.458 -0.455 18792 75 1 1 . 1 1 18 18 SER H H 18 8.384 8.384 8.324 0.060 18792 76 1 1 . 1 1 19 19 TYR N N 19 124.570 124.570 122.749 1.821 18792 77 1 1 . 1 1 19 19 TYR C C 19 178.415 178.415 178.046 0.369 18792 78 1 1 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.176 -1.412 18792 79 1 1 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.265 -1.249 18792 80 1 1 . 1 1 19 19 TYR H H 19 8.155 8.155 8.750 -0.595 18792 81 1 1 . 1 1 20 20 LYS N N 20 119.739 119.739 119.675 0.064 18792 82 1 1 . 1 1 20 20 LYS C C 20 180.456 180.456 178.930 1.526 18792 83 1 1 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.911 -2.423 18792 84 1 1 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.250 -4.091 18792 85 1 1 . 1 1 20 20 LYS H H 20 8.224 8.224 7.935 0.289 18792 86 1 1 . 1 1 21 21 LEU N N 21 118.092 118.092 120.667 -2.575 18792 87 1 1 . 1 1 21 21 LEU C C 21 179.989 179.989 178.781 1.208 18792 88 1 1 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.391 -0.265 18792 89 1 1 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.749 -2.141 18792 90 1 1 . 1 1 21 21 LEU H H 21 8.586 8.586 8.001 0.585 18792 91 1 1 . 1 1 22 22 SER N N 22 117.304 117.304 112.854 4.450 18792 92 1 1 . 1 1 22 22 SER C C 22 180.152 180.152 177.067 3.085 18792 93 1 1 . 1 1 22 22 SER CA C 22 61.287 61.287 60.350 0.937 18792 94 1 1 . 1 1 22 22 SER H H 22 8.266 8.266 7.680 0.586 18792 95 1 1 . 1 1 23 23 GLN N N 23 122.497 122.497 121.352 1.145 18792 96 1 1 . 1 1 23 23 GLN C C 23 177.297 177.297 177.733 -0.436 18792 97 1 1 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.389 -0.447 18792 98 1 1 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.738 -0.927 18792 99 1 1 . 1 1 23 23 GLN H H 23 7.571 7.571 7.881 -0.310 18792 100 1 1 . 1 1 24 24 LYS N N 24 116.038 116.038 116.645 -0.607 18792 101 1 1 . 1 1 24 24 LYS C C 24 175.704 175.704 177.417 -1.713 18792 102 1 1 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.729 -3.234 18792 103 1 1 . 1 1 24 24 LYS CB C 24 31.229 31.229 32.898 -1.669 18792 104 1 1 . 1 1 24 24 LYS H H 24 7.134 7.134 7.732 -0.598 18792 105 1 1 . 1 1 25 25 GLY N N 25 105.283 105.283 106.625 -1.342 18792 106 1 1 . 1 1 25 25 GLY C C 25 174.013 174.013 173.069 0.944 18792 107 1 1 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.387 0.392 18792 108 1 1 . 1 1 25 25 GLY H H 25 7.483 7.483 7.918 -0.435 18792 109 1 1 . 1 1 26 26 TYR N N 26 119.547 119.547 122.681 -3.134 18792 110 1 1 . 1 1 26 26 TYR C C 26 175.122 175.122 173.744 1.378 18792 111 1 1 . 1 1 26 26 TYR CA C 26 55.132 55.132 57.303 -2.171 18792 112 1 1 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.465 0.616 18792 113 1 1 . 1 1 26 26 TYR H H 26 7.788 7.788 7.667 0.121 18792 114 1 1 . 1 1 27 27 SER N N 27 115.088 115.088 122.221 -7.133 18792 115 1 1 . 1 1 27 27 SER C C 27 174.452 174.452 174.839 -0.387 18792 116 1 1 . 1 1 27 27 SER CA C 27 56.306 56.306 57.039 -0.734 18792 117 1 1 . 1 1 27 27 SER CB C 27 63.921 63.921 64.820 -0.899 18792 118 1 1 . 1 1 27 27 SER H H 27 8.473 8.473 8.473 -0.000 18792 119 1 1 . 1 1 28 28 TRP N N 28 127.014 127.014 125.985 1.029 18792 120 1 1 . 1 1 28 28 TRP C C 28 177.002 177.002 177.598 -0.596 18792 121 1 1 . 1 1 28 28 TRP CA C 28 59.472 59.472 60.209 -0.737 18792 122 1 1 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.103 0.727 18792 123 1 1 . 1 1 28 28 TRP H H 28 8.897 8.897 9.254 -0.357 18792 124 1 1 . 1 1 29 29 SER N N 29 112.044 112.044 113.931 -1.887 18792 125 1 1 . 1 1 29 29 SER C C 29 175.106 175.106 174.323 0.783 18792 126 1 1 . 1 1 29 29 SER CA C 29 59.472 59.472 58.404 1.069 18792 127 1 1 . 1 1 29 29 SER CB C 29 62.226 62.226 62.249 -0.023 18792 128 1 1 . 1 1 29 29 SER H H 29 8.129 8.129 8.217 -0.088 18792 129 1 1 . 1 1 30 30 GLN N N 30 119.160 119.160 120.311 -1.151 18792 130 1 1 . 1 1 30 30 GLN C C 30 176.218 176.218 175.712 0.506 18792 131 1 1 . 1 1 30 30 GLN CA C 30 56.412 56.412 56.961 -0.549 18792 132 1 1 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.941 -1.363 18792 133 1 1 . 1 1 30 30 GLN H H 30 7.370 7.370 7.466 -0.096 18792 134 1 1 . 1 1 31 31 PHE N N 31 116.277 116.277 114.981 1.296 18792 135 1 1 . 1 1 31 31 PHE C C 31 175.217 175.217 175.718 -0.501 18792 136 1 1 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.211 -1.977 18792 137 1 1 . 1 1 31 31 PHE CB C 31 39.066 39.066 36.196 2.870 18792 138 1 1 . 1 1 31 31 PHE H H 31 7.248 7.248 7.159 0.089 18792 139 1 1 . 1 1 32 32 SER N N 32 113.683 113.683 117.808 -4.125 18792 140 1 1 . 1 1 32 32 SER C C 32 173.793 173.793 174.717 -0.924 18792 141 1 1 . 1 1 32 32 SER CA C 32 57.124 57.124 59.588 -2.464 18792 142 1 1 . 1 1 32 32 SER CB C 32 63.081 63.081 62.156 0.926 18792 143 1 1 . 1 1 32 32 SER H H 32 7.242 7.242 8.253 -1.011 18792 144 1 1 . 1 1 33 33 ASP N N 33 122.195 122.195 120.571 1.624 18792 145 1 1 . 1 1 33 33 ASP C C 33 176.394 176.394 175.533 0.861 18792 146 1 1 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.169 -1.421 18792 147 1 1 . 1 1 33 33 ASP CB C 33 40.398 40.398 39.082 1.316 18792 148 1 1 . 1 1 33 33 ASP H H 33 8.257 8.257 8.387 -0.130 18792 149 1 1 . 1 1 34 34 VAL N N 34 118.913 118.913 114.961 3.952 18792 150 1 1 . 1 1 34 34 VAL C C 34 176.328 176.328 175.151 1.177 18792 151 1 1 . 1 1 34 34 VAL CA C 34 61.891 61.891 63.487 -1.597 18792 152 1 1 . 1 1 34 34 VAL CB C 34 32.015 32.015 30.473 1.542 18792 153 1 1 . 1 1 34 34 VAL H H 34 7.852 7.852 7.911 -0.059 18792 154 1 1 . 1 1 35 35 GLU N N 35 124.205 124.205 120.217 3.988 18792 155 1 1 . 1 1 35 35 GLU C C 35 176.586 176.586 176.547 0.039 18792 156 1 1 . 1 1 35 35 GLU CA C 35 56.057 56.057 56.437 -0.380 18792 157 1 1 . 1 1 35 35 GLU CB C 35 28.898 28.898 30.627 -1.729 18792 158 1 1 . 1 1 35 35 GLU H H 35 8.401 8.401 8.198 0.203 18792 159 1 1 . 1 1 36 36 GLU N N 36 121.670 121.670 123.530 -1.860 18792 160 1 1 . 1 1 36 36 GLU C C 36 176.218 176.218 175.642 0.576 18792 161 1 1 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.906 -0.918 18792 162 1 1 . 1 1 36 36 GLU CB C 36 29.442 29.442 31.336 -1.894 18792 163 1 1 . 1 1 36 36 GLU H H 36 8.239 8.239 8.815 -0.576 18792 164 1 1 . 1 1 37 37 ASN N N 37 119.252 119.252 117.968 1.284 18792 165 1 1 . 1 1 37 37 ASN C C 37 175.003 175.003 173.830 1.173 18792 166 1 1 . 1 1 37 37 ASN CA C 37 52.655 52.655 54.256 -1.601 18792 167 1 1 . 1 1 37 37 ASN CB C 37 38.212 38.212 38.627 -0.415 18792 168 1 1 . 1 1 37 37 ASN H H 37 8.412 8.412 8.646 -0.234 18792 169 1 1 . 1 1 38 38 ARG N N 38 121.622 121.622 122.125 -0.503 18792 170 1 1 . 1 1 38 38 ARG C C 38 176.610 176.610 175.065 1.545 18792 171 1 1 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.009 -0.645 18792 172 1 1 . 1 1 38 38 ARG CB C 38 29.419 29.419 30.901 -1.482 18792 173 1 1 . 1 1 38 38 ARG H H 38 8.227 8.227 8.454 -0.227 18792 174 1 1 . 1 1 39 39 THR N N 39 115.681 115.681 115.101 0.580 18792 175 1 1 . 1 1 39 39 THR C C 39 174.500 174.500 173.813 0.687 18792 176 1 1 . 1 1 39 39 THR CA C 39 61.606 61.606 62.030 -0.424 18792 177 1 1 . 1 1 39 39 THR CB C 39 69.163 69.163 69.660 -0.497 18792 178 1 1 . 1 1 39 39 THR H H 39 8.173 8.173 8.013 0.160 18792 179 1 1 . 1 1 40 40 GLU N N 40 122.708 122.708 119.764 2.944 18792 180 1 1 . 1 1 40 40 GLU C C 40 175.728 175.728 175.672 0.056 18792 181 1 1 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.435 -0.664 18792 182 1 1 . 1 1 40 40 GLU CB C 40 29.054 29.054 28.562 0.492 18792 183 1 1 . 1 1 40 40 GLU H H 40 8.298 8.298 8.540 -0.242 18792 184 1 1 . 1 1 41 41 ALA N N 41 125.922 125.922 123.683 2.239 18792 185 1 1 . 1 1 41 41 ALA C C 41 175.557 175.557 176.179 -0.622 18792 186 1 1 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.518 -1.545 18792 187 1 1 . 1 1 41 41 ALA CB C 41 17.245 17.245 19.075 -1.830 18792 188 1 1 . 1 1 41 41 ALA H H 41 8.212 8.212 8.092 0.120 18792 189 1 1 . 1 1 43 43 GLU N N 43 120.783 120.783 114.153 6.630 18792 190 1 1 . 1 1 43 43 GLU C C 43 177.174 177.174 177.329 -0.155 18792 191 1 1 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.790 -0.449 18792 192 1 1 . 1 1 43 43 GLU CB C 43 29.287 29.287 27.409 1.879 18792 193 1 1 . 1 1 43 43 GLU H H 43 8.519 8.519 8.573 -0.054 18792 194 1 1 . 1 1 44 44 GLY N N 44 110.022 110.022 106.969 3.053 18792 195 1 1 . 1 1 44 44 GLY C C 44 174.773 174.773 174.537 0.236 18792 196 1 1 . 1 1 44 44 GLY CA C 44 45.028 45.028 46.471 -1.443 18792 197 1 1 . 1 1 44 44 GLY H H 44 8.429 8.429 8.884 -0.456 18792 198 1 1 . 1 1 45 45 THR N N 45 112.790 112.790 112.314 0.476 18792 199 1 1 . 1 1 45 45 THR C C 45 175.726 175.726 174.868 0.858 18792 200 1 1 . 1 1 45 45 THR CA C 45 61.987 61.987 61.913 0.074 18792 201 1 1 . 1 1 45 45 THR CB C 45 69.304 69.304 69.444 -0.140 18792 202 1 1 . 1 1 45 45 THR H H 45 8.125 8.125 7.956 0.169 18792 203 1 1 . 1 1 46 46 GLU N N 46 122.752 122.752 120.661 2.091 18792 204 1 1 . 1 1 46 46 GLU C C 46 177.419 177.419 175.882 1.537 18792 205 1 1 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.574 0.657 18792 206 1 1 . 1 1 46 46 GLU CB C 46 28.199 28.199 31.060 -2.861 18792 207 1 1 . 1 1 46 46 GLU H H 46 8.765 8.765 8.164 0.601 18792 208 1 1 . 1 1 47 47 SER N N 47 114.895 114.895 113.953 0.942 18792 209 1 1 . 1 1 47 47 SER C C 47 175.826 175.826 174.980 0.846 18792 210 1 1 . 1 1 47 47 SER CA C 47 58.582 58.582 58.650 -0.068 18792 211 1 1 . 1 1 47 47 SER CB C 47 62.537 62.537 62.773 -0.236 18792 212 1 1 . 1 1 47 47 SER H H 47 8.355 8.355 8.179 0.176 18792 213 1 1 . 1 1 48 48 GLU N N 48 122.429 122.429 119.682 2.747 18792 214 1 1 . 1 1 48 48 GLU C C 48 178.099 178.099 177.625 0.474 18792 215 1 1 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.585 0.033 18792 216 1 1 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.197 -0.722 18792 217 1 1 . 1 1 48 48 GLU H H 48 8.139 8.139 8.529 -0.390 18792 218 1 1 . 1 1 49 49 ALA N N 49 120.374 120.374 122.657 -2.283 18792 219 1 1 . 1 1 49 49 ALA C C 49 180.843 180.843 179.368 1.475 18792 220 1 1 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.109 -0.626 18792 221 1 1 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.043 -0.608 18792 222 1 1 . 1 1 49 49 ALA H H 49 8.079 8.079 8.216 -0.137 18792 223 1 1 . 1 1 50 50 VAL N N 50 118.599 118.599 118.994 -0.395 18792 224 1 1 . 1 1 50 50 VAL C C 50 176.921 176.921 177.506 -0.585 18792 225 1 1 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.572 -0.012 18792 226 1 1 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.855 -0.558 18792 227 1 1 . 1 1 50 50 VAL H H 50 7.419 7.419 7.831 -0.412 18792 228 1 1 . 1 1 51 51 LYS N N 51 117.469 117.469 120.991 -3.522 18792 229 1 1 . 1 1 51 51 LYS C C 51 179.061 179.061 178.764 0.297 18792 230 1 1 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.520 -0.297 18792 231 1 1 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.756 -0.760 18792 232 1 1 . 1 1 51 51 LYS H H 51 7.359 7.359 7.740 -0.381 18792 233 1 1 . 1 1 52 52 GLN N N 52 115.930 115.930 118.146 -2.216 18792 234 1 1 . 1 1 52 52 GLN C C 52 177.713 177.713 178.014 -0.301 18792 235 1 1 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.790 -0.314 18792 236 1 1 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.738 -2.170 18792 237 1 1 . 1 1 52 52 GLN H H 52 8.025 8.025 8.230 -0.205 18792 238 1 1 . 1 1 53 53 ALA N N 53 119.782 119.782 122.796 -3.014 18792 239 1 1 . 1 1 53 53 ALA C C 53 180.008 180.008 179.671 0.337 18792 240 1 1 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.741 -0.356 18792 241 1 1 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.388 -0.873 18792 242 1 1 . 1 1 53 53 ALA H H 53 7.655 7.655 7.814 -0.159 18792 243 1 1 . 1 1 54 54 LEU N N 54 120.443 120.443 119.301 1.142 18792 244 1 1 . 1 1 54 54 LEU C C 54 179.330 179.330 178.598 0.732 18792 245 1 1 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.910 1.103 18792 246 1 1 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.780 -0.918 18792 247 1 1 . 1 1 54 54 LEU H H 54 8.419 8.419 8.260 0.159 18792 248 1 1 . 1 1 55 55 ARG N N 55 118.423 118.423 120.108 -1.685 18792 249 1 1 . 1 1 55 55 ARG C C 55 178.767 178.767 178.686 0.081 18792 250 1 1 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.576 0.821 18792 251 1 1 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.968 -1.226 18792 252 1 1 . 1 1 55 55 ARG H H 55 8.062 8.062 8.037 0.025 18792 253 1 1 . 1 1 56 56 GLU N N 56 115.988 115.988 118.306 -2.318 18792 254 1 1 . 1 1 56 56 GLU C C 56 180.090 180.090 178.584 1.506 18792 255 1 1 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.582 -0.822 18792 256 1 1 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.584 -1.230 18792 257 1 1 . 1 1 56 56 GLU H H 56 7.772 7.772 8.412 -0.640 18792 258 1 1 . 1 1 57 57 ALA N N 57 122.837 122.837 121.875 0.962 18792 259 1 1 . 1 1 57 57 ALA C C 57 181.861 181.861 179.958 1.903 18792 260 1 1 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.892 -0.258 18792 261 1 1 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.800 -0.327 18792 262 1 1 . 1 1 57 57 ALA H H 57 8.774 8.774 7.952 0.822 18792 263 1 1 . 1 1 58 58 GLY N N 58 108.409 108.409 106.313 2.096 18792 264 1 1 . 1 1 58 58 GLY C C 58 175.331 175.331 175.764 -0.433 18792 265 1 1 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.668 -0.000 18792 266 1 1 . 1 1 58 58 GLY H H 58 9.073 9.073 8.498 0.575 18792 267 1 1 . 1 1 59 59 ASP N N 59 122.074 122.074 122.182 -0.108 18792 268 1 1 . 1 1 59 59 ASP C C 59 179.023 179.023 178.136 0.887 18792 269 1 1 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.632 -0.330 18792 270 1 1 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.250 -2.408 18792 271 1 1 . 1 1 59 59 ASP H H 59 8.049 8.049 8.151 -0.102 18792 272 1 1 . 1 1 60 60 GLU N N 60 120.131 120.131 119.920 0.211 18792 273 1 1 . 1 1 60 60 GLU C C 60 178.522 178.522 178.871 -0.349 18792 274 1 1 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.770 -0.762 18792 275 1 1 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.823 -1.624 18792 276 1 1 . 1 1 60 60 GLU H H 60 8.136 8.136 8.122 0.014 18792 277 1 1 . 1 1 61 61 PHE N N 61 121.309 121.309 120.280 1.029 18792 278 1 1 . 1 1 61 61 PHE C C 61 176.904 176.904 178.022 -1.118 18792 279 1 1 . 1 1 61 61 PHE CA C 61 61.322 61.322 60.993 0.329 18792 280 1 1 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.646 -1.037 18792 281 1 1 . 1 1 61 61 PHE H H 61 8.523 8.523 8.060 0.463 18792 282 1 1 . 1 1 62 62 GLU N N 62 115.971 115.971 119.953 -3.982 18792 283 1 1 . 1 1 62 62 GLU C C 62 177.713 177.713 177.993 -0.280 18792 284 1 1 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.732 -0.541 18792 285 1 1 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.194 -0.917 18792 286 1 1 . 1 1 62 62 GLU H H 62 7.969 7.969 8.265 -0.296 18792 287 1 1 . 1 1 63 63 LEU N N 63 116.703 116.703 117.085 -0.382 18792 288 1 1 . 1 1 63 63 LEU C C 63 178.963 178.963 179.337 -0.374 18792 289 1 1 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.753 -0.341 18792 290 1 1 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.297 -0.891 18792 291 1 1 . 1 1 63 63 LEU H H 63 7.347 7.347 8.086 -0.739 18792 292 1 1 . 1 1 64 64 ARG N N 64 117.453 117.453 115.476 1.977 18792 293 1 1 . 1 1 64 64 ARG C C 64 177.297 177.297 176.415 0.882 18792 294 1 1 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.644 0.693 18792 295 1 1 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.532 -1.935 18792 296 1 1 . 1 1 64 64 ARG H H 64 7.995 7.995 7.953 0.042 18792 297 1 1 . 1 1 65 65 TYR N N 65 118.956 118.956 120.368 -1.412 18792 298 1 1 . 1 1 65 65 TYR C C 65 175.278 175.278 174.184 1.094 18792 299 1 1 . 1 1 65 65 TYR CA C 65 55.701 55.701 56.951 -1.250 18792 300 1 1 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.979 -3.993 18792 301 1 1 . 1 1 65 65 TYR H H 65 7.909 7.909 7.996 -0.087 18792 302 1 1 . 1 1 66 66 ARG N N 66 119.438 119.438 120.199 -0.761 18792 303 1 1 . 1 1 66 66 ARG C C 66 178.424 178.424 177.248 1.176 18792 304 1 1 . 1 1 66 66 ARG CA C 66 58.476 58.476 57.213 1.263 18792 305 1 1 . 1 1 66 66 ARG CB C 66 28.821 28.821 29.893 -1.072 18792 306 1 1 . 1 1 66 66 ARG H H 66 7.244 7.244 8.394 -1.150 18792 307 1 1 . 1 1 67 67 ARG N N 67 118.936 118.936 120.464 -1.528 18792 308 1 1 . 1 1 67 67 ARG C C 67 177.542 177.542 177.357 0.185 18792 309 1 1 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.387 -1.943 18792 310 1 1 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.672 -1.551 18792 311 1 1 . 1 1 67 67 ARG H H 67 8.417 8.417 7.920 0.497 18792 312 1 1 . 1 1 68 68 ALA N N 68 121.797 121.797 121.294 0.503 18792 313 1 1 . 1 1 68 68 ALA C C 68 180.337 180.337 179.394 0.943 18792 314 1 1 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.209 -0.073 18792 315 1 1 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.165 -0.698 18792 316 1 1 . 1 1 68 68 ALA H H 68 7.827 7.827 7.591 0.236 18792 317 1 1 . 1 1 69 69 PHE N N 69 115.986 115.986 119.498 -3.512 18792 318 1 1 . 1 1 69 69 PHE C C 69 177.468 177.468 177.136 0.332 18792 319 1 1 . 1 1 69 69 PHE CA C 69 58.049 58.049 60.289 -2.240 18792 320 1 1 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.632 -1.033 18792 321 1 1 . 1 1 69 69 PHE H H 69 8.517 8.517 7.877 0.640 18792 322 1 1 . 1 1 70 70 SER N N 70 116.526 116.526 114.399 2.127 18792 323 1 1 . 1 1 70 70 SER C C 70 177.640 177.640 176.549 1.091 18792 324 1 1 . 1 1 70 70 SER CA C 70 61.073 61.073 61.139 -0.066 18792 325 1 1 . 1 1 70 70 SER CB C 70 61.993 61.993 62.781 -0.788 18792 326 1 1 . 1 1 70 70 SER H H 70 8.152 8.152 7.912 0.240 18792 327 1 1 . 1 1 71 71 ASP N N 71 121.181 121.181 122.783 -1.602 18792 328 1 1 . 1 1 71 71 ASP C C 71 178.546 178.546 178.218 0.328 18792 329 1 1 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.338 -0.890 18792 330 1 1 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.706 -1.475 18792 331 1 1 . 1 1 71 71 ASP H H 71 8.356 8.356 7.582 0.774 18792 332 1 1 . 1 1 72 72 LEU N N 72 120.747 120.747 119.936 0.811 18792 333 1 1 . 1 1 72 72 LEU C C 72 178.963 178.963 178.545 0.418 18792 334 1 1 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.327 -0.883 18792 335 1 1 . 1 1 72 72 LEU CB C 72 41.017 41.017 41.506 -0.489 18792 336 1 1 . 1 1 72 72 LEU H H 72 7.738 7.738 8.532 -0.794 18792 337 1 1 . 1 1 73 73 THR N N 73 109.432 109.432 112.921 -3.489 18792 338 1 1 . 1 1 73 73 THR C C 73 177.481 177.481 176.076 1.405 18792 339 1 1 . 1 1 73 73 THR CA C 73 65.128 65.128 65.197 -0.069 18792 340 1 1 . 1 1 73 73 THR CB C 73 67.720 67.720 68.283 -0.563 18792 341 1 1 . 1 1 73 73 THR H H 73 8.296 8.296 7.558 0.738 18792 342 1 1 . 1 1 74 74 SER N N 74 115.862 115.862 114.493 1.369 18792 343 1 1 . 1 1 74 74 SER C C 74 175.361 175.361 175.338 0.023 18792 344 1 1 . 1 1 74 74 SER CA C 74 60.112 60.112 60.401 -0.289 18792 345 1 1 . 1 1 74 74 SER CB C 74 62.537 62.537 63.163 -0.626 18792 346 1 1 . 1 1 74 74 SER H H 74 7.629 7.629 8.066 -0.437 18792 347 1 1 . 1 1 75 75 GLN N N 75 118.551 118.551 118.295 0.256 18792 348 1 1 . 1 1 75 75 GLN C C 75 176.316 176.316 176.184 0.132 18792 349 1 1 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.872 -0.068 18792 350 1 1 . 1 1 75 75 GLN CB C 75 28.277 28.277 30.571 -2.294 18792 351 1 1 . 1 1 75 75 GLN H H 75 7.640 7.640 7.535 0.105 18792 352 1 1 . 1 1 76 76 LEU N N 76 118.313 118.313 119.824 -1.511 18792 353 1 1 . 1 1 76 76 LEU C C 76 174.160 174.160 176.933 -2.773 18792 354 1 1 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.092 -0.352 18792 355 1 1 . 1 1 76 76 LEU CB C 76 42.727 42.727 42.484 0.243 18792 356 1 1 . 1 1 76 76 LEU H H 76 7.411 7.411 7.733 -0.322 18792 357 1 1 . 1 1 77 77 HIS N N 77 120.104 120.104 120.340 -0.236 18792 358 1 1 . 1 1 77 77 HIS C C 77 174.528 174.528 175.386 -0.858 18792 359 1 1 . 1 1 77 77 HIS CA C 77 54.207 54.207 59.629 -5.422 18792 360 1 1 . 1 1 77 77 HIS CB C 77 27.966 27.966 30.644 -2.678 18792 361 1 1 . 1 1 77 77 HIS H H 77 8.117 8.117 8.198 -0.081 18792 362 1 1 . 1 1 78 78 ILE N N 78 122.298 122.298 114.969 7.329 18792 363 1 1 . 1 1 78 78 ILE C C 78 174.240 174.240 173.988 0.252 18792 364 1 1 . 1 1 78 78 ILE CA C 78 61.402 61.402 61.751 -0.348 18792 365 1 1 . 1 1 78 78 ILE CB C 78 37.591 37.591 40.057 -2.466 18792 366 1 1 . 1 1 78 78 ILE H H 78 8.655 8.655 7.735 0.920 18792 367 1 1 . 1 1 79 79 THR N N 79 116.442 116.442 119.582 -3.140 18792 368 1 1 . 1 1 79 79 THR C C 79 174.291 174.291 174.139 0.152 18792 369 1 1 . 1 1 79 79 THR CA C 79 61.632 61.632 57.978 3.654 18792 370 1 1 . 1 1 79 79 THR CB C 79 68.704 68.704 69.456 -0.751 18792 371 1 1 . 1 1 79 79 THR H H 79 8.245 8.245 8.165 0.080 18792 372 1 1 . 1 1 84 84 TYR N N 84 120.888 120.888 120.884 0.004 18792 373 1 1 . 1 1 84 84 TYR C C 84 176.708 176.708 177.152 -0.444 18792 374 1 1 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.942 -1.510 18792 375 1 1 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.869 -2.124 18792 376 1 1 . 1 1 84 84 TYR H H 84 8.733 8.733 8.760 -0.027 18792 377 1 1 . 1 1 85 85 GLN N N 85 114.530 114.530 118.263 -3.733 18792 378 1 1 . 1 1 85 85 GLN C C 85 178.473 178.473 178.355 0.118 18792 379 1 1 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.721 -0.427 18792 380 1 1 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.483 -1.682 18792 381 1 1 . 1 1 85 85 GLN H H 85 8.413 8.413 8.944 -0.531 18792 382 1 1 . 1 1 86 86 SER N N 86 114.032 114.032 115.836 -1.804 18792 383 1 1 . 1 1 86 86 SER C C 86 178.473 178.473 176.329 2.144 18792 384 1 1 . 1 1 86 86 SER CA C 86 62.175 62.175 61.793 0.382 18792 385 1 1 . 1 1 86 86 SER CB C 86 63.252 63.252 62.809 0.443 18792 386 1 1 . 1 1 86 86 SER H H 86 7.258 7.258 7.810 -0.552 18792 387 1 1 . 1 1 88 88 GLU N N 88 119.386 119.386 119.330 0.056 18792 388 1 1 . 1 1 88 88 GLU C C 88 177.199 177.199 178.099 -0.900 18792 389 1 1 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.512 -0.930 18792 390 1 1 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.081 -0.105 18792 391 1 1 . 1 1 88 88 GLU H H 88 8.534 8.534 8.373 0.161 18792 392 1 1 . 1 1 89 89 GLN N N 89 114.678 114.678 119.150 -4.472 18792 393 1 1 . 1 1 89 89 GLN C C 89 178.669 178.669 178.226 0.443 18792 394 1 1 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.056 -0.474 18792 395 1 1 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.875 -1.453 18792 396 1 1 . 1 1 89 89 GLN H H 89 7.500 7.500 7.578 -0.078 18792 397 1 1 . 1 1 90 90 VAL N N 90 118.174 118.174 117.068 1.106 18792 398 1 1 . 1 1 90 90 VAL C C 90 178.081 178.081 177.675 0.406 18792 399 1 1 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.696 -0.141 18792 400 1 1 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.231 0.376 18792 401 1 1 . 1 1 90 90 VAL H H 90 7.017 7.017 7.574 -0.557 18792 402 1 1 . 1 1 91 91 VAL N N 91 119.489 119.489 121.620 -2.131 18792 403 1 1 . 1 1 91 91 VAL C C 91 177.914 177.914 177.834 0.080 18792 404 1 1 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.134 -0.365 18792 405 1 1 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.429 -0.138 18792 406 1 1 . 1 1 91 91 VAL H H 91 7.833 7.833 7.721 0.112 18792 407 1 1 . 1 1 92 92 ASN N N 92 117.180 117.180 118.186 -1.006 18792 408 1 1 . 1 1 92 92 ASN C C 92 179.110 179.110 176.726 2.384 18792 409 1 1 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.648 -1.730 18792 410 1 1 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.664 -2.696 18792 411 1 1 . 1 1 92 92 ASN H H 92 8.368 8.368 8.252 0.116 18792 412 1 1 . 1 1 93 93 GLU N N 93 118.476 118.476 119.171 -0.695 18792 413 1 1 . 1 1 93 93 GLU C C 93 179.355 179.355 179.376 -0.021 18792 414 1 1 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.826 -0.421 18792 415 1 1 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.895 -2.162 18792 416 1 1 . 1 1 93 93 GLU H H 93 7.213 7.213 7.629 -0.416 18792 417 1 1 . 1 1 94 94 LEU N N 94 120.889 120.889 120.483 0.406 18792 418 1 1 . 1 1 94 94 LEU C C 94 178.473 178.473 178.470 0.003 18792 419 1 1 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.024 -0.007 18792 420 1 1 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.041 -2.111 18792 421 1 1 . 1 1 94 94 LEU H H 94 7.446 7.446 7.726 -0.280 18792 422 1 1 . 1 1 95 95 PHE N N 95 112.902 112.902 117.005 -4.103 18792 423 1 1 . 1 1 95 95 PHE C C 95 176.586 176.586 176.628 -0.042 18792 424 1 1 . 1 1 95 95 PHE CA C 95 57.159 57.159 58.578 -1.419 18792 425 1 1 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.092 -0.871 18792 426 1 1 . 1 1 95 95 PHE H H 95 6.916 6.916 8.240 -1.324 18792 427 1 1 . 1 1 96 96 ARG N N 96 123.729 123.729 119.038 4.691 18792 428 1 1 . 1 1 96 96 ARG C C 96 177.272 177.272 176.412 0.860 18792 429 1 1 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.095 1.128 18792 430 1 1 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.547 -2.115 18792 431 1 1 . 1 1 96 96 ARG H H 96 7.126 7.126 7.340 -0.214 18792 432 1 1 . 1 1 97 97 ASP N N 97 116.576 116.576 115.416 1.160 18792 433 1 1 . 1 1 97 97 ASP C C 97 175.687 175.687 174.166 1.521 18792 434 1 1 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.255 -0.582 18792 435 1 1 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.195 -3.150 18792 436 1 1 . 1 1 97 97 ASP H H 97 8.644 8.644 7.561 1.083 18792 437 1 1 . 1 1 98 98 GLY N N 98 108.551 108.551 106.062 2.489 18792 438 1 1 . 1 1 98 98 GLY C C 98 172.690 172.690 171.340 1.350 18792 439 1 1 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.382 -2.132 18792 440 1 1 . 1 1 98 98 GLY H H 98 7.463 7.463 7.424 0.039 18792 441 1 1 . 1 1 99 99 VAL N N 99 120.630 120.630 122.602 -1.972 18792 442 1 1 . 1 1 99 99 VAL C C 99 174.503 174.503 174.811 -0.308 18792 443 1 1 . 1 1 99 99 VAL CA C 99 62.318 62.318 60.353 1.964 18792 444 1 1 . 1 1 99 99 VAL CB C 99 30.763 30.763 34.490 -3.727 18792 445 1 1 . 1 1 99 99 VAL H H 99 8.184 8.184 7.052 1.132 18792 446 1 1 . 1 1 100 100 ASN N N 100 115.485 115.485 125.989 -10.504 18792 447 1 1 . 1 1 100 100 ASN C C 100 175.239 175.239 176.345 -1.106 18792 448 1 1 . 1 1 100 100 ASN CA C 100 51.361 51.361 56.046 -4.685 18792 449 1 1 . 1 1 100 100 ASN CB C 100 38.920 38.920 36.905 2.015 18792 450 1 1 . 1 1 100 100 ASN H H 100 6.241 6.241 8.708 -2.467 18792 451 1 1 . 1 1 101 101 TRP N N 101 118.266 118.266 119.867 -1.601 18792 452 1 1 . 1 1 101 101 TRP C C 101 178.301 178.301 176.865 1.436 18792 453 1 1 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.723 0.816 18792 454 1 1 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.838 0.992 18792 455 1 1 . 1 1 101 101 TRP H H 101 8.409 8.409 7.671 0.738 18792 456 1 1 . 1 1 102 102 GLY N N 102 106.147 106.147 105.214 0.933 18792 457 1 1 . 1 1 102 102 GLY C C 102 177.640 177.640 175.569 2.071 18792 458 1 1 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.861 2.053 18792 459 1 1 . 1 1 102 102 GLY H H 102 8.504 8.504 7.561 0.943 18792 460 1 1 . 1 1 103 103 ARG N N 103 121.347 121.347 121.086 0.261 18792 461 1 1 . 1 1 103 103 ARG C C 103 177.738 177.738 177.633 0.105 18792 462 1 1 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.686 -0.744 18792 463 1 1 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.110 0.109 18792 464 1 1 . 1 1 103 103 ARG H H 103 8.099 8.099 7.932 0.167 18792 465 1 1 . 1 1 104 104 ILE N N 104 120.930 120.930 120.072 0.858 18792 466 1 1 . 1 1 104 104 ILE C C 104 178.197 178.197 177.281 0.916 18792 467 1 1 . 1 1 104 104 ILE CA C 104 66.535 66.535 63.570 2.965 18792 468 1 1 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.000 -1.955 18792 469 1 1 . 1 1 104 104 ILE H H 104 7.690 7.690 7.668 0.022 18792 470 1 1 . 1 1 105 105 VAL N N 105 120.938 120.938 118.946 1.992 18792 471 1 1 . 1 1 105 105 VAL C C 105 177.854 177.854 178.032 -0.178 18792 472 1 1 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.256 1.202 18792 473 1 1 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.602 -0.228 18792 474 1 1 . 1 1 105 105 VAL H H 105 8.245 8.245 8.080 0.165 18792 475 1 1 . 1 1 106 106 ALA N N 106 121.165 121.165 121.272 -0.107 18792 476 1 1 . 1 1 106 106 ALA C C 106 178.284 178.284 179.436 -1.152 18792 477 1 1 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.074 0.524 18792 478 1 1 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.615 -1.100 18792 479 1 1 . 1 1 106 106 ALA H H 106 7.529 7.529 7.415 0.114 18792 480 1 1 . 1 1 107 107 PHE N N 107 119.242 119.242 119.801 -0.559 18792 481 1 1 . 1 1 107 107 PHE C C 107 176.390 176.390 177.227 -0.837 18792 482 1 1 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.181 -0.008 18792 483 1 1 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.552 -1.465 18792 484 1 1 . 1 1 107 107 PHE H H 107 7.974 7.974 7.232 0.742 18792 485 1 1 . 1 1 108 108 PHE N N 108 120.009 120.009 115.885 4.124 18792 486 1 1 . 1 1 108 108 PHE C C 108 177.640 177.640 177.656 -0.016 18792 487 1 1 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.517 0.907 18792 488 1 1 . 1 1 108 108 PHE CB C 108 35.346 35.346 37.074 -1.728 18792 489 1 1 . 1 1 108 108 PHE H H 108 7.946 7.946 7.527 0.419 18792 490 1 1 . 1 1 109 109 SER N N 109 114.631 114.631 116.266 -1.635 18792 491 1 1 . 1 1 109 109 SER C C 109 177.770 177.770 176.494 1.276 18792 492 1 1 . 1 1 109 109 SER CA C 109 63.349 63.349 61.860 1.489 18792 493 1 1 . 1 1 109 109 SER H H 109 8.424 8.424 7.606 0.818 18792 494 1 1 . 1 1 110 110 PHE N N 110 124.230 124.230 124.876 -0.646 18792 495 1 1 . 1 1 110 110 PHE C C 110 176.708 176.708 177.458 -0.750 18792 496 1 1 . 1 1 110 110 PHE CA C 110 59.614 59.614 60.148 -0.534 18792 497 1 1 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.922 -1.478 18792 498 1 1 . 1 1 110 110 PHE H H 110 9.052 9.052 8.110 0.942 18792 499 1 1 . 1 1 111 111 GLY N N 111 105.893 105.893 106.502 -0.609 18792 500 1 1 . 1 1 111 111 GLY C C 111 176.795 176.795 176.088 0.707 18792 501 1 1 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.618 0.758 18792 502 1 1 . 1 1 111 111 GLY H H 111 7.926 7.926 8.896 -0.970 18792 503 1 1 . 1 1 112 112 GLY N N 112 107.410 107.410 109.524 -2.114 18792 504 1 1 . 1 1 112 112 GLY C C 112 174.650 174.650 175.479 -0.829 18792 505 1 1 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.422 0.883 18792 506 1 1 . 1 1 112 112 GLY H H 112 8.799 8.799 8.275 0.524 18792 507 1 1 . 1 1 113 113 ALA N N 113 124.313 124.313 124.829 -0.516 18792 508 1 1 . 1 1 113 113 ALA C C 113 181.300 181.300 178.961 2.339 18792 509 1 1 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.843 -0.316 18792 510 1 1 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.806 -1.323 18792 511 1 1 . 1 1 113 113 ALA H H 113 8.212 8.212 8.240 -0.028 18792 512 1 1 . 1 1 114 114 LEU N N 114 118.878 118.878 119.718 -0.840 18792 513 1 1 . 1 1 114 114 LEU C C 114 180.286 180.286 178.831 1.455 18792 514 1 1 . 1 1 114 114 LEU CA C 114 56.982 56.982 58.026 -1.044 18792 515 1 1 . 1 1 114 114 LEU CB C 114 41.017 41.017 42.166 -1.149 18792 516 1 1 . 1 1 114 114 LEU H H 114 8.161 8.161 8.144 0.017 18792 517 1 1 . 1 1 115 115 CYS N N 115 119.002 119.002 118.852 0.150 18792 518 1 1 . 1 1 115 115 CYS C C 115 176.087 176.087 176.889 -0.802 18792 519 1 1 . 1 1 115 115 CYS CA C 115 63.944 63.944 62.505 1.440 18792 520 1 1 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.717 -2.082 18792 521 1 1 . 1 1 115 115 CYS H H 115 8.070 8.070 8.026 0.044 18792 522 1 1 . 1 1 116 116 VAL N N 116 118.737 118.737 117.143 1.594 18792 523 1 1 . 1 1 116 116 VAL C C 116 177.494 177.494 177.771 -0.277 18792 524 1 1 . 1 1 116 116 VAL CA C 116 66.762 66.762 65.745 1.017 18792 525 1 1 . 1 1 116 116 VAL CB C 116 30.763 30.763 30.691 0.072 18792 526 1 1 . 1 1 116 116 VAL H H 116 7.995 7.995 7.899 0.096 18792 527 1 1 . 1 1 117 117 GLU N N 117 118.886 118.886 120.090 -1.204 18792 528 1 1 . 1 1 117 117 GLU C C 117 178.424 178.424 179.074 -0.650 18792 529 1 1 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.128 -0.368 18792 530 1 1 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.524 -1.470 18792 531 1 1 . 1 1 117 117 GLU H H 117 8.059 8.059 8.168 -0.109 18792 532 1 1 . 1 1 118 118 SER N N 118 113.417 113.417 115.967 -2.550 18792 533 1 1 . 1 1 118 118 SER C C 118 175.607 175.607 176.762 -1.155 18792 534 1 1 . 1 1 118 118 SER CA C 118 62.638 62.638 61.647 0.991 18792 535 1 1 . 1 1 118 118 SER CB C 118 61.061 61.061 63.128 -2.067 18792 536 1 1 . 1 1 118 118 SER H H 118 7.626 7.626 7.895 -0.269 18792 537 1 1 . 1 1 119 119 VAL N N 119 120.612 120.612 118.413 2.199 18792 538 1 1 . 1 1 119 119 VAL C C 119 179.713 179.713 178.169 1.544 18792 539 1 1 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.759 0.466 18792 540 1 1 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.541 -1.462 18792 541 1 1 . 1 1 119 119 VAL H H 119 7.297 7.297 7.907 -0.610 18792 542 1 1 . 1 1 120 120 ASP N N 120 122.546 122.546 120.507 2.039 18792 543 1 1 . 1 1 120 120 ASP C C 120 178.057 178.057 177.359 0.698 18792 544 1 1 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.294 0.695 18792 545 1 1 . 1 1 120 120 ASP CB C 120 39.923 39.923 41.056 -1.133 18792 546 1 1 . 1 1 120 120 ASP H H 120 8.264 8.264 7.912 0.352 18792 547 1 1 . 1 1 121 121 LYS N N 121 115.636 115.636 118.346 -2.710 18792 548 1 1 . 1 1 121 121 LYS C C 121 175.159 175.159 175.504 -0.345 18792 549 1 1 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.327 -1.067 18792 550 1 1 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.729 -1.954 18792 551 1 1 . 1 1 121 121 LYS H H 121 7.558 7.558 7.373 0.185 18792 552 1 1 . 1 1 122 122 GLU N N 122 113.915 113.915 113.456 0.459 18792 553 1 1 . 1 1 122 122 GLU C C 122 176.109 176.109 176.310 -0.201 18792 554 1 1 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.008 -0.701 18792 555 1 1 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.830 -2.498 18792 556 1 1 . 1 1 122 122 GLU H H 122 7.826 7.826 7.774 0.052 18792 557 1 1 . 1 1 124 124 GLN N N 124 119.233 119.233 121.509 -2.276 18792 558 1 1 . 1 1 124 124 GLN C C 124 177.640 177.640 177.650 -0.010 18792 559 1 1 . 1 1 124 124 GLN CA C 124 59.472 59.472 59.398 0.074 18792 560 1 1 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.022 -1.532 18792 561 1 1 . 1 1 124 124 GLN H H 124 8.626 8.626 8.554 0.072 18792 562 1 1 . 1 1 125 125 VAL N N 125 117.011 117.011 114.710 2.301 18792 563 1 1 . 1 1 125 125 VAL C C 125 175.826 175.826 176.650 -0.824 18792 564 1 1 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.797 -1.661 18792 565 1 1 . 1 1 125 125 VAL CB C 125 30.297 30.297 30.637 -0.340 18792 566 1 1 . 1 1 125 125 VAL H H 125 7.870 7.870 8.110 -0.240 18792 567 1 1 . 1 1 126 126 LEU N N 126 117.058 117.058 116.089 0.969 18792 568 1 1 . 1 1 126 126 LEU C C 126 178.096 178.096 178.361 -0.265 18792 569 1 1 . 1 1 126 126 LEU CA C 126 55.085 55.085 56.989 -1.904 18792 570 1 1 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.470 -2.197 18792 571 1 1 . 1 1 126 126 LEU H H 126 7.747 7.747 7.802 -0.055 18792 572 1 1 . 1 1 127 127 VAL N N 127 119.457 119.457 121.665 -2.208 18792 573 1 1 . 1 1 127 127 VAL C C 127 177.150 177.150 178.124 -0.974 18792 574 1 1 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.629 0.527 18792 575 1 1 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.244 -0.490 18792 576 1 1 . 1 1 127 127 VAL H H 127 7.306 7.306 8.231 -0.925 18792 577 1 1 . 1 1 128 128 SER N N 128 110.647 110.647 114.480 -3.833 18792 578 1 1 . 1 1 128 128 SER C C 128 177.222 177.222 176.602 0.620 18792 579 1 1 . 1 1 128 128 SER CA C 128 60.752 60.752 61.261 -0.509 18792 580 1 1 . 1 1 128 128 SER CB C 128 61.605 61.605 62.910 -1.305 18792 581 1 1 . 1 1 128 128 SER H H 128 8.237 8.237 7.950 0.287 18792 582 1 1 . 1 1 129 129 ARG N N 129 123.100 123.100 122.137 0.963 18792 583 1 1 . 1 1 129 129 ARG C C 129 175.802 175.802 178.634 -2.832 18792 584 1 1 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.900 -0.673 18792 585 1 1 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.015 -1.816 18792 586 1 1 . 1 1 129 129 ARG H H 129 6.564 6.564 7.779 -1.215 18792 587 1 1 . 1 1 130 130 ILE N N 130 118.182 118.182 116.819 1.363 18792 588 1 1 . 1 1 130 130 ILE C C 130 178.156 178.156 177.663 0.493 18792 589 1 1 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.278 -0.932 18792 590 1 1 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.521 -0.839 18792 591 1 1 . 1 1 130 130 ILE H H 130 7.955 7.955 8.363 -0.408 18792 592 1 1 . 1 1 131 131 ALA N N 131 119.029 119.029 122.378 -3.349 18792 593 1 1 . 1 1 131 131 ALA C C 131 179.593 179.593 179.130 0.463 18792 594 1 1 . 1 1 131 131 ALA CA C 131 54.598 54.598 54.882 -0.284 18792 595 1 1 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.256 -0.868 18792 596 1 1 . 1 1 131 131 ALA H H 131 7.582 7.582 8.463 -0.881 18792 597 1 1 . 1 1 132 132 ALA N N 132 120.336 120.336 122.228 -1.892 18792 598 1 1 . 1 1 132 132 ALA C C 132 181.095 181.095 179.217 1.878 18792 599 1 1 . 1 1 132 132 ALA CA C 132 54.598 54.598 55.101 -0.503 18792 600 1 1 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.666 -1.965 18792 601 1 1 . 1 1 132 132 ALA H H 132 7.224 7.224 8.000 -0.776 18792 602 1 1 . 1 1 133 133 TRP N N 133 121.194 121.194 119.453 1.741 18792 603 1 1 . 1 1 133 133 TRP C C 133 179.698 179.698 178.114 1.584 18792 604 1 1 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.617 -3.315 18792 605 1 1 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.880 -2.225 18792 606 1 1 . 1 1 133 133 TRP H H 133 8.925 8.925 8.780 0.145 18792 607 1 1 . 1 1 134 134 MET N N 134 116.987 116.987 117.307 -0.320 18792 608 1 1 . 1 1 134 134 MET C C 134 178.277 178.277 178.186 0.091 18792 609 1 1 . 1 1 134 134 MET CA C 134 59.578 59.578 59.316 0.262 18792 610 1 1 . 1 1 134 134 MET CB C 134 33.559 33.559 32.644 0.915 18792 611 1 1 . 1 1 134 134 MET H H 134 8.863 8.863 8.488 0.375 18792 612 1 1 . 1 1 135 135 ALA N N 135 120.523 120.523 121.282 -0.759 18792 613 1 1 . 1 1 135 135 ALA C C 135 179.298 179.298 179.402 -0.104 18792 614 1 1 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.193 0.240 18792 615 1 1 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.154 -1.517 18792 616 1 1 . 1 1 135 135 ALA H H 135 8.152 8.152 8.345 -0.193 18792 617 1 1 . 1 1 136 136 THR N N 136 116.715 116.715 117.948 -1.233 18792 618 1 1 . 1 1 136 136 THR C C 136 175.106 175.106 176.386 -1.280 18792 619 1 1 . 1 1 136 136 THR CA C 136 66.729 66.729 66.878 -0.149 18792 620 1 1 . 1 1 136 136 THR CB C 136 68.441 68.441 68.998 -0.557 18792 621 1 1 . 1 1 136 136 THR H H 136 8.532 8.532 7.976 0.556 18792 622 1 1 . 1 1 137 137 TYR N N 137 123.204 123.204 122.392 0.812 18792 623 1 1 . 1 1 137 137 TYR C C 137 179.592 179.592 177.669 1.923 18792 624 1 1 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.524 1.541 18792 625 1 1 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.124 -0.137 18792 626 1 1 . 1 1 137 137 TYR H H 137 8.809 8.809 7.865 0.944 18792 627 1 1 . 1 1 138 138 LEU N N 138 119.247 119.247 120.610 -1.363 18792 628 1 1 . 1 1 138 138 LEU C C 138 178.385 178.385 178.288 0.097 18792 629 1 1 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.338 0.600 18792 630 1 1 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.103 -0.395 18792 631 1 1 . 1 1 138 138 LEU H H 138 8.742 8.742 8.344 0.398 18792 632 1 1 . 1 1 139 139 ASN N N 139 117.122 117.122 116.441 0.681 18792 633 1 1 . 1 1 139 139 ASN C C 139 176.417 176.417 177.018 -0.601 18792 634 1 1 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.532 0.916 18792 635 1 1 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.015 0.637 18792 636 1 1 . 1 1 139 139 ASN H H 139 8.307 8.307 8.085 0.222 18792 637 1 1 . 1 1 140 140 ASP N N 140 115.394 115.394 120.298 -4.904 18792 638 1 1 . 1 1 140 140 ASP C C 140 177.919 177.919 176.862 1.057 18792 639 1 1 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.710 -0.757 18792 640 1 1 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.025 -1.639 18792 641 1 1 . 1 1 140 140 ASP H H 140 8.439 8.439 8.261 0.178 18792 642 1 1 . 1 1 141 141 HIS N N 141 111.695 111.695 114.558 -2.863 18792 643 1 1 . 1 1 141 141 HIS C C 141 175.949 175.949 176.499 -0.550 18792 644 1 1 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.969 -0.913 18792 645 1 1 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.735 -2.827 18792 646 1 1 . 1 1 141 141 HIS H H 141 8.043 8.043 7.517 0.526 18792 647 1 1 . 1 1 142 142 LEU N N 142 117.054 117.054 122.466 -5.412 18792 648 1 1 . 1 1 142 142 LEU C C 142 176.530 176.530 178.100 -1.570 18792 649 1 1 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.608 -3.299 18792 650 1 1 . 1 1 142 142 LEU CB C 142 42.338 42.338 42.214 0.124 18792 651 1 1 . 1 1 142 142 LEU H H 142 7.198 7.198 8.408 -1.210 18792 652 1 1 . 1 1 143 143 GLU N N 143 121.335 121.335 120.007 1.328 18792 653 1 1 . 1 1 143 143 GLU C C 143 173.964 173.964 175.923 -1.959 18792 654 1 1 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.915 -0.661 18792 655 1 1 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.136 -1.879 18792 656 1 1 . 1 1 143 143 GLU H H 143 8.565 8.565 8.106 0.459 18792 657 1 1 . 1 1 145 145 TRP N N 145 117.973 117.973 120.104 -2.131 18792 658 1 1 . 1 1 145 145 TRP C C 145 179.526 179.526 177.444 2.082 18792 659 1 1 . 1 1 145 145 TRP CA C 145 61.606 61.606 59.604 2.002 18792 660 1 1 . 1 1 145 145 TRP CB C 145 27.888 27.888 30.051 -2.163 18792 661 1 1 . 1 1 145 145 TRP H H 145 7.078 7.078 8.385 -1.307 18792 662 1 1 . 1 1 146 146 ILE N N 146 122.101 122.101 111.577 10.524 18792 663 1 1 . 1 1 146 146 ILE C C 146 179.110 179.110 177.137 1.973 18792 664 1 1 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.283 4.051 18792 665 1 1 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.096 -1.274 18792 666 1 1 . 1 1 146 146 ILE H H 146 8.389 8.389 7.686 0.703 18792 667 1 1 . 1 1 147 147 GLN N N 147 116.344 116.344 120.672 -4.328 18792 668 1 1 . 1 1 147 147 GLN C C 147 179.526 179.526 178.003 1.523 18792 669 1 1 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.426 -0.413 18792 670 1 1 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.020 -1.298 18792 671 1 1 . 1 1 147 147 GLN H H 147 8.376 8.376 8.201 0.175 18792 672 1 1 . 1 1 148 148 GLU N N 148 118.913 118.913 121.376 -2.463 18792 673 1 1 . 1 1 148 148 GLU C C 148 176.880 176.880 178.069 -1.189 18792 674 1 1 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.638 -3.265 18792 675 1 1 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.501 -1.069 18792 676 1 1 . 1 1 148 148 GLU H H 148 7.504 7.504 8.114 -0.610 18792 677 1 1 . 1 1 149 149 ASN N N 149 116.616 116.616 114.009 2.607 18792 678 1 1 . 1 1 149 149 ASN C C 149 173.964 173.964 176.691 -2.727 18792 679 1 1 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.722 -0.476 18792 680 1 1 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.815 -2.682 18792 681 1 1 . 1 1 149 149 ASN H H 149 7.070 7.070 8.331 -1.261 18792 682 1 1 . 1 1 150 150 GLY N N 150 104.750 104.750 105.655 -0.905 18792 683 1 1 . 1 1 150 150 GLY C C 150 176.022 176.022 174.049 1.973 18792 684 1 1 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.734 -0.492 18792 685 1 1 . 1 1 150 150 GLY H H 150 7.313 7.313 8.087 -0.774 18792 686 1 1 . 1 1 151 151 GLY N N 151 108.385 108.385 108.437 -0.052 18792 687 1 1 . 1 1 151 151 GLY C C 151 173.449 173.449 174.842 -1.393 18792 688 1 1 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.868 -0.836 18792 689 1 1 . 1 1 151 151 GLY H H 151 8.452 8.452 7.534 0.918 18792 690 1 1 . 1 1 152 152 TRP N N 152 118.092 118.092 122.613 -4.521 18792 691 1 1 . 1 1 152 152 TRP C C 152 178.571 178.571 178.187 0.384 18792 692 1 1 . 1 1 152 152 TRP CA C 152 60.077 60.077 62.388 -2.311 18792 693 1 1 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.708 -1.120 18792 694 1 1 . 1 1 152 152 TRP H H 152 8.644 8.644 9.160 -0.516 18792 695 1 1 . 1 1 153 153 ASP N N 153 117.758 117.758 118.311 -0.553 18792 696 1 1 . 1 1 153 153 ASP C C 153 179.796 179.796 178.639 1.157 18792 697 1 1 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.404 -0.102 18792 698 1 1 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.840 -1.609 18792 699 1 1 . 1 1 153 153 ASP H H 153 8.827 8.827 8.404 0.423 18792 700 1 1 . 1 1 154 154 THR N N 154 116.817 116.817 118.045 -1.228 18792 701 1 1 . 1 1 154 154 THR C C 154 175.352 175.352 176.577 -1.225 18792 702 1 1 . 1 1 154 154 THR CA C 154 65.910 65.910 66.515 -0.605 18792 703 1 1 . 1 1 154 154 THR CB C 154 67.712 67.712 68.839 -1.127 18792 704 1 1 . 1 1 154 154 THR H H 154 7.494 7.494 7.593 -0.099 18792 705 1 1 . 1 1 155 155 PHE N N 155 122.196 122.196 121.284 0.912 18792 706 1 1 . 1 1 155 155 PHE C C 155 176.831 176.831 177.921 -1.090 18792 707 1 1 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.168 0.118 18792 708 1 1 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.344 -1.677 18792 709 1 1 . 1 1 155 155 PHE H H 155 6.477 6.477 8.646 -2.169 18792 710 1 1 . 1 1 156 156 VAL N N 156 117.387 117.387 118.078 -0.691 18792 711 1 1 . 1 1 156 156 VAL C C 156 178.497 178.497 177.808 0.689 18792 712 1 1 . 1 1 156 156 VAL CA C 156 66.231 66.231 65.491 0.740 18792 713 1 1 . 1 1 156 156 VAL CB C 156 30.685 30.685 30.976 -0.291 18792 714 1 1 . 1 1 156 156 VAL H H 156 7.788 7.788 7.945 -0.157 18792 715 1 1 . 1 1 157 157 GLU N N 157 119.876 119.876 119.597 0.279 18792 716 1 1 . 1 1 157 157 GLU C C 157 178.399 178.399 177.810 0.589 18792 717 1 1 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.734 0.026 18792 718 1 1 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.958 -1.681 18792 719 1 1 . 1 1 157 157 GLU H H 157 7.409 7.409 8.124 -0.715 18792 720 1 1 . 1 1 158 158 LEU N N 158 117.194 117.194 117.888 -0.694 18792 721 1 1 . 1 1 158 158 LEU C C 158 178.595 178.595 176.402 2.193 18792 722 1 1 . 1 1 158 158 LEU CA C 158 56.377 56.377 55.007 1.370 18792 723 1 1 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.361 0.210 18792 724 1 1 . 1 1 158 158 LEU H H 158 7.584 7.584 7.864 -0.280 18792 725 1 1 . 1 1 159 159 TYR N N 159 115.549 115.549 115.641 -0.092 18792 726 1 1 . 1 1 159 159 TYR C C 159 177.032 177.032 176.441 0.591 18792 727 1 1 . 1 1 159 159 TYR CA C 159 59.116 59.116 58.352 0.764 18792 728 1 1 . 1 1 159 159 TYR CB C 159 37.599 37.599 34.817 2.782 18792 729 1 1 . 1 1 159 159 TYR H H 159 8.099 8.099 7.255 0.844 18792 730 1 1 . 1 1 160 160 GLY N N 160 108.334 108.334 106.443 1.891 18792 731 1 1 . 1 1 160 160 GLY C C 160 173.973 173.973 173.916 0.057 18792 732 1 1 . 1 1 160 160 GLY CA C 160 45.064 45.064 45.689 -0.625 18792 733 1 1 . 1 1 160 160 GLY H H 160 8.020 8.020 8.554 -0.534 18792 734 1 1 . 1 1 161 161 ASN N N 161 118.189 118.189 119.566 -1.377 18792 735 1 1 . 1 1 161 161 ASN C C 161 175.513 175.513 174.510 1.003 18792 736 1 1 . 1 1 161 161 ASN CA C 161 53.104 53.104 52.719 0.385 18792 737 1 1 . 1 1 161 161 ASN CB C 161 38.203 38.203 38.820 -0.617 18792 738 1 1 . 1 1 161 161 ASN H H 161 8.327 8.327 7.895 0.432 18792 739 1 1 . 1 1 162 162 ASN N N 162 119.022 119.022 124.075 -5.053 18792 740 1 1 . 1 1 162 162 ASN C C 162 175.690 175.690 173.747 1.943 18792 741 1 1 . 1 1 162 162 ASN CA C 162 53.424 53.424 52.843 0.581 18792 742 1 1 . 1 1 162 162 ASN CB C 162 38.203 38.203 39.547 -1.344 18792 743 1 1 . 1 1 162 162 ASN H H 162 8.363 8.363 8.126 0.237 18792 744 1 1 . 1 1 163 163 ALA N N 163 123.275 123.275 124.162 -0.887 18792 745 1 1 . 1 1 163 163 ALA C C 163 178.598 178.598 178.023 0.575 18792 746 1 1 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.899 0.339 18792 747 1 1 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.829 -2.218 18792 748 1 1 . 1 1 163 163 ALA H H 163 8.103 8.103 8.204 -0.101 18792 749 1 1 . 1 1 164 164 ALA N N 164 121.521 121.521 121.859 -0.338 18792 750 1 1 . 1 1 164 164 ALA C C 164 178.642 178.642 178.867 -0.225 18792 751 1 1 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.226 -1.642 18792 752 1 1 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.184 -0.365 18792 753 1 1 . 1 1 164 164 ALA H H 164 8.053 8.053 8.534 -0.481 18792 754 1 1 . 1 1 165 165 ALA N N 165 122.101 122.101 120.645 1.456 18792 755 1 1 . 1 1 165 165 ALA C C 165 179.124 179.124 179.153 -0.029 18792 756 1 1 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.628 -1.489 18792 757 1 1 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.285 -0.307 18792 758 1 1 . 1 1 165 165 ALA H H 165 7.949 7.949 8.286 -0.337 18792 759 1 1 . 1 1 166 166 GLU N N 166 118.381 118.381 118.501 -0.120 18792 760 1 1 . 1 1 166 166 GLU C C 166 177.664 177.664 178.122 -0.458 18792 761 1 1 . 1 1 166 166 GLU CA C 166 57.088 57.088 58.464 -1.376 18792 762 1 1 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.285 -0.931 18792 763 1 1 . 1 1 166 166 GLU H H 166 8.202 8.202 8.292 -0.090 18792 764 1 1 . 1 1 167 167 SER N N 167 115.193 115.193 114.535 0.658 18792 765 1 1 . 1 1 167 167 SER C C 167 175.312 175.312 174.984 0.328 18792 766 1 1 . 1 1 167 167 SER CA C 167 58.831 58.831 59.491 -0.660 18792 767 1 1 . 1 1 167 167 SER CB C 167 62.537 62.537 63.488 -0.951 18792 768 1 1 . 1 1 167 167 SER H H 167 8.029 8.029 7.616 0.413 18792 769 1 1 . 1 1 168 168 ARG N N 168 121.696 121.696 117.613 4.083 18792 770 1 1 . 1 1 168 168 ARG C C 168 176.880 176.880 175.594 1.286 18792 771 1 1 . 1 1 168 168 ARG CA C 168 56.163 56.163 57.378 -1.215 18792 772 1 1 . 1 1 168 168 ARG CB C 168 29.209 29.209 28.310 0.899 18792 773 1 1 . 1 1 168 168 ARG H H 168 7.967 7.967 7.620 0.347 18792 774 1 1 . 1 1 169 169 LYS N N 169 120.917 120.917 118.086 2.831 18792 775 1 1 . 1 1 169 169 LYS C C 169 177.640 177.640 175.939 1.701 18792 776 1 1 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.023 0.673 18792 777 1 1 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.737 -1.275 18792 778 1 1 . 1 1 169 169 LYS H H 169 8.011 8.011 8.036 -0.025 18792 779 1 1 . 1 1 170 170 GLY N N 170 109.155 109.155 106.597 2.558 18792 780 1 1 . 1 1 170 170 GLY C C 170 174.479 174.479 174.476 0.003 18792 781 1 1 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.033 0.031 18792 782 1 1 . 1 1 170 170 GLY H H 170 8.329 8.329 8.559 -0.230 18792 783 1 1 . 1 1 171 171 GLN N N 171 119.292 119.292 119.868 -0.576 18792 784 1 1 . 1 1 171 171 GLN C C 171 176.463 176.463 176.435 0.028 18792 785 1 1 . 1 1 171 171 GLN CA C 171 55.666 55.666 54.777 0.889 18792 786 1 1 . 1 1 171 171 GLN CB C 171 28.199 28.199 29.301 -1.102 18792 787 1 1 . 1 1 171 171 GLN H H 171 8.035 8.035 7.706 0.329 18792 788 1 1 . 1 1 172 172 GLU N N 172 121.703 121.703 120.141 1.562 18792 789 1 1 . 1 1 172 172 GLU C C 172 176.414 176.414 177.005 -0.591 18792 790 1 1 . 1 1 172 172 GLU CA C 172 56.341 56.341 57.767 -1.426 18792 791 1 1 . 1 1 172 172 GLU CB C 172 28.821 28.821 29.800 -0.979 18792 792 1 1 . 1 1 172 172 GLU H H 172 8.405 8.405 8.527 -0.122 18792 793 1 1 . 1 1 173 173 ARG N N 173 121.852 121.852 117.595 4.257 18792 794 1 1 . 1 1 173 173 ARG C C 173 176.365 176.365 175.020 1.345 18792 795 1 1 . 1 1 173 173 ARG CA C 173 56.199 56.199 57.080 -0.881 18792 796 1 1 . 1 1 173 173 ARG CB C 173 29.131 29.131 30.203 -1.071 18792 797 1 1 . 1 1 173 173 ARG H H 173 8.335 8.335 7.832 0.503 18792 798 1 1 . 1 1 174 174 LEU N N 174 122.640 122.640 119.320 3.320 18792 799 1 1 . 1 1 174 174 LEU C C 174 176.523 176.523 176.783 -0.260 18792 800 1 1 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.725 -0.957 18792 801 1 1 . 1 1 174 174 LEU CB C 174 40.784 40.784 41.234 -0.450 18792 802 1 1 . 1 1 174 174 LEU H H 174 8.082 8.082 8.536 -0.454 18792 803 1 1 . 1 1 175 175 GLU N N 175 125.909 125.909 121.300 4.609 18792 804 1 1 . 1 1 175 175 GLU C C 175 181.029 181.029 176.304 4.725 18792 805 1 1 . 1 1 175 175 GLU CA C 175 57.398 57.398 57.040 0.358 18792 806 1 1 . 1 1 175 175 GLU CB C 175 30.050 30.050 30.463 -0.413 18792 807 1 1 . 1 1 175 175 GLU H H 175 7.785 7.785 8.650 -0.865 18792 808 1 2 . 1 1 4 4 ALA N N 4 124.786 124.786 123.657 1.129 18792 809 1 2 . 1 1 4 4 ALA C C 4 178.272 178.272 177.701 0.571 18792 810 1 2 . 1 1 4 4 ALA CA C 4 52.566 52.566 52.577 -0.011 18792 811 1 2 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.841 -0.607 18792 812 1 2 . 1 1 4 4 ALA H H 4 8.414 8.414 8.345 0.069 18792 813 1 2 . 1 1 5 5 MET N N 5 119.681 119.681 119.511 0.170 18792 814 1 2 . 1 1 5 5 MET C C 5 176.929 176.929 176.511 0.418 18792 815 1 2 . 1 1 5 5 MET CA C 5 55.594 55.594 55.144 0.450 18792 816 1 2 . 1 1 5 5 MET CB C 5 31.540 31.540 31.893 -0.353 18792 817 1 2 . 1 1 5 5 MET H H 5 8.336 8.336 7.935 0.401 18792 818 1 2 . 1 1 6 6 SER N N 6 116.162 116.162 116.841 -0.679 18792 819 1 2 . 1 1 6 6 SER C C 6 175.924 175.924 176.470 -0.546 18792 820 1 2 . 1 1 6 6 SER CA C 6 59.009 59.009 60.920 -1.911 18792 821 1 2 . 1 1 6 6 SER CB C 6 62.537 62.537 62.772 -0.235 18792 822 1 2 . 1 1 6 6 SER H H 6 8.272 8.272 8.349 -0.077 18792 823 1 2 . 1 1 7 7 GLN N N 7 122.263 122.263 121.346 0.917 18792 824 1 2 . 1 1 7 7 GLN C C 7 177.027 177.027 178.346 -1.319 18792 825 1 2 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.931 -2.662 18792 826 1 2 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.632 -0.893 18792 827 1 2 . 1 1 7 7 GLN H H 7 8.314 8.314 8.450 -0.136 18792 828 1 2 . 1 1 8 8 SER N N 8 116.625 116.625 115.250 1.375 18792 829 1 2 . 1 1 8 8 SER C C 8 176.457 176.457 176.461 -0.004 18792 830 1 2 . 1 1 8 8 SER CA C 8 59.650 59.650 61.548 -1.898 18792 831 1 2 . 1 1 8 8 SER CB C 8 62.226 62.226 62.651 -0.425 18792 832 1 2 . 1 1 8 8 SER H H 8 8.333 8.333 8.228 0.105 18792 833 1 2 . 1 1 9 9 ASN N N 9 121.307 121.307 120.781 0.526 18792 834 1 2 . 1 1 9 9 ASN C C 9 177.419 177.419 177.326 0.093 18792 835 1 2 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.147 -0.660 18792 836 1 2 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.995 -1.862 18792 837 1 2 . 1 1 9 9 ASN H H 9 8.611 8.611 8.732 -0.121 18792 838 1 2 . 1 1 10 10 ARG N N 10 119.830 119.830 121.108 -1.278 18792 839 1 2 . 1 1 10 10 ARG C C 10 177.615 177.615 178.534 -0.919 18792 840 1 2 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.321 -0.063 18792 841 1 2 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.133 -1.934 18792 842 1 2 . 1 1 10 10 ARG H H 10 7.996 7.996 8.354 -0.358 18792 843 1 2 . 1 1 11 11 GLU N N 11 117.270 117.270 119.172 -1.902 18792 844 1 2 . 1 1 11 11 GLU C C 11 179.649 179.649 179.016 0.633 18792 845 1 2 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.437 -0.428 18792 846 1 2 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.476 -1.355 18792 847 1 2 . 1 1 11 11 GLU H H 11 7.885 7.885 8.354 -0.469 18792 848 1 2 . 1 1 12 12 LEU N N 12 119.900 119.900 122.210 -2.310 18792 849 1 2 . 1 1 12 12 LEU C C 12 178.473 178.473 178.448 0.025 18792 850 1 2 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.424 -0.731 18792 851 1 2 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.801 -1.172 18792 852 1 2 . 1 1 12 12 LEU H H 12 7.691 7.691 8.006 -0.315 18792 853 1 2 . 1 1 13 13 VAL N N 13 117.320 117.320 117.925 -0.605 18792 854 1 2 . 1 1 13 13 VAL C C 13 177.272 177.272 178.092 -0.820 18792 855 1 2 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.281 0.875 18792 856 1 2 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.174 0.055 18792 857 1 2 . 1 1 13 13 VAL H H 13 7.629 7.629 7.796 -0.167 18792 858 1 2 . 1 1 14 14 VAL N N 14 116.659 116.659 120.670 -4.011 18792 859 1 2 . 1 1 14 14 VAL C C 14 178.718 178.718 178.211 0.507 18792 860 1 2 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.488 0.028 18792 861 1 2 . 1 1 14 14 VAL CB C 14 30.374 30.374 30.811 -0.437 18792 862 1 2 . 1 1 14 14 VAL H H 14 8.210 8.210 8.061 0.149 18792 863 1 2 . 1 1 15 15 ASP N N 15 120.374 120.374 121.188 -0.814 18792 864 1 2 . 1 1 15 15 ASP C C 15 177.557 177.557 178.207 -0.650 18792 865 1 2 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.724 0.752 18792 866 1 2 . 1 1 15 15 ASP CB C 15 42.553 42.553 41.115 1.438 18792 867 1 2 . 1 1 15 15 ASP H H 15 7.967 7.967 8.629 -0.662 18792 868 1 2 . 1 1 16 16 PHE N N 16 119.864 119.864 120.249 -0.385 18792 869 1 2 . 1 1 16 16 PHE C C 16 178.252 178.252 177.357 0.895 18792 870 1 2 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.272 1.508 18792 871 1 2 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.145 -0.085 18792 872 1 2 . 1 1 16 16 PHE H H 16 8.228 8.228 7.945 0.283 18792 873 1 2 . 1 1 17 17 LEU N N 17 116.312 116.312 118.943 -2.631 18792 874 1 2 . 1 1 17 17 LEU C C 17 179.649 179.649 178.888 0.761 18792 875 1 2 . 1 1 17 17 LEU CA C 17 57.764 57.764 57.960 -0.196 18792 876 1 2 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.591 -1.506 18792 877 1 2 . 1 1 17 17 LEU H H 17 8.766 8.766 8.215 0.551 18792 878 1 2 . 1 1 18 18 SER N N 18 113.715 113.715 114.948 -1.233 18792 879 1 2 . 1 1 18 18 SER C C 18 177.362 177.362 176.351 1.011 18792 880 1 2 . 1 1 18 18 SER CA C 18 61.948 61.948 61.271 0.677 18792 881 1 2 . 1 1 18 18 SER CB C 18 63.003 63.003 63.095 -0.092 18792 882 1 2 . 1 1 18 18 SER H H 18 8.384 8.384 8.130 0.254 18792 883 1 2 . 1 1 19 19 TYR N N 19 124.570 124.570 121.790 2.780 18792 884 1 2 . 1 1 19 19 TYR C C 19 178.415 178.415 177.617 0.798 18792 885 1 2 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.438 -1.674 18792 886 1 2 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.453 -1.437 18792 887 1 2 . 1 1 19 19 TYR H H 19 8.155 8.155 8.858 -0.703 18792 888 1 2 . 1 1 20 20 LYS N N 20 119.739 119.739 120.076 -0.337 18792 889 1 2 . 1 1 20 20 LYS C C 20 180.456 180.456 179.229 1.227 18792 890 1 2 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.339 -2.850 18792 891 1 2 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.434 -4.275 18792 892 1 2 . 1 1 20 20 LYS H H 20 8.224 8.224 7.815 0.409 18792 893 1 2 . 1 1 21 21 LEU N N 21 118.092 118.092 121.152 -3.060 18792 894 1 2 . 1 1 21 21 LEU C C 21 179.989 179.989 178.630 1.359 18792 895 1 2 . 1 1 21 21 LEU CA C 21 58.126 58.126 57.828 0.298 18792 896 1 2 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.691 -2.083 18792 897 1 2 . 1 1 21 21 LEU H H 21 8.586 8.586 7.933 0.653 18792 898 1 2 . 1 1 22 22 SER N N 22 117.304 117.304 113.489 3.815 18792 899 1 2 . 1 1 22 22 SER C C 22 180.152 180.152 177.171 2.981 18792 900 1 2 . 1 1 22 22 SER CA C 22 61.287 61.287 61.807 -0.520 18792 901 1 2 . 1 1 22 22 SER H H 22 8.266 8.266 8.011 0.255 18792 902 1 2 . 1 1 23 23 GLN N N 23 122.497 122.497 120.898 1.599 18792 903 1 2 . 1 1 23 23 GLN C C 23 177.297 177.297 177.987 -0.690 18792 904 1 2 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.343 -0.401 18792 905 1 2 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.572 -0.761 18792 906 1 2 . 1 1 23 23 GLN H H 23 7.571 7.571 8.473 -0.902 18792 907 1 2 . 1 1 24 24 LYS N N 24 116.038 116.038 116.720 -0.682 18792 908 1 2 . 1 1 24 24 LYS C C 24 175.704 175.704 176.947 -1.243 18792 909 1 2 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.369 -2.874 18792 910 1 2 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.077 -1.848 18792 911 1 2 . 1 1 24 24 LYS H H 24 7.134 7.134 7.796 -0.662 18792 912 1 2 . 1 1 25 25 GLY N N 25 105.283 105.283 106.744 -1.461 18792 913 1 2 . 1 1 25 25 GLY C C 25 174.013 174.013 173.476 0.537 18792 914 1 2 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.684 0.095 18792 915 1 2 . 1 1 25 25 GLY H H 25 7.483 7.483 8.036 -0.553 18792 916 1 2 . 1 1 26 26 TYR N N 26 119.547 119.547 119.439 0.108 18792 917 1 2 . 1 1 26 26 TYR C C 26 175.122 175.122 174.360 0.762 18792 918 1 2 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.626 -1.494 18792 919 1 2 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.650 0.430 18792 920 1 2 . 1 1 26 26 TYR H H 26 7.788 7.788 7.610 0.178 18792 921 1 2 . 1 1 27 27 SER N N 27 115.088 115.088 117.838 -2.750 18792 922 1 2 . 1 1 27 27 SER C C 27 174.452 174.452 175.408 -0.956 18792 923 1 2 . 1 1 27 27 SER CA C 27 56.306 56.306 56.504 -0.198 18792 924 1 2 . 1 1 27 27 SER CB C 27 63.921 63.921 65.763 -1.842 18792 925 1 2 . 1 1 27 27 SER H H 27 8.473 8.473 7.953 0.520 18792 926 1 2 . 1 1 28 28 TRP N N 28 127.014 127.014 123.538 3.476 18792 927 1 2 . 1 1 28 28 TRP C C 28 177.002 177.002 177.034 -0.032 18792 928 1 2 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.332 0.140 18792 929 1 2 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.037 0.793 18792 930 1 2 . 1 1 28 28 TRP H H 28 8.897 8.897 8.903 -0.006 18792 931 1 2 . 1 1 29 29 SER N N 29 112.044 112.044 115.124 -3.080 18792 932 1 2 . 1 1 29 29 SER C C 29 175.106 175.106 175.829 -0.723 18792 933 1 2 . 1 1 29 29 SER CA C 29 59.472 59.472 61.188 -1.716 18792 934 1 2 . 1 1 29 29 SER CB C 29 62.226 62.226 63.705 -1.479 18792 935 1 2 . 1 1 29 29 SER H H 29 8.129 8.129 7.840 0.289 18792 936 1 2 . 1 1 30 30 GLN N N 30 119.160 119.160 117.268 1.892 18792 937 1 2 . 1 1 30 30 GLN C C 30 176.218 176.218 176.109 0.109 18792 938 1 2 . 1 1 30 30 GLN CA C 30 56.412 56.412 55.646 0.766 18792 939 1 2 . 1 1 30 30 GLN CB C 30 27.578 27.578 30.917 -3.339 18792 940 1 2 . 1 1 30 30 GLN H H 30 7.370 7.370 7.656 -0.286 18792 941 1 2 . 1 1 31 31 PHE N N 31 116.277 116.277 118.754 -2.477 18792 942 1 2 . 1 1 31 31 PHE C C 31 175.217 175.217 173.643 1.574 18792 943 1 2 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.651 -3.417 18792 944 1 2 . 1 1 31 31 PHE CB C 31 39.066 39.066 38.106 0.960 18792 945 1 2 . 1 1 31 31 PHE H H 31 7.248 7.248 8.040 -0.792 18792 946 1 2 . 1 1 32 32 SER N N 32 113.683 113.683 112.793 0.890 18792 947 1 2 . 1 1 32 32 SER C C 32 173.793 173.793 173.303 0.490 18792 948 1 2 . 1 1 32 32 SER CA C 32 57.124 57.124 57.253 -0.129 18792 949 1 2 . 1 1 32 32 SER CB C 32 63.081 63.081 65.245 -2.163 18792 950 1 2 . 1 1 32 32 SER H H 32 7.242 7.242 7.455 -0.213 18792 951 1 2 . 1 1 33 33 ASP N N 33 122.195 122.195 122.424 -0.229 18792 952 1 2 . 1 1 33 33 ASP C C 33 176.394 176.394 175.018 1.376 18792 953 1 2 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.691 -1.943 18792 954 1 2 . 1 1 33 33 ASP CB C 33 40.398 40.398 39.489 0.909 18792 955 1 2 . 1 1 33 33 ASP H H 33 8.257 8.257 8.909 -0.652 18792 956 1 2 . 1 1 34 34 VAL N N 34 118.913 118.913 111.978 6.935 18792 957 1 2 . 1 1 34 34 VAL C C 34 176.328 176.328 174.640 1.688 18792 958 1 2 . 1 1 34 34 VAL CA C 34 61.891 61.891 63.062 -1.171 18792 959 1 2 . 1 1 34 34 VAL CB C 34 32.015 32.015 30.483 1.532 18792 960 1 2 . 1 1 34 34 VAL H H 34 7.852 7.852 7.899 -0.047 18792 961 1 2 . 1 1 35 35 GLU N N 35 124.205 124.205 116.386 7.819 18792 962 1 2 . 1 1 35 35 GLU C C 35 176.586 176.586 175.224 1.362 18792 963 1 2 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.820 -1.763 18792 964 1 2 . 1 1 35 35 GLU CB C 35 28.898 28.898 27.924 0.974 18792 965 1 2 . 1 1 35 35 GLU H H 35 8.401 8.401 7.881 0.520 18792 966 1 2 . 1 1 36 36 GLU N N 36 121.670 121.670 123.984 -2.314 18792 967 1 2 . 1 1 36 36 GLU C C 36 176.218 176.218 175.113 1.105 18792 968 1 2 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.669 -0.681 18792 969 1 2 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.570 -1.128 18792 970 1 2 . 1 1 36 36 GLU H H 36 8.239 8.239 8.713 -0.474 18792 971 1 2 . 1 1 37 37 ASN N N 37 119.252 119.252 118.841 0.411 18792 972 1 2 . 1 1 37 37 ASN C C 37 175.003 175.003 173.843 1.160 18792 973 1 2 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.370 -0.715 18792 974 1 2 . 1 1 37 37 ASN CB C 37 38.212 38.212 38.759 -0.547 18792 975 1 2 . 1 1 37 37 ASN H H 37 8.412 8.412 8.293 0.119 18792 976 1 2 . 1 1 38 38 ARG N N 38 121.622 121.622 122.676 -1.054 18792 977 1 2 . 1 1 38 38 ARG C C 38 176.610 176.610 174.645 1.965 18792 978 1 2 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.045 -0.681 18792 979 1 2 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.928 -2.509 18792 980 1 2 . 1 1 38 38 ARG H H 38 8.227 8.227 8.308 -0.081 18792 981 1 2 . 1 1 39 39 THR N N 39 115.681 115.681 118.183 -2.502 18792 982 1 2 . 1 1 39 39 THR C C 39 174.500 174.500 174.254 0.246 18792 983 1 2 . 1 1 39 39 THR CA C 39 61.606 61.606 62.546 -0.940 18792 984 1 2 . 1 1 39 39 THR CB C 39 69.163 69.163 69.280 -0.117 18792 985 1 2 . 1 1 39 39 THR H H 39 8.173 8.173 8.248 -0.075 18792 986 1 2 . 1 1 40 40 GLU N N 40 122.708 122.708 124.039 -1.331 18792 987 1 2 . 1 1 40 40 GLU C C 40 175.728 175.728 176.553 -0.825 18792 988 1 2 . 1 1 40 40 GLU CA C 40 55.772 55.772 57.169 -1.397 18792 989 1 2 . 1 1 40 40 GLU CB C 40 29.054 29.054 30.680 -1.626 18792 990 1 2 . 1 1 40 40 GLU H H 40 8.298 8.298 8.982 -0.684 18792 991 1 2 . 1 1 41 41 ALA N N 41 125.922 125.922 123.860 2.062 18792 992 1 2 . 1 1 41 41 ALA C C 41 175.557 175.557 175.585 -0.028 18792 993 1 2 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.754 -1.780 18792 994 1 2 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.406 -0.161 18792 995 1 2 . 1 1 41 41 ALA H H 41 8.212 8.212 7.894 0.318 18792 996 1 2 . 1 1 43 43 GLU N N 43 120.783 120.783 120.473 0.310 18792 997 1 2 . 1 1 43 43 GLU C C 43 177.174 177.174 176.913 0.261 18792 998 1 2 . 1 1 43 43 GLU CA C 43 56.341 56.341 57.517 -1.176 18792 999 1 2 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.987 -0.700 18792 1000 1 2 . 1 1 43 43 GLU H H 43 8.519 8.519 8.965 -0.446 18792 1001 1 2 . 1 1 44 44 GLY N N 44 110.022 110.022 108.719 1.303 18792 1002 1 2 . 1 1 44 44 GLY C C 44 174.773 174.773 174.541 0.232 18792 1003 1 2 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.287 -0.259 18792 1004 1 2 . 1 1 44 44 GLY H H 44 8.429 8.429 8.563 -0.134 18792 1005 1 2 . 1 1 45 45 THR N N 45 112.790 112.790 114.035 -1.245 18792 1006 1 2 . 1 1 45 45 THR C C 45 175.726 175.726 175.473 0.253 18792 1007 1 2 . 1 1 45 45 THR CA C 45 61.987 61.987 60.510 1.478 18792 1008 1 2 . 1 1 45 45 THR CB C 45 69.304 69.304 69.492 -0.188 18792 1009 1 2 . 1 1 45 45 THR H H 45 8.125 8.125 7.811 0.314 18792 1010 1 2 . 1 1 46 46 GLU N N 46 122.752 122.752 125.660 -2.908 18792 1011 1 2 . 1 1 46 46 GLU C C 46 177.419 177.419 177.045 0.374 18792 1012 1 2 . 1 1 46 46 GLU CA C 46 57.231 57.231 58.835 -1.604 18792 1013 1 2 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.547 -1.347 18792 1014 1 2 . 1 1 46 46 GLU H H 46 8.765 8.765 8.821 -0.056 18792 1015 1 2 . 1 1 47 47 SER N N 47 114.895 114.895 111.690 3.205 18792 1016 1 2 . 1 1 47 47 SER C C 47 175.826 175.826 175.032 0.794 18792 1017 1 2 . 1 1 47 47 SER CA C 47 58.582 58.582 59.242 -0.660 18792 1018 1 2 . 1 1 47 47 SER CB C 47 62.537 62.537 62.098 0.439 18792 1019 1 2 . 1 1 47 47 SER H H 47 8.355 8.355 8.233 0.122 18792 1020 1 2 . 1 1 48 48 GLU N N 48 122.429 122.429 119.275 3.154 18792 1021 1 2 . 1 1 48 48 GLU C C 48 178.099 178.099 177.892 0.207 18792 1022 1 2 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.630 -0.012 18792 1023 1 2 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.628 -1.153 18792 1024 1 2 . 1 1 48 48 GLU H H 48 8.139 8.139 8.645 -0.506 18792 1025 1 2 . 1 1 49 49 ALA N N 49 120.374 120.374 123.247 -2.873 18792 1026 1 2 . 1 1 49 49 ALA C C 49 180.843 180.843 179.317 1.526 18792 1027 1 2 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.265 -0.782 18792 1028 1 2 . 1 1 49 49 ALA CB C 49 17.435 17.435 17.998 -0.563 18792 1029 1 2 . 1 1 49 49 ALA H H 49 8.079 8.079 8.272 -0.193 18792 1030 1 2 . 1 1 50 50 VAL N N 50 118.599 118.599 115.485 3.114 18792 1031 1 2 . 1 1 50 50 VAL C C 50 176.921 176.921 177.417 -0.496 18792 1032 1 2 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.308 0.252 18792 1033 1 2 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.338 -0.041 18792 1034 1 2 . 1 1 50 50 VAL H H 50 7.419 7.419 7.863 -0.444 18792 1035 1 2 . 1 1 51 51 LYS N N 51 117.469 117.469 121.343 -3.874 18792 1036 1 2 . 1 1 51 51 LYS C C 51 179.061 179.061 178.976 0.085 18792 1037 1 2 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.799 -0.576 18792 1038 1 2 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.936 -0.939 18792 1039 1 2 . 1 1 51 51 LYS H H 51 7.359 7.359 7.942 -0.583 18792 1040 1 2 . 1 1 52 52 GLN N N 52 115.930 115.930 118.454 -2.524 18792 1041 1 2 . 1 1 52 52 GLN C C 52 177.713 177.713 178.026 -0.313 18792 1042 1 2 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.693 -0.217 18792 1043 1 2 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.696 -2.128 18792 1044 1 2 . 1 1 52 52 GLN H H 52 8.025 8.025 8.200 -0.175 18792 1045 1 2 . 1 1 53 53 ALA N N 53 119.782 119.782 122.489 -2.707 18792 1046 1 2 . 1 1 53 53 ALA C C 53 180.008 180.008 179.594 0.414 18792 1047 1 2 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.441 -0.056 18792 1048 1 2 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.559 -1.044 18792 1049 1 2 . 1 1 53 53 ALA H H 53 7.655 7.655 7.856 -0.201 18792 1050 1 2 . 1 1 54 54 LEU N N 54 120.443 120.443 119.546 0.897 18792 1051 1 2 . 1 1 54 54 LEU C C 54 179.330 179.330 178.507 0.823 18792 1052 1 2 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.119 0.894 18792 1053 1 2 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.407 -0.546 18792 1054 1 2 . 1 1 54 54 LEU H H 54 8.419 8.419 8.385 0.034 18792 1055 1 2 . 1 1 55 55 ARG N N 55 118.423 118.423 120.168 -1.745 18792 1056 1 2 . 1 1 55 55 ARG C C 55 178.767 178.767 178.768 -0.001 18792 1057 1 2 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.784 0.613 18792 1058 1 2 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.245 -1.502 18792 1059 1 2 . 1 1 55 55 ARG H H 55 8.062 8.062 7.771 0.291 18792 1060 1 2 . 1 1 56 56 GLU N N 56 115.988 115.988 118.697 -2.709 18792 1061 1 2 . 1 1 56 56 GLU C C 56 180.090 180.090 178.570 1.520 18792 1062 1 2 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.343 -0.584 18792 1063 1 2 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.532 -1.178 18792 1064 1 2 . 1 1 56 56 GLU H H 56 7.772 7.772 8.018 -0.246 18792 1065 1 2 . 1 1 57 57 ALA N N 57 122.837 122.837 121.927 0.910 18792 1066 1 2 . 1 1 57 57 ALA C C 57 181.861 181.861 179.951 1.910 18792 1067 1 2 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.758 -0.124 18792 1068 1 2 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.485 -0.012 18792 1069 1 2 . 1 1 57 57 ALA H H 57 8.774 8.774 7.894 0.880 18792 1070 1 2 . 1 1 58 58 GLY N N 58 108.409 108.409 106.702 1.707 18792 1071 1 2 . 1 1 58 58 GLY C C 58 175.331 175.331 175.896 -0.565 18792 1072 1 2 . 1 1 58 58 GLY CA C 58 46.668 46.668 47.117 -0.449 18792 1073 1 2 . 1 1 58 58 GLY H H 58 9.073 9.073 8.450 0.624 18792 1074 1 2 . 1 1 59 59 ASP N N 59 122.074 122.074 122.213 -0.139 18792 1075 1 2 . 1 1 59 59 ASP C C 59 179.023 179.023 178.687 0.336 18792 1076 1 2 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.665 -0.363 18792 1077 1 2 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.822 -1.980 18792 1078 1 2 . 1 1 59 59 ASP H H 59 8.049 8.049 8.309 -0.260 18792 1079 1 2 . 1 1 60 60 GLU N N 60 120.131 120.131 120.803 -0.672 18792 1080 1 2 . 1 1 60 60 GLU C C 60 178.522 178.522 178.734 -0.212 18792 1081 1 2 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.253 -0.244 18792 1082 1 2 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.544 -1.345 18792 1083 1 2 . 1 1 60 60 GLU H H 60 8.136 8.136 8.107 0.029 18792 1084 1 2 . 1 1 61 61 PHE N N 61 121.309 121.309 119.093 2.216 18792 1085 1 2 . 1 1 61 61 PHE C C 61 176.904 176.904 177.814 -0.910 18792 1086 1 2 . 1 1 61 61 PHE CA C 61 61.322 61.322 62.120 -0.798 18792 1087 1 2 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.395 -0.786 18792 1088 1 2 . 1 1 61 61 PHE H H 61 8.523 8.523 8.074 0.449 18792 1089 1 2 . 1 1 62 62 GLU N N 62 115.971 115.971 120.027 -4.056 18792 1090 1 2 . 1 1 62 62 GLU C C 62 177.713 177.713 178.965 -1.252 18792 1091 1 2 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.386 -1.195 18792 1092 1 2 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.492 -1.215 18792 1093 1 2 . 1 1 62 62 GLU H H 62 7.969 7.969 8.830 -0.861 18792 1094 1 2 . 1 1 63 63 LEU N N 63 116.703 116.703 120.623 -3.920 18792 1095 1 2 . 1 1 63 63 LEU C C 63 178.963 178.963 178.016 0.947 18792 1096 1 2 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.936 -0.524 18792 1097 1 2 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.159 -0.753 18792 1098 1 2 . 1 1 63 63 LEU H H 63 7.347 7.347 7.815 -0.468 18792 1099 1 2 . 1 1 64 64 ARG N N 64 117.453 117.453 116.860 0.593 18792 1100 1 2 . 1 1 64 64 ARG C C 64 177.297 177.297 178.187 -0.890 18792 1101 1 2 . 1 1 64 64 ARG CA C 64 57.337 57.337 58.365 -1.028 18792 1102 1 2 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.659 -1.062 18792 1103 1 2 . 1 1 64 64 ARG H H 64 7.995 7.995 8.376 -0.381 18792 1104 1 2 . 1 1 65 65 TYR N N 65 118.956 118.956 117.580 1.376 18792 1105 1 2 . 1 1 65 65 TYR C C 65 175.278 175.278 177.090 -1.812 18792 1106 1 2 . 1 1 65 65 TYR CA C 65 55.701 55.701 59.783 -4.082 18792 1107 1 2 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.520 -3.534 18792 1108 1 2 . 1 1 65 65 TYR H H 65 7.909 7.909 8.286 -0.377 18792 1109 1 2 . 1 1 66 66 ARG N N 66 119.438 119.438 117.586 1.852 18792 1110 1 2 . 1 1 66 66 ARG C C 66 178.424 178.424 178.301 0.123 18792 1111 1 2 . 1 1 66 66 ARG CA C 66 58.476 58.476 59.419 -0.943 18792 1112 1 2 . 1 1 66 66 ARG CB C 66 28.821 28.821 28.483 0.338 18792 1113 1 2 . 1 1 66 66 ARG H H 66 7.244 7.244 8.290 -1.046 18792 1114 1 2 . 1 1 67 67 ARG N N 67 118.936 118.936 120.170 -1.234 18792 1115 1 2 . 1 1 67 67 ARG C C 67 177.542 177.542 178.170 -0.628 18792 1116 1 2 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.894 -2.450 18792 1117 1 2 . 1 1 67 67 ARG CB C 67 28.121 28.121 30.206 -2.085 18792 1118 1 2 . 1 1 67 67 ARG H H 67 8.417 8.417 8.373 0.044 18792 1119 1 2 . 1 1 68 68 ALA N N 68 121.797 121.797 120.608 1.189 18792 1120 1 2 . 1 1 68 68 ALA C C 68 180.337 180.337 179.833 0.504 18792 1121 1 2 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.770 -0.634 18792 1122 1 2 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.586 -1.119 18792 1123 1 2 . 1 1 68 68 ALA H H 68 7.827 7.827 8.425 -0.598 18792 1124 1 2 . 1 1 69 69 PHE N N 69 115.986 115.986 119.220 -3.234 18792 1125 1 2 . 1 1 69 69 PHE C C 69 177.468 177.468 176.974 0.494 18792 1126 1 2 . 1 1 69 69 PHE CA C 69 58.049 58.049 57.964 0.085 18792 1127 1 2 . 1 1 69 69 PHE CB C 69 37.599 37.599 39.189 -1.590 18792 1128 1 2 . 1 1 69 69 PHE H H 69 8.517 8.517 7.791 0.726 18792 1129 1 2 . 1 1 70 70 SER N N 70 116.526 116.526 118.034 -1.508 18792 1130 1 2 . 1 1 70 70 SER C C 70 177.640 177.640 176.807 0.833 18792 1131 1 2 . 1 1 70 70 SER CA C 70 61.073 61.073 61.830 -0.757 18792 1132 1 2 . 1 1 70 70 SER CB C 70 61.993 61.993 62.853 -0.860 18792 1133 1 2 . 1 1 70 70 SER H H 70 8.152 8.152 8.587 -0.435 18792 1134 1 2 . 1 1 71 71 ASP N N 71 121.181 121.181 121.544 -0.363 18792 1135 1 2 . 1 1 71 71 ASP C C 71 178.546 178.546 178.392 0.154 18792 1136 1 2 . 1 1 71 71 ASP CA C 71 56.448 56.448 58.064 -1.616 18792 1137 1 2 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.858 -1.627 18792 1138 1 2 . 1 1 71 71 ASP H H 71 8.356 8.356 7.951 0.405 18792 1139 1 2 . 1 1 72 72 LEU N N 72 120.747 120.747 119.781 0.966 18792 1140 1 2 . 1 1 72 72 LEU C C 72 178.963 178.963 178.595 0.368 18792 1141 1 2 . 1 1 72 72 LEU CA C 72 57.444 57.444 57.944 -0.500 18792 1142 1 2 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.136 -1.119 18792 1143 1 2 . 1 1 72 72 LEU H H 72 7.738 7.738 7.312 0.426 18792 1144 1 2 . 1 1 73 73 THR N N 73 109.432 109.432 113.785 -4.353 18792 1145 1 2 . 1 1 73 73 THR C C 73 177.481 177.481 176.379 1.102 18792 1146 1 2 . 1 1 73 73 THR CA C 73 65.128 65.128 65.528 -0.400 18792 1147 1 2 . 1 1 73 73 THR CB C 73 67.720 67.720 68.059 -0.339 18792 1148 1 2 . 1 1 73 73 THR H H 73 8.296 8.296 8.439 -0.143 18792 1149 1 2 . 1 1 74 74 SER N N 74 115.862 115.862 116.810 -0.948 18792 1150 1 2 . 1 1 74 74 SER C C 74 175.361 175.361 175.815 -0.454 18792 1151 1 2 . 1 1 74 74 SER CA C 74 60.112 60.112 60.916 -0.804 18792 1152 1 2 . 1 1 74 74 SER CB C 74 62.537 62.537 63.358 -0.821 18792 1153 1 2 . 1 1 74 74 SER H H 74 7.629 7.629 7.956 -0.327 18792 1154 1 2 . 1 1 75 75 GLN N N 75 118.551 118.551 118.879 -0.328 18792 1155 1 2 . 1 1 75 75 GLN C C 75 176.316 176.316 176.299 0.017 18792 1156 1 2 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.424 0.380 18792 1157 1 2 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.834 -1.557 18792 1158 1 2 . 1 1 75 75 GLN H H 75 7.640 7.640 7.602 0.038 18792 1159 1 2 . 1 1 76 76 LEU N N 76 118.313 118.313 113.765 4.548 18792 1160 1 2 . 1 1 76 76 LEU C C 76 174.160 174.160 175.942 -1.782 18792 1161 1 2 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.522 -0.782 18792 1162 1 2 . 1 1 76 76 LEU CB C 76 42.727 42.727 39.619 3.108 18792 1163 1 2 . 1 1 76 76 LEU H H 76 7.411 7.411 7.482 -0.071 18792 1164 1 2 . 1 1 77 77 HIS N N 77 120.104 120.104 119.359 0.745 18792 1165 1 2 . 1 1 77 77 HIS C C 77 174.528 174.528 173.424 1.104 18792 1166 1 2 . 1 1 77 77 HIS CA C 77 54.207 54.207 57.434 -3.227 18792 1167 1 2 . 1 1 77 77 HIS CB C 77 27.966 27.966 27.823 0.143 18792 1168 1 2 . 1 1 77 77 HIS H H 77 8.117 8.117 8.460 -0.343 18792 1169 1 2 . 1 1 78 78 ILE N N 78 122.298 122.298 121.813 0.485 18792 1170 1 2 . 1 1 78 78 ILE C C 78 174.240 174.240 175.135 -0.895 18792 1171 1 2 . 1 1 78 78 ILE CA C 78 61.402 61.402 60.932 0.470 18792 1172 1 2 . 1 1 78 78 ILE CB C 78 37.591 37.591 40.299 -2.708 18792 1173 1 2 . 1 1 78 78 ILE H H 78 8.655 8.655 8.388 0.267 18792 1174 1 2 . 1 1 79 79 THR N N 79 116.442 116.442 113.833 2.609 18792 1175 1 2 . 1 1 79 79 THR C C 79 174.291 174.291 172.648 1.643 18792 1176 1 2 . 1 1 79 79 THR CA C 79 61.632 61.632 61.792 -0.160 18792 1177 1 2 . 1 1 79 79 THR CB C 79 68.704 68.704 67.416 1.288 18792 1178 1 2 . 1 1 79 79 THR H H 79 8.245 8.245 7.999 0.246 18792 1179 1 2 . 1 1 84 84 TYR N N 84 120.888 120.888 117.826 3.062 18792 1180 1 2 . 1 1 84 84 TYR C C 84 176.708 176.708 177.535 -0.827 18792 1181 1 2 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.593 -1.161 18792 1182 1 2 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.732 -0.987 18792 1183 1 2 . 1 1 84 84 TYR H H 84 8.733 8.733 8.629 0.104 18792 1184 1 2 . 1 1 85 85 GLN N N 85 114.530 114.530 119.020 -4.490 18792 1185 1 2 . 1 1 85 85 GLN C C 85 178.473 178.473 178.406 0.067 18792 1186 1 2 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.296 -0.002 18792 1187 1 2 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.901 -1.101 18792 1188 1 2 . 1 1 85 85 GLN H H 85 8.413 8.413 7.564 0.849 18792 1189 1 2 . 1 1 86 86 SER N N 86 114.032 114.032 116.115 -2.083 18792 1190 1 2 . 1 1 86 86 SER C C 86 178.473 178.473 176.812 1.661 18792 1191 1 2 . 1 1 86 86 SER CA C 86 62.175 62.175 61.346 0.829 18792 1192 1 2 . 1 1 86 86 SER CB C 86 63.252 63.252 62.806 0.446 18792 1193 1 2 . 1 1 86 86 SER H H 86 7.258 7.258 7.342 -0.084 18792 1194 1 2 . 1 1 88 88 GLU N N 88 119.386 119.386 120.092 -0.706 18792 1195 1 2 . 1 1 88 88 GLU C C 88 177.199 177.199 178.790 -1.591 18792 1196 1 2 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.701 -1.119 18792 1197 1 2 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.574 -0.598 18792 1198 1 2 . 1 1 88 88 GLU H H 88 8.534 8.534 8.515 0.019 18792 1199 1 2 . 1 1 89 89 GLN N N 89 114.678 114.678 118.972 -4.294 18792 1200 1 2 . 1 1 89 89 GLN C C 89 178.669 178.669 178.643 0.026 18792 1201 1 2 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.738 -0.156 18792 1202 1 2 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.415 -0.993 18792 1203 1 2 . 1 1 89 89 GLN H H 89 7.500 7.500 7.654 -0.154 18792 1204 1 2 . 1 1 90 90 VAL N N 90 118.174 118.174 119.817 -1.643 18792 1205 1 2 . 1 1 90 90 VAL C C 90 178.081 178.081 177.494 0.587 18792 1206 1 2 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.873 -0.318 18792 1207 1 2 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.596 -0.989 18792 1208 1 2 . 1 1 90 90 VAL H H 90 7.017 7.017 7.669 -0.652 18792 1209 1 2 . 1 1 91 91 VAL N N 91 119.489 119.489 120.670 -1.181 18792 1210 1 2 . 1 1 91 91 VAL C C 91 177.914 177.914 178.231 -0.317 18792 1211 1 2 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.536 -0.767 18792 1212 1 2 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.076 -0.785 18792 1213 1 2 . 1 1 91 91 VAL H H 91 7.833 7.833 8.227 -0.394 18792 1214 1 2 . 1 1 92 92 ASN N N 92 117.180 117.180 117.451 -0.271 18792 1215 1 2 . 1 1 92 92 ASN C C 92 179.110 179.110 177.007 2.103 18792 1216 1 2 . 1 1 92 92 ASN CA C 92 54.918 54.918 55.871 -0.953 18792 1217 1 2 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.133 -2.165 18792 1218 1 2 . 1 1 92 92 ASN H H 92 8.368 8.368 8.633 -0.265 18792 1219 1 2 . 1 1 93 93 GLU N N 93 118.476 118.476 119.235 -0.759 18792 1220 1 2 . 1 1 93 93 GLU C C 93 179.355 179.355 179.481 -0.126 18792 1221 1 2 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.948 -0.543 18792 1222 1 2 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.931 -2.198 18792 1223 1 2 . 1 1 93 93 GLU H H 93 7.213 7.213 7.750 -0.537 18792 1224 1 2 . 1 1 94 94 LEU N N 94 120.889 120.889 120.801 0.088 18792 1225 1 2 . 1 1 94 94 LEU C C 94 178.473 178.473 178.443 0.030 18792 1226 1 2 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.180 -0.163 18792 1227 1 2 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.710 -1.780 18792 1228 1 2 . 1 1 94 94 LEU H H 94 7.446 7.446 7.885 -0.439 18792 1229 1 2 . 1 1 95 95 PHE N N 95 112.902 112.902 118.769 -5.867 18792 1230 1 2 . 1 1 95 95 PHE C C 95 176.586 176.586 176.730 -0.144 18792 1231 1 2 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.907 -2.748 18792 1232 1 2 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.412 -1.191 18792 1233 1 2 . 1 1 95 95 PHE H H 95 6.916 6.916 8.479 -1.563 18792 1234 1 2 . 1 1 96 96 ARG N N 96 123.729 123.729 119.577 4.152 18792 1235 1 2 . 1 1 96 96 ARG C C 96 177.272 177.272 177.830 -0.558 18792 1236 1 2 . 1 1 96 96 ARG CA C 96 59.223 59.223 59.226 -0.003 18792 1237 1 2 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.334 -1.902 18792 1238 1 2 . 1 1 96 96 ARG H H 96 7.126 7.126 7.668 -0.542 18792 1239 1 2 . 1 1 97 97 ASP N N 97 116.576 116.576 115.719 0.857 18792 1240 1 2 . 1 1 97 97 ASP C C 97 175.687 175.687 176.385 -0.698 18792 1241 1 2 . 1 1 97 97 ASP CA C 97 53.673 53.673 56.127 -2.454 18792 1242 1 2 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.045 -2.000 18792 1243 1 2 . 1 1 97 97 ASP H H 97 8.644 8.644 7.791 0.853 18792 1244 1 2 . 1 1 98 98 GLY N N 98 108.551 108.551 106.037 2.514 18792 1245 1 2 . 1 1 98 98 GLY C C 98 172.690 172.690 172.243 0.447 18792 1246 1 2 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.624 -2.374 18792 1247 1 2 . 1 1 98 98 GLY H H 98 7.463 7.463 7.316 0.147 18792 1248 1 2 . 1 1 99 99 VAL N N 99 120.630 120.630 117.057 3.573 18792 1249 1 2 . 1 1 99 99 VAL C C 99 174.503 174.503 173.748 0.755 18792 1250 1 2 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.134 -0.816 18792 1251 1 2 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.609 -1.846 18792 1252 1 2 . 1 1 99 99 VAL H H 99 8.184 8.184 7.678 0.506 18792 1253 1 2 . 1 1 100 100 ASN N N 100 115.485 115.485 118.650 -3.165 18792 1254 1 2 . 1 1 100 100 ASN C C 100 175.239 175.239 175.793 -0.554 18792 1255 1 2 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.314 -2.953 18792 1256 1 2 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.573 0.347 18792 1257 1 2 . 1 1 100 100 ASN H H 100 6.241 6.241 7.514 -1.273 18792 1258 1 2 . 1 1 101 101 TRP N N 101 118.266 118.266 118.301 -0.035 18792 1259 1 2 . 1 1 101 101 TRP C C 101 178.301 178.301 175.891 2.410 18792 1260 1 2 . 1 1 101 101 TRP CA C 101 60.539 60.539 57.960 2.579 18792 1261 1 2 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.425 1.405 18792 1262 1 2 . 1 1 101 101 TRP H H 101 8.409 8.409 7.765 0.644 18792 1263 1 2 . 1 1 102 102 GLY N N 102 106.147 106.147 107.273 -1.126 18792 1264 1 2 . 1 1 102 102 GLY C C 102 177.640 177.640 175.269 2.371 18792 1265 1 2 . 1 1 102 102 GLY CA C 102 46.914 46.914 45.179 1.735 18792 1266 1 2 . 1 1 102 102 GLY H H 102 8.504 8.504 7.716 0.788 18792 1267 1 2 . 1 1 103 103 ARG N N 103 121.347 121.347 121.764 -0.417 18792 1268 1 2 . 1 1 103 103 ARG C C 103 177.738 177.738 178.292 -0.554 18792 1269 1 2 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.319 -0.377 18792 1270 1 2 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.206 0.013 18792 1271 1 2 . 1 1 103 103 ARG H H 103 8.099 8.099 8.176 -0.077 18792 1272 1 2 . 1 1 104 104 ILE N N 104 120.930 120.930 120.109 0.821 18792 1273 1 2 . 1 1 104 104 ILE C C 104 178.197 178.197 178.021 0.176 18792 1274 1 2 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.888 1.647 18792 1275 1 2 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.833 -1.788 18792 1276 1 2 . 1 1 104 104 ILE H H 104 7.690 7.690 8.185 -0.495 18792 1277 1 2 . 1 1 105 105 VAL N N 105 120.938 120.938 117.665 3.273 18792 1278 1 2 . 1 1 105 105 VAL C C 105 177.854 177.854 177.632 0.222 18792 1279 1 2 . 1 1 105 105 VAL CA C 105 67.458 67.458 65.969 1.488 18792 1280 1 2 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.373 0.001 18792 1281 1 2 . 1 1 105 105 VAL H H 105 8.245 8.245 7.654 0.591 18792 1282 1 2 . 1 1 106 106 ALA N N 106 121.165 121.165 122.355 -1.190 18792 1283 1 2 . 1 1 106 106 ALA C C 106 178.284 178.284 179.348 -1.064 18792 1284 1 2 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.397 0.201 18792 1285 1 2 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.544 -1.029 18792 1286 1 2 . 1 1 106 106 ALA H H 106 7.529 7.529 7.712 -0.183 18792 1287 1 2 . 1 1 107 107 PHE N N 107 119.242 119.242 121.543 -2.301 18792 1288 1 2 . 1 1 107 107 PHE C C 107 176.390 176.390 176.528 -0.138 18792 1289 1 2 . 1 1 107 107 PHE CA C 107 60.173 60.173 59.489 0.684 18792 1290 1 2 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.948 -1.861 18792 1291 1 2 . 1 1 107 107 PHE H H 107 7.974 7.974 8.058 -0.084 18792 1292 1 2 . 1 1 108 108 PHE N N 108 120.009 120.009 119.942 0.067 18792 1293 1 2 . 1 1 108 108 PHE C C 108 177.640 177.640 176.907 0.733 18792 1294 1 2 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.963 1.461 18792 1295 1 2 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.637 -3.291 18792 1296 1 2 . 1 1 108 108 PHE H H 108 7.946 7.946 8.404 -0.458 18792 1297 1 2 . 1 1 109 109 SER N N 109 114.631 114.631 114.522 0.109 18792 1298 1 2 . 1 1 109 109 SER C C 109 177.770 177.770 176.039 1.731 18792 1299 1 2 . 1 1 109 109 SER CA C 109 63.349 63.349 61.794 1.554 18792 1300 1 2 . 1 1 109 109 SER H H 109 8.424 8.424 7.500 0.924 18792 1301 1 2 . 1 1 110 110 PHE N N 110 124.230 124.230 123.058 1.172 18792 1302 1 2 . 1 1 110 110 PHE C C 110 176.708 176.708 177.220 -0.512 18792 1303 1 2 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.916 -0.302 18792 1304 1 2 . 1 1 110 110 PHE CB C 110 37.444 37.444 39.176 -1.732 18792 1305 1 2 . 1 1 110 110 PHE H H 110 9.052 9.052 8.175 0.877 18792 1306 1 2 . 1 1 111 111 GLY N N 111 105.893 105.893 106.364 -0.471 18792 1307 1 2 . 1 1 111 111 GLY C C 111 176.795 176.795 175.979 0.816 18792 1308 1 2 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.730 0.646 18792 1309 1 2 . 1 1 111 111 GLY H H 111 7.926 7.926 8.754 -0.828 18792 1310 1 2 . 1 1 112 112 GLY N N 112 107.410 107.410 108.985 -1.575 18792 1311 1 2 . 1 1 112 112 GLY C C 112 174.650 174.650 175.499 -0.849 18792 1312 1 2 . 1 1 112 112 GLY CA C 112 47.305 47.305 45.868 1.437 18792 1313 1 2 . 1 1 112 112 GLY H H 112 8.799 8.799 7.997 0.802 18792 1314 1 2 . 1 1 113 113 ALA N N 113 124.313 124.313 125.415 -1.102 18792 1315 1 2 . 1 1 113 113 ALA C C 113 181.300 181.300 179.421 1.879 18792 1316 1 2 . 1 1 113 113 ALA CA C 113 54.527 54.527 55.004 -0.477 18792 1317 1 2 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.729 -1.246 18792 1318 1 2 . 1 1 113 113 ALA H H 113 8.212 8.212 7.932 0.280 18792 1319 1 2 . 1 1 114 114 LEU N N 114 118.878 118.878 118.167 0.711 18792 1320 1 2 . 1 1 114 114 LEU C C 114 180.286 180.286 178.570 1.716 18792 1321 1 2 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.382 -0.400 18792 1322 1 2 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.460 -0.443 18792 1323 1 2 . 1 1 114 114 LEU H H 114 8.161 8.161 7.891 0.270 18792 1324 1 2 . 1 1 115 115 CYS N N 115 119.002 119.002 118.296 0.706 18792 1325 1 2 . 1 1 115 115 CYS C C 115 176.087 176.087 176.671 -0.584 18792 1326 1 2 . 1 1 115 115 CYS CA C 115 63.944 63.944 64.055 -0.111 18792 1327 1 2 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.350 -1.715 18792 1328 1 2 . 1 1 115 115 CYS H H 115 8.070 8.070 7.934 0.136 18792 1329 1 2 . 1 1 116 116 VAL N N 116 118.737 118.737 119.068 -0.331 18792 1330 1 2 . 1 1 116 116 VAL C C 116 177.494 177.494 178.525 -1.031 18792 1331 1 2 . 1 1 116 116 VAL CA C 116 66.762 66.762 65.836 0.926 18792 1332 1 2 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.289 -0.526 18792 1333 1 2 . 1 1 116 116 VAL H H 116 7.995 7.995 7.590 0.405 18792 1334 1 2 . 1 1 117 117 GLU N N 117 118.886 118.886 120.565 -1.679 18792 1335 1 2 . 1 1 117 117 GLU C C 117 178.424 178.424 179.130 -0.706 18792 1336 1 2 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.183 -0.423 18792 1337 1 2 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.190 -1.136 18792 1338 1 2 . 1 1 117 117 GLU H H 117 8.059 8.059 8.304 -0.245 18792 1339 1 2 . 1 1 118 118 SER N N 118 113.417 113.417 116.176 -2.759 18792 1340 1 2 . 1 1 118 118 SER C C 118 175.607 175.607 176.694 -1.087 18792 1341 1 2 . 1 1 118 118 SER CA C 118 62.638 62.638 62.143 0.495 18792 1342 1 2 . 1 1 118 118 SER CB C 118 61.061 61.061 63.104 -2.043 18792 1343 1 2 . 1 1 118 118 SER H H 118 7.626 7.626 8.225 -0.599 18792 1344 1 2 . 1 1 119 119 VAL N N 119 120.612 120.612 119.315 1.297 18792 1345 1 2 . 1 1 119 119 VAL C C 119 179.713 179.713 177.770 1.943 18792 1346 1 2 . 1 1 119 119 VAL CA C 119 66.225 66.225 66.221 0.004 18792 1347 1 2 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.109 -1.030 18792 1348 1 2 . 1 1 119 119 VAL H H 119 7.297 7.297 8.017 -0.720 18792 1349 1 2 . 1 1 120 120 ASP N N 120 122.546 122.546 121.505 1.041 18792 1350 1 2 . 1 1 120 120 ASP C C 120 178.057 178.057 177.608 0.449 18792 1351 1 2 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.547 0.442 18792 1352 1 2 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.954 -1.031 18792 1353 1 2 . 1 1 120 120 ASP H H 120 8.264 8.264 7.839 0.425 18792 1354 1 2 . 1 1 121 121 LYS N N 121 115.636 115.636 118.469 -2.833 18792 1355 1 2 . 1 1 121 121 LYS C C 121 175.159 175.159 175.775 -0.616 18792 1356 1 2 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.291 -1.031 18792 1357 1 2 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.572 -1.797 18792 1358 1 2 . 1 1 121 121 LYS H H 121 7.558 7.558 7.394 0.164 18792 1359 1 2 . 1 1 122 122 GLU N N 122 113.915 113.915 116.508 -2.593 18792 1360 1 2 . 1 1 122 122 GLU C C 122 176.109 176.109 175.976 0.133 18792 1361 1 2 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.243 -0.937 18792 1362 1 2 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.671 -3.339 18792 1363 1 2 . 1 1 122 122 GLU H H 122 7.826 7.826 7.812 0.014 18792 1364 1 2 . 1 1 124 124 GLN N N 124 119.233 119.233 121.079 -1.846 18792 1365 1 2 . 1 1 124 124 GLN C C 124 177.640 177.640 177.185 0.455 18792 1366 1 2 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.777 0.695 18792 1367 1 2 . 1 1 124 124 GLN CB C 124 26.490 26.490 26.846 -0.356 18792 1368 1 2 . 1 1 124 124 GLN H H 124 8.626 8.626 8.466 0.160 18792 1369 1 2 . 1 1 125 125 VAL N N 125 117.011 117.011 118.943 -1.932 18792 1370 1 2 . 1 1 125 125 VAL C C 125 175.826 175.826 177.215 -1.389 18792 1371 1 2 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.846 -1.710 18792 1372 1 2 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.378 -1.081 18792 1373 1 2 . 1 1 125 125 VAL H H 125 7.870 7.870 7.876 -0.006 18792 1374 1 2 . 1 1 126 126 LEU N N 126 117.058 117.058 116.767 0.291 18792 1375 1 2 . 1 1 126 126 LEU C C 126 178.096 178.096 178.157 -0.061 18792 1376 1 2 . 1 1 126 126 LEU CA C 126 55.085 55.085 58.060 -2.975 18792 1377 1 2 . 1 1 126 126 LEU CB C 126 40.273 40.273 41.457 -1.184 18792 1378 1 2 . 1 1 126 126 LEU H H 126 7.747 7.747 8.070 -0.323 18792 1379 1 2 . 1 1 127 127 VAL N N 127 119.457 119.457 121.025 -1.568 18792 1380 1 2 . 1 1 127 127 VAL C C 127 177.150 177.150 178.213 -1.063 18792 1381 1 2 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.090 1.066 18792 1382 1 2 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.204 -0.451 18792 1383 1 2 . 1 1 127 127 VAL H H 127 7.306 7.306 7.772 -0.466 18792 1384 1 2 . 1 1 128 128 SER N N 128 110.647 110.647 114.942 -4.295 18792 1385 1 2 . 1 1 128 128 SER C C 128 177.222 177.222 176.803 0.419 18792 1386 1 2 . 1 1 128 128 SER CA C 128 60.752 60.752 61.486 -0.734 18792 1387 1 2 . 1 1 128 128 SER CB C 128 61.605 61.605 62.950 -1.345 18792 1388 1 2 . 1 1 128 128 SER H H 128 8.237 8.237 7.911 0.326 18792 1389 1 2 . 1 1 129 129 ARG N N 129 123.100 123.100 122.385 0.715 18792 1390 1 2 . 1 1 129 129 ARG C C 129 175.802 175.802 178.766 -2.964 18792 1391 1 2 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.022 -0.795 18792 1392 1 2 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.083 -1.884 18792 1393 1 2 . 1 1 129 129 ARG H H 129 6.564 6.564 7.820 -1.256 18792 1394 1 2 . 1 1 130 130 ILE N N 130 118.182 118.182 117.155 1.027 18792 1395 1 2 . 1 1 130 130 ILE C C 130 178.156 178.156 177.921 0.235 18792 1396 1 2 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.331 -0.985 18792 1397 1 2 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.701 -1.019 18792 1398 1 2 . 1 1 130 130 ILE H H 130 7.955 7.955 8.605 -0.650 18792 1399 1 2 . 1 1 131 131 ALA N N 131 119.029 119.029 121.864 -2.835 18792 1400 1 2 . 1 1 131 131 ALA C C 131 179.593 179.593 179.352 0.241 18792 1401 1 2 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.033 -0.435 18792 1402 1 2 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.194 -0.806 18792 1403 1 2 . 1 1 131 131 ALA H H 131 7.582 7.582 8.674 -1.092 18792 1404 1 2 . 1 1 132 132 ALA N N 132 120.336 120.336 122.480 -2.144 18792 1405 1 2 . 1 1 132 132 ALA C C 132 181.095 181.095 179.540 1.555 18792 1406 1 2 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.784 -0.186 18792 1407 1 2 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.506 -1.805 18792 1408 1 2 . 1 1 132 132 ALA H H 132 7.224 7.224 8.005 -0.781 18792 1409 1 2 . 1 1 133 133 TRP N N 133 121.194 121.194 120.690 0.504 18792 1410 1 2 . 1 1 133 133 TRP C C 133 179.698 179.698 178.072 1.626 18792 1411 1 2 . 1 1 133 133 TRP CA C 133 57.302 57.302 61.345 -4.043 18792 1412 1 2 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.796 -2.141 18792 1413 1 2 . 1 1 133 133 TRP H H 133 8.925 8.925 8.764 0.161 18792 1414 1 2 . 1 1 134 134 MET N N 134 116.987 116.987 117.342 -0.355 18792 1415 1 2 . 1 1 134 134 MET C C 134 178.277 178.277 178.559 -0.282 18792 1416 1 2 . 1 1 134 134 MET CA C 134 59.578 59.578 58.282 1.296 18792 1417 1 2 . 1 1 134 134 MET CB C 134 33.559 33.559 31.899 1.660 18792 1418 1 2 . 1 1 134 134 MET H H 134 8.863 8.863 7.997 0.866 18792 1419 1 2 . 1 1 135 135 ALA N N 135 120.523 120.523 121.599 -1.076 18792 1420 1 2 . 1 1 135 135 ALA C C 135 179.298 179.298 179.487 -0.189 18792 1421 1 2 . 1 1 135 135 ALA CA C 135 55.433 55.433 54.999 0.434 18792 1422 1 2 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.424 -1.787 18792 1423 1 2 . 1 1 135 135 ALA H H 135 8.152 8.152 8.402 -0.250 18792 1424 1 2 . 1 1 136 136 THR N N 136 116.715 116.715 118.091 -1.376 18792 1425 1 2 . 1 1 136 136 THR C C 136 175.106 175.106 176.600 -1.494 18792 1426 1 2 . 1 1 136 136 THR CA C 136 66.729 66.729 67.188 -0.459 18792 1427 1 2 . 1 1 136 136 THR CB C 136 68.441 68.441 68.922 -0.481 18792 1428 1 2 . 1 1 136 136 THR H H 136 8.532 8.532 8.069 0.463 18792 1429 1 2 . 1 1 137 137 TYR N N 137 123.204 123.204 120.861 2.343 18792 1430 1 2 . 1 1 137 137 TYR C C 137 179.592 179.592 178.069 1.523 18792 1431 1 2 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.829 1.236 18792 1432 1 2 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.232 -0.244 18792 1433 1 2 . 1 1 137 137 TYR H H 137 8.809 8.809 7.796 1.013 18792 1434 1 2 . 1 1 138 138 LEU N N 138 119.247 119.247 121.484 -2.237 18792 1435 1 2 . 1 1 138 138 LEU C C 138 178.385 178.385 177.787 0.598 18792 1436 1 2 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.397 0.541 18792 1437 1 2 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.169 -0.461 18792 1438 1 2 . 1 1 138 138 LEU H H 138 8.742 8.742 7.947 0.795 18792 1439 1 2 . 1 1 139 139 ASN N N 139 117.122 117.122 116.739 0.383 18792 1440 1 2 . 1 1 139 139 ASN C C 139 176.417 176.417 177.579 -1.162 18792 1441 1 2 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.768 0.680 18792 1442 1 2 . 1 1 139 139 ASN CB C 139 38.652 38.652 37.824 0.828 18792 1443 1 2 . 1 1 139 139 ASN H H 139 8.307 8.307 8.175 0.132 18792 1444 1 2 . 1 1 140 140 ASP N N 140 115.394 115.394 120.202 -4.808 18792 1445 1 2 . 1 1 140 140 ASP C C 140 177.919 177.919 176.298 1.621 18792 1446 1 2 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.899 -0.946 18792 1447 1 2 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.030 -1.644 18792 1448 1 2 . 1 1 140 140 ASP H H 140 8.439 8.439 8.025 0.414 18792 1449 1 2 . 1 1 141 141 HIS N N 141 111.695 111.695 114.410 -2.715 18792 1450 1 2 . 1 1 141 141 HIS C C 141 175.949 175.949 176.833 -0.884 18792 1451 1 2 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.016 0.041 18792 1452 1 2 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.855 -2.947 18792 1453 1 2 . 1 1 141 141 HIS H H 141 8.043 8.043 7.381 0.662 18792 1454 1 2 . 1 1 142 142 LEU N N 142 117.054 117.054 122.431 -5.377 18792 1455 1 2 . 1 1 142 142 LEU C C 142 176.530 176.530 177.816 -1.286 18792 1456 1 2 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.326 -3.017 18792 1457 1 2 . 1 1 142 142 LEU CB C 142 42.338 42.338 42.221 0.117 18792 1458 1 2 . 1 1 142 142 LEU H H 142 7.198 7.198 8.471 -1.273 18792 1459 1 2 . 1 1 143 143 GLU N N 143 121.335 121.335 120.064 1.271 18792 1460 1 2 . 1 1 143 143 GLU C C 143 173.964 173.964 175.908 -1.944 18792 1461 1 2 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.975 -0.721 18792 1462 1 2 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.097 -1.840 18792 1463 1 2 . 1 1 143 143 GLU H H 143 8.565 8.565 8.130 0.435 18792 1464 1 2 . 1 1 145 145 TRP N N 145 117.973 117.973 119.889 -1.916 18792 1465 1 2 . 1 1 145 145 TRP C C 145 179.526 179.526 177.583 1.943 18792 1466 1 2 . 1 1 145 145 TRP CA C 145 61.606 61.606 59.341 2.265 18792 1467 1 2 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.921 -2.033 18792 1468 1 2 . 1 1 145 145 TRP H H 145 7.078 7.078 8.101 -1.023 18792 1469 1 2 . 1 1 146 146 ILE N N 146 122.101 122.101 111.031 11.070 18792 1470 1 2 . 1 1 146 146 ILE C C 146 179.110 179.110 177.251 1.859 18792 1471 1 2 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.147 4.187 18792 1472 1 2 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.973 -1.151 18792 1473 1 2 . 1 1 146 146 ILE H H 146 8.389 8.389 7.538 0.851 18792 1474 1 2 . 1 1 147 147 GLN N N 147 116.344 116.344 121.560 -5.216 18792 1475 1 2 . 1 1 147 147 GLN C C 147 179.526 179.526 177.759 1.767 18792 1476 1 2 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.850 -0.837 18792 1477 1 2 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.384 -1.661 18792 1478 1 2 . 1 1 147 147 GLN H H 147 8.376 8.376 8.125 0.251 18792 1479 1 2 . 1 1 148 148 GLU N N 148 118.913 118.913 120.398 -1.485 18792 1480 1 2 . 1 1 148 148 GLU C C 148 176.880 176.880 178.237 -1.357 18792 1481 1 2 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.629 -3.256 18792 1482 1 2 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.436 -1.004 18792 1483 1 2 . 1 1 148 148 GLU H H 148 7.504 7.504 8.070 -0.566 18792 1484 1 2 . 1 1 149 149 ASN N N 149 116.616 116.616 114.258 2.358 18792 1485 1 2 . 1 1 149 149 ASN C C 149 173.964 173.964 176.902 -2.938 18792 1486 1 2 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.642 -0.396 18792 1487 1 2 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.496 -2.363 18792 1488 1 2 . 1 1 149 149 ASN H H 149 7.070 7.070 8.208 -1.138 18792 1489 1 2 . 1 1 150 150 GLY N N 150 104.750 104.750 105.663 -0.913 18792 1490 1 2 . 1 1 150 150 GLY C C 150 176.022 176.022 174.178 1.844 18792 1491 1 2 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.781 -0.539 18792 1492 1 2 . 1 1 150 150 GLY H H 150 7.313 7.313 8.179 -0.866 18792 1493 1 2 . 1 1 151 151 GLY N N 151 108.385 108.385 108.354 0.031 18792 1494 1 2 . 1 1 151 151 GLY C C 151 173.449 173.449 174.591 -1.142 18792 1495 1 2 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.804 -0.772 18792 1496 1 2 . 1 1 151 151 GLY H H 151 8.452 8.452 7.510 0.942 18792 1497 1 2 . 1 1 152 152 TRP N N 152 118.092 118.092 122.314 -4.222 18792 1498 1 2 . 1 1 152 152 TRP C C 152 178.571 178.571 178.004 0.567 18792 1499 1 2 . 1 1 152 152 TRP CA C 152 60.077 60.077 62.350 -2.273 18792 1500 1 2 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.737 -1.149 18792 1501 1 2 . 1 1 152 152 TRP H H 152 8.644 8.644 9.026 -0.382 18792 1502 1 2 . 1 1 153 153 ASP N N 153 117.758 117.758 117.877 -0.119 18792 1503 1 2 . 1 1 153 153 ASP C C 153 179.796 179.796 178.645 1.151 18792 1504 1 2 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.487 -0.186 18792 1505 1 2 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.012 -1.781 18792 1506 1 2 . 1 1 153 153 ASP H H 153 8.827 8.827 8.329 0.498 18792 1507 1 2 . 1 1 154 154 THR N N 154 116.817 116.817 117.840 -1.023 18792 1508 1 2 . 1 1 154 154 THR C C 154 175.352 175.352 176.887 -1.535 18792 1509 1 2 . 1 1 154 154 THR CA C 154 65.910 65.910 66.856 -0.946 18792 1510 1 2 . 1 1 154 154 THR CB C 154 67.712 67.712 69.044 -1.332 18792 1511 1 2 . 1 1 154 154 THR H H 154 7.494 7.494 7.678 -0.184 18792 1512 1 2 . 1 1 155 155 PHE N N 155 122.196 122.196 121.726 0.470 18792 1513 1 2 . 1 1 155 155 PHE C C 155 176.831 176.831 177.988 -1.157 18792 1514 1 2 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.749 0.537 18792 1515 1 2 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.422 -1.755 18792 1516 1 2 . 1 1 155 155 PHE H H 155 6.477 6.477 8.869 -2.392 18792 1517 1 2 . 1 1 156 156 VAL N N 156 117.387 117.387 117.540 -0.153 18792 1518 1 2 . 1 1 156 156 VAL C C 156 178.497 178.497 177.665 0.832 18792 1519 1 2 . 1 1 156 156 VAL CA C 156 66.231 66.231 65.425 0.806 18792 1520 1 2 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.286 -0.601 18792 1521 1 2 . 1 1 156 156 VAL H H 156 7.788 7.788 8.044 -0.256 18792 1522 1 2 . 1 1 157 157 GLU N N 157 119.876 119.876 120.069 -0.193 18792 1523 1 2 . 1 1 157 157 GLU C C 157 178.399 178.399 177.843 0.556 18792 1524 1 2 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.451 0.309 18792 1525 1 2 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.816 -1.539 18792 1526 1 2 . 1 1 157 157 GLU H H 157 7.409 7.409 7.944 -0.535 18792 1527 1 2 . 1 1 158 158 LEU N N 158 117.194 117.194 118.759 -1.565 18792 1528 1 2 . 1 1 158 158 LEU C C 158 178.595 178.595 176.117 2.478 18792 1529 1 2 . 1 1 158 158 LEU CA C 158 56.377 56.377 54.805 1.572 18792 1530 1 2 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.556 0.015 18792 1531 1 2 . 1 1 158 158 LEU H H 158 7.584 7.584 7.820 -0.236 18792 1532 1 2 . 1 1 159 159 TYR N N 159 115.549 115.549 113.703 1.846 18792 1533 1 2 . 1 1 159 159 TYR C C 159 177.032 177.032 175.841 1.191 18792 1534 1 2 . 1 1 159 159 TYR CA C 159 59.116 59.116 58.174 0.942 18792 1535 1 2 . 1 1 159 159 TYR CB C 159 37.599 37.599 35.043 2.556 18792 1536 1 2 . 1 1 159 159 TYR H H 159 8.099 8.099 7.033 1.066 18792 1537 1 2 . 1 1 160 160 GLY N N 160 108.334 108.334 104.660 3.674 18792 1538 1 2 . 1 1 160 160 GLY C C 160 173.973 173.973 172.681 1.292 18792 1539 1 2 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.806 0.258 18792 1540 1 2 . 1 1 160 160 GLY H H 160 8.020 8.020 8.026 -0.006 18792 1541 1 2 . 1 1 161 161 ASN N N 161 118.189 118.189 118.145 0.044 18792 1542 1 2 . 1 1 161 161 ASN C C 161 175.513 175.513 173.121 2.392 18792 1543 1 2 . 1 1 161 161 ASN CA C 161 53.104 53.104 52.268 0.836 18792 1544 1 2 . 1 1 161 161 ASN CB C 161 38.203 38.203 41.962 -3.759 18792 1545 1 2 . 1 1 161 161 ASN H H 161 8.327 8.327 7.913 0.414 18792 1546 1 2 . 1 1 162 162 ASN N N 162 119.022 119.022 117.207 1.815 18792 1547 1 2 . 1 1 162 162 ASN C C 162 175.690 175.690 174.487 1.203 18792 1548 1 2 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.154 0.270 18792 1549 1 2 . 1 1 162 162 ASN CB C 162 38.203 38.203 40.274 -2.071 18792 1550 1 2 . 1 1 162 162 ASN H H 162 8.363 8.363 8.511 -0.148 18792 1551 1 2 . 1 1 163 163 ALA N N 163 123.275 123.275 126.318 -3.043 18792 1552 1 2 . 1 1 163 163 ALA C C 163 178.598 178.598 178.754 -0.156 18792 1553 1 2 . 1 1 163 163 ALA CA C 163 53.238 53.238 54.190 -0.952 18792 1554 1 2 . 1 1 163 163 ALA CB C 163 17.611 17.611 18.980 -1.369 18792 1555 1 2 . 1 1 163 163 ALA H H 163 8.103 8.103 8.422 -0.320 18792 1556 1 2 . 1 1 164 164 ALA N N 164 121.521 121.521 120.696 0.825 18792 1557 1 2 . 1 1 164 164 ALA C C 164 178.642 178.642 179.437 -0.795 18792 1558 1 2 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.358 -1.774 18792 1559 1 2 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.222 -0.403 18792 1560 1 2 . 1 1 164 164 ALA H H 164 8.053 8.053 8.222 -0.169 18792 1561 1 2 . 1 1 165 165 ALA N N 165 122.101 122.101 120.263 1.838 18792 1562 1 2 . 1 1 165 165 ALA C C 165 179.124 179.124 179.014 0.110 18792 1563 1 2 . 1 1 165 165 ALA CA C 165 53.139 53.139 53.539 -0.400 18792 1564 1 2 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.503 -0.525 18792 1565 1 2 . 1 1 165 165 ALA H H 165 7.949 7.949 8.131 -0.182 18792 1566 1 2 . 1 1 166 166 GLU N N 166 118.381 118.381 117.186 1.195 18792 1567 1 2 . 1 1 166 166 GLU C C 166 177.664 177.664 177.300 0.364 18792 1568 1 2 . 1 1 166 166 GLU CA C 166 57.088 57.088 58.227 -1.139 18792 1569 1 2 . 1 1 166 166 GLU CB C 166 28.354 28.354 28.855 -0.501 18792 1570 1 2 . 1 1 166 166 GLU H H 166 8.202 8.202 8.020 0.182 18792 1571 1 2 . 1 1 167 167 SER N N 167 115.193 115.193 112.758 2.435 18792 1572 1 2 . 1 1 167 167 SER C C 167 175.312 175.312 174.772 0.540 18792 1573 1 2 . 1 1 167 167 SER CA C 167 58.831 58.831 59.720 -0.889 18792 1574 1 2 . 1 1 167 167 SER CB C 167 62.537 62.537 63.352 -0.815 18792 1575 1 2 . 1 1 167 167 SER H H 167 8.029 8.029 7.559 0.470 18792 1576 1 2 . 1 1 168 168 ARG N N 168 121.696 121.696 117.781 3.915 18792 1577 1 2 . 1 1 168 168 ARG C C 168 176.880 176.880 175.163 1.717 18792 1578 1 2 . 1 1 168 168 ARG CA C 168 56.163 56.163 57.029 -0.867 18792 1579 1 2 . 1 1 168 168 ARG CB C 168 29.209 29.209 27.628 1.581 18792 1580 1 2 . 1 1 168 168 ARG H H 168 7.967 7.967 7.410 0.557 18792 1581 1 2 . 1 1 169 169 LYS N N 169 120.917 120.917 120.317 0.600 18792 1582 1 2 . 1 1 169 169 LYS C C 169 177.640 177.640 177.647 -0.007 18792 1583 1 2 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.988 -0.291 18792 1584 1 2 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.762 -1.300 18792 1585 1 2 . 1 1 169 169 LYS H H 169 8.011 8.011 7.532 0.479 18792 1586 1 2 . 1 1 170 170 GLY N N 170 109.155 109.155 110.170 -1.015 18792 1587 1 2 . 1 1 170 170 GLY C C 170 174.479 174.479 174.138 0.341 18792 1588 1 2 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.935 0.128 18792 1589 1 2 . 1 1 170 170 GLY H H 170 8.329 8.329 8.546 -0.217 18792 1590 1 2 . 1 1 171 171 GLN N N 171 119.292 119.292 122.736 -3.444 18792 1591 1 2 . 1 1 171 171 GLN C C 171 176.463 176.463 174.595 1.868 18792 1592 1 2 . 1 1 171 171 GLN CA C 171 55.666 55.666 56.714 -1.048 18792 1593 1 2 . 1 1 171 171 GLN CB C 171 28.199 28.199 27.905 0.294 18792 1594 1 2 . 1 1 171 171 GLN H H 171 8.035 8.035 8.633 -0.598 18792 1595 1 2 . 1 1 172 172 GLU N N 172 121.703 121.703 122.314 -0.611 18792 1596 1 2 . 1 1 172 172 GLU C C 172 176.414 176.414 174.640 1.774 18792 1597 1 2 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.301 1.040 18792 1598 1 2 . 1 1 172 172 GLU CB C 172 28.821 28.821 33.372 -4.551 18792 1599 1 2 . 1 1 172 172 GLU H H 172 8.405 8.405 8.484 -0.079 18792 1600 1 2 . 1 1 173 173 ARG N N 173 121.852 121.852 120.116 1.736 18792 1601 1 2 . 1 1 173 173 ARG C C 173 176.365 176.365 175.026 1.339 18792 1602 1 2 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.687 0.512 18792 1603 1 2 . 1 1 173 173 ARG CB C 173 29.131 29.131 32.392 -3.261 18792 1604 1 2 . 1 1 173 173 ARG H H 173 8.335 8.335 8.704 -0.369 18792 1605 1 2 . 1 1 174 174 LEU N N 174 122.640 122.640 120.981 1.659 18792 1606 1 2 . 1 1 174 174 LEU C C 174 176.523 176.523 176.478 0.045 18792 1607 1 2 . 1 1 174 174 LEU CA C 174 54.768 54.768 53.113 1.655 18792 1608 1 2 . 1 1 174 174 LEU CB C 174 40.784 40.784 44.149 -3.365 18792 1609 1 2 . 1 1 174 174 LEU H H 174 8.082 8.082 8.438 -0.356 18792 1610 1 2 . 1 1 175 175 GLU N N 175 125.909 125.909 120.276 5.633 18792 1611 1 2 . 1 1 175 175 GLU C C 175 181.029 181.029 175.630 5.399 18792 1612 1 2 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.646 1.752 18792 1613 1 2 . 1 1 175 175 GLU CB C 175 30.050 30.050 30.620 -0.570 18792 1614 1 2 . 1 1 175 175 GLU H H 175 7.785 7.785 8.374 -0.589 18792 1615 1 3 . 1 1 4 4 ALA N N 4 124.786 124.786 125.949 -1.163 18792 1616 1 3 . 1 1 4 4 ALA C C 4 178.272 178.272 178.311 -0.039 18792 1617 1 3 . 1 1 4 4 ALA CA C 4 52.566 52.566 53.911 -1.345 18792 1618 1 3 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.959 -0.725 18792 1619 1 3 . 1 1 4 4 ALA H H 4 8.414 8.414 8.591 -0.177 18792 1620 1 3 . 1 1 5 5 MET N N 5 119.681 119.681 115.515 4.166 18792 1621 1 3 . 1 1 5 5 MET C C 5 176.929 176.929 176.650 0.279 18792 1622 1 3 . 1 1 5 5 MET CA C 5 55.594 55.594 55.504 0.090 18792 1623 1 3 . 1 1 5 5 MET CB C 5 31.540 31.540 31.631 -0.090 18792 1624 1 3 . 1 1 5 5 MET H H 5 8.336 8.336 8.053 0.283 18792 1625 1 3 . 1 1 6 6 SER N N 6 116.162 116.162 116.466 -0.304 18792 1626 1 3 . 1 1 6 6 SER C C 6 175.924 175.924 175.869 0.055 18792 1627 1 3 . 1 1 6 6 SER CA C 6 59.009 59.009 60.669 -1.660 18792 1628 1 3 . 1 1 6 6 SER CB C 6 62.537 62.537 63.131 -0.594 18792 1629 1 3 . 1 1 6 6 SER H H 6 8.272 8.272 8.312 -0.040 18792 1630 1 3 . 1 1 7 7 GLN N N 7 122.263 122.263 120.433 1.830 18792 1631 1 3 . 1 1 7 7 GLN C C 7 177.027 177.027 177.592 -0.565 18792 1632 1 3 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.298 -2.028 18792 1633 1 3 . 1 1 7 7 GLN CB C 7 27.739 27.739 27.536 0.203 18792 1634 1 3 . 1 1 7 7 GLN H H 7 8.314 8.314 8.016 0.298 18792 1635 1 3 . 1 1 8 8 SER N N 8 116.625 116.625 116.737 -0.112 18792 1636 1 3 . 1 1 8 8 SER C C 8 176.457 176.457 176.272 0.185 18792 1637 1 3 . 1 1 8 8 SER CA C 8 59.650 59.650 61.645 -1.995 18792 1638 1 3 . 1 1 8 8 SER CB C 8 62.226 62.226 63.164 -0.938 18792 1639 1 3 . 1 1 8 8 SER H H 8 8.333 8.333 7.866 0.467 18792 1640 1 3 . 1 1 9 9 ASN N N 9 121.307 121.307 119.276 2.031 18792 1641 1 3 . 1 1 9 9 ASN C C 9 177.419 177.419 177.314 0.105 18792 1642 1 3 . 1 1 9 9 ASN CA C 9 55.487 55.487 55.971 -0.484 18792 1643 1 3 . 1 1 9 9 ASN CB C 9 37.133 37.133 37.743 -0.610 18792 1644 1 3 . 1 1 9 9 ASN H H 9 8.611 8.611 7.922 0.689 18792 1645 1 3 . 1 1 10 10 ARG N N 10 119.830 119.830 121.044 -1.214 18792 1646 1 3 . 1 1 10 10 ARG C C 10 177.615 177.615 178.406 -0.791 18792 1647 1 3 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.399 -0.141 18792 1648 1 3 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.382 -2.183 18792 1649 1 3 . 1 1 10 10 ARG H H 10 7.996 7.996 7.765 0.231 18792 1650 1 3 . 1 1 11 11 GLU N N 11 117.270 117.270 120.341 -3.071 18792 1651 1 3 . 1 1 11 11 GLU C C 11 179.649 179.649 178.389 1.260 18792 1652 1 3 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.426 -0.417 18792 1653 1 3 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.671 -1.550 18792 1654 1 3 . 1 1 11 11 GLU H H 11 7.885 7.885 8.430 -0.545 18792 1655 1 3 . 1 1 12 12 LEU N N 12 119.900 119.900 121.519 -1.619 18792 1656 1 3 . 1 1 12 12 LEU C C 12 178.473 178.473 179.339 -0.866 18792 1657 1 3 . 1 1 12 12 LEU CA C 12 57.693 57.693 57.936 -0.243 18792 1658 1 3 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.265 -0.636 18792 1659 1 3 . 1 1 12 12 LEU H H 12 7.691 7.691 8.136 -0.445 18792 1660 1 3 . 1 1 13 13 VAL N N 13 117.320 117.320 119.218 -1.898 18792 1661 1 3 . 1 1 13 13 VAL C C 13 177.272 177.272 177.647 -0.375 18792 1662 1 3 . 1 1 13 13 VAL CA C 13 67.156 67.156 65.535 1.621 18792 1663 1 3 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.548 -0.319 18792 1664 1 3 . 1 1 13 13 VAL H H 13 7.629 7.629 7.776 -0.147 18792 1665 1 3 . 1 1 14 14 VAL N N 14 116.659 116.659 120.388 -3.729 18792 1666 1 3 . 1 1 14 14 VAL C C 14 178.718 178.718 177.717 1.001 18792 1667 1 3 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.078 0.438 18792 1668 1 3 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.668 -1.294 18792 1669 1 3 . 1 1 14 14 VAL H H 14 8.210 8.210 7.797 0.413 18792 1670 1 3 . 1 1 15 15 ASP N N 15 120.374 120.374 120.716 -0.342 18792 1671 1 3 . 1 1 15 15 ASP C C 15 177.557 177.557 177.811 -0.254 18792 1672 1 3 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.185 1.291 18792 1673 1 3 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.903 1.650 18792 1674 1 3 . 1 1 15 15 ASP H H 15 7.967 7.967 8.740 -0.773 18792 1675 1 3 . 1 1 16 16 PHE N N 16 119.864 119.864 120.952 -1.088 18792 1676 1 3 . 1 1 16 16 PHE C C 16 178.252 178.252 177.273 0.979 18792 1677 1 3 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.567 2.213 18792 1678 1 3 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.923 0.137 18792 1679 1 3 . 1 1 16 16 PHE H H 16 8.228 8.228 8.085 0.143 18792 1680 1 3 . 1 1 17 17 LEU N N 17 116.312 116.312 117.904 -1.592 18792 1681 1 3 . 1 1 17 17 LEU C C 17 179.649 179.649 178.282 1.367 18792 1682 1 3 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.599 -0.835 18792 1683 1 3 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.407 -1.323 18792 1684 1 3 . 1 1 17 17 LEU H H 17 8.766 8.766 7.853 0.913 18792 1685 1 3 . 1 1 18 18 SER N N 18 113.715 113.715 115.647 -1.932 18792 1686 1 3 . 1 1 18 18 SER C C 18 177.362 177.362 176.410 0.952 18792 1687 1 3 . 1 1 18 18 SER CA C 18 61.948 61.948 61.370 0.578 18792 1688 1 3 . 1 1 18 18 SER CB C 18 63.003 63.003 63.470 -0.467 18792 1689 1 3 . 1 1 18 18 SER H H 18 8.384 8.384 7.842 0.542 18792 1690 1 3 . 1 1 19 19 TYR N N 19 124.570 124.570 123.100 1.470 18792 1691 1 3 . 1 1 19 19 TYR C C 19 178.415 178.415 177.783 0.632 18792 1692 1 3 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.622 -1.858 18792 1693 1 3 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.817 -1.801 18792 1694 1 3 . 1 1 19 19 TYR H H 19 8.155 8.155 8.930 -0.775 18792 1695 1 3 . 1 1 20 20 LYS N N 20 119.739 119.739 120.694 -0.955 18792 1696 1 3 . 1 1 20 20 LYS C C 20 180.456 180.456 178.782 1.674 18792 1697 1 3 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.977 -2.489 18792 1698 1 3 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.351 -4.192 18792 1699 1 3 . 1 1 20 20 LYS H H 20 8.224 8.224 7.787 0.437 18792 1700 1 3 . 1 1 21 21 LEU N N 21 118.092 118.092 120.580 -2.488 18792 1701 1 3 . 1 1 21 21 LEU C C 21 179.989 179.989 178.344 1.645 18792 1702 1 3 . 1 1 21 21 LEU CA C 21 58.126 58.126 57.997 0.129 18792 1703 1 3 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.910 -2.302 18792 1704 1 3 . 1 1 21 21 LEU H H 21 8.586 8.586 7.830 0.756 18792 1705 1 3 . 1 1 22 22 SER N N 22 117.304 117.304 112.930 4.374 18792 1706 1 3 . 1 1 22 22 SER C C 22 180.152 180.152 176.978 3.174 18792 1707 1 3 . 1 1 22 22 SER CA C 22 61.287 61.287 60.857 0.430 18792 1708 1 3 . 1 1 22 22 SER H H 22 8.266 8.266 7.610 0.656 18792 1709 1 3 . 1 1 23 23 GLN N N 23 122.497 122.497 121.894 0.603 18792 1710 1 3 . 1 1 23 23 GLN C C 23 177.297 177.297 177.599 -0.302 18792 1711 1 3 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.223 -0.281 18792 1712 1 3 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.566 -0.755 18792 1713 1 3 . 1 1 23 23 GLN H H 23 7.571 7.571 7.838 -0.267 18792 1714 1 3 . 1 1 24 24 LYS N N 24 116.038 116.038 116.237 -0.199 18792 1715 1 3 . 1 1 24 24 LYS C C 24 175.704 175.704 176.809 -1.105 18792 1716 1 3 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.512 -3.017 18792 1717 1 3 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.104 -1.875 18792 1718 1 3 . 1 1 24 24 LYS H H 24 7.134 7.134 7.737 -0.603 18792 1719 1 3 . 1 1 25 25 GLY N N 25 105.283 105.283 106.770 -1.487 18792 1720 1 3 . 1 1 25 25 GLY C C 25 174.013 174.013 173.087 0.926 18792 1721 1 3 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.601 0.178 18792 1722 1 3 . 1 1 25 25 GLY H H 25 7.483 7.483 7.893 -0.410 18792 1723 1 3 . 1 1 26 26 TYR N N 26 119.547 119.547 118.473 1.074 18792 1724 1 3 . 1 1 26 26 TYR C C 26 175.122 175.122 173.837 1.285 18792 1725 1 3 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.586 -1.454 18792 1726 1 3 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.972 0.108 18792 1727 1 3 . 1 1 26 26 TYR H H 26 7.788 7.788 7.453 0.335 18792 1728 1 3 . 1 1 27 27 SER N N 27 115.088 115.088 115.848 -0.760 18792 1729 1 3 . 1 1 27 27 SER C C 27 174.452 174.452 175.045 -0.593 18792 1730 1 3 . 1 1 27 27 SER CA C 27 56.306 56.306 55.413 0.893 18792 1731 1 3 . 1 1 27 27 SER CB C 27 63.921 63.921 65.258 -1.337 18792 1732 1 3 . 1 1 27 27 SER H H 27 8.473 8.473 8.015 0.458 18792 1733 1 3 . 1 1 28 28 TRP N N 28 127.014 127.014 122.227 4.787 18792 1734 1 3 . 1 1 28 28 TRP C C 28 177.002 177.002 177.073 -0.071 18792 1735 1 3 . 1 1 28 28 TRP CA C 28 59.472 59.472 58.618 0.854 18792 1736 1 3 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.650 0.180 18792 1737 1 3 . 1 1 28 28 TRP H H 28 8.897 8.897 8.135 0.762 18792 1738 1 3 . 1 1 29 29 SER N N 29 112.044 112.044 110.017 2.027 18792 1739 1 3 . 1 1 29 29 SER C C 29 175.106 175.106 175.124 -0.018 18792 1740 1 3 . 1 1 29 29 SER CA C 29 59.472 59.472 58.322 1.150 18792 1741 1 3 . 1 1 29 29 SER CB C 29 62.226 62.226 63.583 -1.357 18792 1742 1 3 . 1 1 29 29 SER H H 29 8.129 8.129 8.009 0.120 18792 1743 1 3 . 1 1 30 30 GLN N N 30 119.160 119.160 119.181 -0.021 18792 1744 1 3 . 1 1 30 30 GLN C C 30 176.218 176.218 176.521 -0.303 18792 1745 1 3 . 1 1 30 30 GLN CA C 30 56.412 56.412 56.530 -0.118 18792 1746 1 3 . 1 1 30 30 GLN CB C 30 27.578 27.578 30.853 -3.275 18792 1747 1 3 . 1 1 30 30 GLN H H 30 7.370 7.370 8.076 -0.706 18792 1748 1 3 . 1 1 31 31 PHE N N 31 116.277 116.277 121.313 -5.036 18792 1749 1 3 . 1 1 31 31 PHE C C 31 175.217 175.217 174.895 0.322 18792 1750 1 3 . 1 1 31 31 PHE CA C 31 56.234 56.234 56.630 -0.396 18792 1751 1 3 . 1 1 31 31 PHE CB C 31 39.066 39.066 39.251 -0.185 18792 1752 1 3 . 1 1 31 31 PHE H H 31 7.248 7.248 8.426 -1.178 18792 1753 1 3 . 1 1 32 32 SER N N 32 113.683 113.683 115.145 -1.462 18792 1754 1 3 . 1 1 32 32 SER C C 32 173.793 173.793 174.443 -0.650 18792 1755 1 3 . 1 1 32 32 SER CA C 32 57.124 57.124 60.332 -3.208 18792 1756 1 3 . 1 1 32 32 SER CB C 32 63.081 63.081 63.599 -0.518 18792 1757 1 3 . 1 1 32 32 SER H H 32 7.242 7.242 8.156 -0.914 18792 1758 1 3 . 1 1 33 33 ASP N N 33 122.195 122.195 118.220 3.975 18792 1759 1 3 . 1 1 33 33 ASP C C 33 176.394 176.394 175.254 1.140 18792 1760 1 3 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.813 -2.065 18792 1761 1 3 . 1 1 33 33 ASP CB C 33 40.398 40.398 39.483 0.915 18792 1762 1 3 . 1 1 33 33 ASP H H 33 8.257 8.257 8.860 -0.603 18792 1763 1 3 . 1 1 34 34 VAL N N 34 118.913 118.913 116.299 2.614 18792 1764 1 3 . 1 1 34 34 VAL C C 34 176.328 176.328 175.430 0.898 18792 1765 1 3 . 1 1 34 34 VAL CA C 34 61.891 61.891 61.822 0.069 18792 1766 1 3 . 1 1 34 34 VAL CB C 34 32.015 32.015 33.662 -1.647 18792 1767 1 3 . 1 1 34 34 VAL H H 34 7.852 7.852 7.469 0.383 18792 1768 1 3 . 1 1 35 35 GLU N N 35 124.205 124.205 118.596 5.609 18792 1769 1 3 . 1 1 35 35 GLU C C 35 176.586 176.586 175.624 0.962 18792 1770 1 3 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.634 -1.577 18792 1771 1 3 . 1 1 35 35 GLU CB C 35 28.898 28.898 29.950 -1.052 18792 1772 1 3 . 1 1 35 35 GLU H H 35 8.401 8.401 7.695 0.706 18792 1773 1 3 . 1 1 36 36 GLU N N 36 121.670 121.670 116.321 5.349 18792 1774 1 3 . 1 1 36 36 GLU C C 36 176.218 176.218 176.039 0.179 18792 1775 1 3 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.748 -0.760 18792 1776 1 3 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.094 -0.652 18792 1777 1 3 . 1 1 36 36 GLU H H 36 8.239 8.239 8.824 -0.585 18792 1778 1 3 . 1 1 37 37 ASN N N 37 119.252 119.252 119.425 -0.173 18792 1779 1 3 . 1 1 37 37 ASN C C 37 175.003 175.003 173.680 1.323 18792 1780 1 3 . 1 1 37 37 ASN CA C 37 52.655 52.655 54.056 -1.401 18792 1781 1 3 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.040 -0.828 18792 1782 1 3 . 1 1 37 37 ASN H H 37 8.412 8.412 8.489 -0.077 18792 1783 1 3 . 1 1 38 38 ARG N N 38 121.622 121.622 119.595 2.027 18792 1784 1 3 . 1 1 38 38 ARG C C 38 176.610 176.610 175.366 1.244 18792 1785 1 3 . 1 1 38 38 ARG CA C 38 55.364 55.364 55.291 0.073 18792 1786 1 3 . 1 1 38 38 ARG CB C 38 29.419 29.419 30.911 -1.492 18792 1787 1 3 . 1 1 38 38 ARG H H 38 8.227 8.227 8.174 0.053 18792 1788 1 3 . 1 1 39 39 THR N N 39 115.681 115.681 114.958 0.723 18792 1789 1 3 . 1 1 39 39 THR C C 39 174.500 174.500 174.400 0.100 18792 1790 1 3 . 1 1 39 39 THR CA C 39 61.606 61.606 63.062 -1.456 18792 1791 1 3 . 1 1 39 39 THR CB C 39 69.163 69.163 68.842 0.321 18792 1792 1 3 . 1 1 39 39 THR H H 39 8.173 8.173 7.900 0.273 18792 1793 1 3 . 1 1 40 40 GLU N N 40 122.708 122.708 119.598 3.110 18792 1794 1 3 . 1 1 40 40 GLU C C 40 175.728 175.728 175.386 0.342 18792 1795 1 3 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.506 -0.734 18792 1796 1 3 . 1 1 40 40 GLU CB C 40 29.054 29.054 27.120 1.934 18792 1797 1 3 . 1 1 40 40 GLU H H 40 8.298 8.298 8.620 -0.322 18792 1798 1 3 . 1 1 41 41 ALA N N 41 125.922 125.922 122.687 3.235 18792 1799 1 3 . 1 1 41 41 ALA C C 41 175.557 175.557 176.303 -0.746 18792 1800 1 3 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.586 -1.613 18792 1801 1 3 . 1 1 41 41 ALA CB C 41 17.245 17.245 19.234 -1.989 18792 1802 1 3 . 1 1 41 41 ALA H H 41 8.212 8.212 8.017 0.195 18792 1803 1 3 . 1 1 43 43 GLU N N 43 120.783 120.783 116.367 4.416 18792 1804 1 3 . 1 1 43 43 GLU C C 43 177.174 177.174 176.042 1.132 18792 1805 1 3 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.478 -0.137 18792 1806 1 3 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.009 0.278 18792 1807 1 3 . 1 1 43 43 GLU H H 43 8.519 8.519 8.461 0.058 18792 1808 1 3 . 1 1 44 44 GLY N N 44 110.022 110.022 105.239 4.783 18792 1809 1 3 . 1 1 44 44 GLY C C 44 174.773 174.773 174.279 0.494 18792 1810 1 3 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.003 0.025 18792 1811 1 3 . 1 1 44 44 GLY H H 44 8.429 8.429 8.156 0.273 18792 1812 1 3 . 1 1 45 45 THR N N 45 112.790 112.790 113.663 -0.873 18792 1813 1 3 . 1 1 45 45 THR C C 45 175.726 175.726 175.581 0.145 18792 1814 1 3 . 1 1 45 45 THR CA C 45 61.987 61.987 61.709 0.278 18792 1815 1 3 . 1 1 45 45 THR CB C 45 69.304 69.304 69.166 0.138 18792 1816 1 3 . 1 1 45 45 THR H H 45 8.125 8.125 7.762 0.363 18792 1817 1 3 . 1 1 46 46 GLU N N 46 122.752 122.752 120.151 2.601 18792 1818 1 3 . 1 1 46 46 GLU C C 46 177.419 177.419 175.680 1.739 18792 1819 1 3 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.838 0.393 18792 1820 1 3 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.658 -1.459 18792 1821 1 3 . 1 1 46 46 GLU H H 46 8.765 8.765 8.467 0.298 18792 1822 1 3 . 1 1 47 47 SER N N 47 114.895 114.895 110.247 4.648 18792 1823 1 3 . 1 1 47 47 SER C C 47 175.826 175.826 175.355 0.471 18792 1824 1 3 . 1 1 47 47 SER CA C 47 58.582 58.582 57.707 0.875 18792 1825 1 3 . 1 1 47 47 SER CB C 47 62.537 62.537 64.147 -1.610 18792 1826 1 3 . 1 1 47 47 SER H H 47 8.355 8.355 7.706 0.649 18792 1827 1 3 . 1 1 48 48 GLU N N 48 122.429 122.429 122.291 0.138 18792 1828 1 3 . 1 1 48 48 GLU C C 48 178.099 178.099 177.274 0.825 18792 1829 1 3 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.294 -0.676 18792 1830 1 3 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.286 -0.811 18792 1831 1 3 . 1 1 48 48 GLU H H 48 8.139 8.139 7.665 0.474 18792 1832 1 3 . 1 1 49 49 ALA N N 49 120.374 120.374 123.214 -2.840 18792 1833 1 3 . 1 1 49 49 ALA C C 49 180.843 180.843 179.153 1.690 18792 1834 1 3 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.782 -0.299 18792 1835 1 3 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.215 -0.780 18792 1836 1 3 . 1 1 49 49 ALA H H 49 8.079 8.079 8.242 -0.163 18792 1837 1 3 . 1 1 50 50 VAL N N 50 118.599 118.599 118.789 -0.190 18792 1838 1 3 . 1 1 50 50 VAL C C 50 176.921 176.921 177.300 -0.379 18792 1839 1 3 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.782 -0.222 18792 1840 1 3 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.794 -0.497 18792 1841 1 3 . 1 1 50 50 VAL H H 50 7.419 7.419 7.758 -0.339 18792 1842 1 3 . 1 1 51 51 LYS N N 51 117.469 117.469 119.726 -2.257 18792 1843 1 3 . 1 1 51 51 LYS C C 51 179.061 179.061 178.580 0.481 18792 1844 1 3 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.505 -0.282 18792 1845 1 3 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.873 -0.877 18792 1846 1 3 . 1 1 51 51 LYS H H 51 7.359 7.359 7.827 -0.468 18792 1847 1 3 . 1 1 52 52 GLN N N 52 115.930 115.930 117.699 -1.769 18792 1848 1 3 . 1 1 52 52 GLN C C 52 177.713 177.713 178.049 -0.336 18792 1849 1 3 . 1 1 52 52 GLN CA C 52 58.476 58.476 57.880 0.596 18792 1850 1 3 . 1 1 52 52 GLN CB C 52 26.568 26.568 27.528 -0.960 18792 1851 1 3 . 1 1 52 52 GLN H H 52 8.025 8.025 7.394 0.631 18792 1852 1 3 . 1 1 53 53 ALA N N 53 119.782 119.782 122.728 -2.946 18792 1853 1 3 . 1 1 53 53 ALA C C 53 180.008 180.008 179.363 0.645 18792 1854 1 3 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.655 -0.270 18792 1855 1 3 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.483 -0.968 18792 1856 1 3 . 1 1 53 53 ALA H H 53 7.655 7.655 7.535 0.120 18792 1857 1 3 . 1 1 54 54 LEU N N 54 120.443 120.443 119.059 1.384 18792 1858 1 3 . 1 1 54 54 LEU C C 54 179.330 179.330 178.001 1.329 18792 1859 1 3 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.805 1.208 18792 1860 1 3 . 1 1 54 54 LEU CB C 54 40.862 40.862 40.724 0.138 18792 1861 1 3 . 1 1 54 54 LEU H H 54 8.419 8.419 7.899 0.520 18792 1862 1 3 . 1 1 55 55 ARG N N 55 118.423 118.423 119.284 -0.861 18792 1863 1 3 . 1 1 55 55 ARG C C 55 178.767 178.767 178.258 0.509 18792 1864 1 3 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.790 0.607 18792 1865 1 3 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.027 -1.284 18792 1866 1 3 . 1 1 55 55 ARG H H 55 8.062 8.062 7.644 0.418 18792 1867 1 3 . 1 1 56 56 GLU N N 56 115.988 115.988 119.344 -3.356 18792 1868 1 3 . 1 1 56 56 GLU C C 56 180.090 180.090 178.587 1.503 18792 1869 1 3 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.342 -0.582 18792 1870 1 3 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.832 -1.478 18792 1871 1 3 . 1 1 56 56 GLU H H 56 7.772 7.772 8.133 -0.361 18792 1872 1 3 . 1 1 57 57 ALA N N 57 122.837 122.837 121.076 1.761 18792 1873 1 3 . 1 1 57 57 ALA C C 57 181.861 181.861 180.089 1.772 18792 1874 1 3 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.969 -0.336 18792 1875 1 3 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.579 -0.107 18792 1876 1 3 . 1 1 57 57 ALA H H 57 8.774 8.774 8.227 0.547 18792 1877 1 3 . 1 1 58 58 GLY N N 58 108.409 108.409 106.547 1.862 18792 1878 1 3 . 1 1 58 58 GLY C C 58 175.331 175.331 175.904 -0.573 18792 1879 1 3 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.883 -0.215 18792 1880 1 3 . 1 1 58 58 GLY H H 58 9.073 9.073 8.556 0.517 18792 1881 1 3 . 1 1 59 59 ASP N N 59 122.074 122.074 122.540 -0.466 18792 1882 1 3 . 1 1 59 59 ASP C C 59 179.023 179.023 177.907 1.116 18792 1883 1 3 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.688 -0.386 18792 1884 1 3 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.132 -2.290 18792 1885 1 3 . 1 1 59 59 ASP H H 59 8.049 8.049 8.296 -0.247 18792 1886 1 3 . 1 1 60 60 GLU N N 60 120.131 120.131 120.251 -0.120 18792 1887 1 3 . 1 1 60 60 GLU C C 60 178.522 178.522 178.904 -0.382 18792 1888 1 3 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.466 -0.457 18792 1889 1 3 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.669 -1.470 18792 1890 1 3 . 1 1 60 60 GLU H H 60 8.136 8.136 8.173 -0.037 18792 1891 1 3 . 1 1 61 61 PHE N N 61 121.309 121.309 118.984 2.325 18792 1892 1 3 . 1 1 61 61 PHE C C 61 176.904 176.904 178.151 -1.247 18792 1893 1 3 . 1 1 61 61 PHE CA C 61 61.322 61.322 62.068 -0.746 18792 1894 1 3 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.404 -0.795 18792 1895 1 3 . 1 1 61 61 PHE H H 61 8.523 8.523 8.258 0.265 18792 1896 1 3 . 1 1 62 62 GLU N N 62 115.971 115.971 120.092 -4.121 18792 1897 1 3 . 1 1 62 62 GLU C C 62 177.713 177.713 178.349 -0.636 18792 1898 1 3 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.436 -1.245 18792 1899 1 3 . 1 1 62 62 GLU CB C 62 28.277 28.277 30.046 -1.769 18792 1900 1 3 . 1 1 62 62 GLU H H 62 7.969 7.969 8.272 -0.303 18792 1901 1 3 . 1 1 63 63 LEU N N 63 116.703 116.703 119.074 -2.371 18792 1902 1 3 . 1 1 63 63 LEU C C 63 178.963 178.963 178.349 0.614 18792 1903 1 3 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.866 -0.454 18792 1904 1 3 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.239 -0.833 18792 1905 1 3 . 1 1 63 63 LEU H H 63 7.347 7.347 8.024 -0.677 18792 1906 1 3 . 1 1 64 64 ARG N N 64 117.453 117.453 117.850 -0.397 18792 1907 1 3 . 1 1 64 64 ARG C C 64 177.297 177.297 177.227 0.070 18792 1908 1 3 . 1 1 64 64 ARG CA C 64 57.337 57.337 58.401 -1.064 18792 1909 1 3 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.478 -0.881 18792 1910 1 3 . 1 1 64 64 ARG H H 64 7.995 7.995 8.079 -0.084 18792 1911 1 3 . 1 1 65 65 TYR N N 65 118.956 118.956 117.326 1.630 18792 1912 1 3 . 1 1 65 65 TYR C C 65 175.278 175.278 177.102 -1.824 18792 1913 1 3 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.071 -2.370 18792 1914 1 3 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.325 -3.339 18792 1915 1 3 . 1 1 65 65 TYR H H 65 7.909 7.909 7.741 0.168 18792 1916 1 3 . 1 1 66 66 ARG N N 66 119.438 119.438 117.322 2.116 18792 1917 1 3 . 1 1 66 66 ARG C C 66 178.424 178.424 178.451 -0.027 18792 1918 1 3 . 1 1 66 66 ARG CA C 66 58.476 58.476 59.478 -1.002 18792 1919 1 3 . 1 1 66 66 ARG CB C 66 28.821 28.821 28.540 0.281 18792 1920 1 3 . 1 1 66 66 ARG H H 66 7.244 7.244 8.325 -1.081 18792 1921 1 3 . 1 1 67 67 ARG N N 67 118.936 118.936 120.197 -1.261 18792 1922 1 3 . 1 1 67 67 ARG C C 67 177.542 177.542 177.297 0.245 18792 1923 1 3 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.064 -1.620 18792 1924 1 3 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.891 -1.770 18792 1925 1 3 . 1 1 67 67 ARG H H 67 8.417 8.417 8.356 0.061 18792 1926 1 3 . 1 1 68 68 ALA N N 68 121.797 121.797 121.471 0.326 18792 1927 1 3 . 1 1 68 68 ALA C C 68 180.337 180.337 179.770 0.567 18792 1928 1 3 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.827 -0.690 18792 1929 1 3 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.289 -0.822 18792 1930 1 3 . 1 1 68 68 ALA H H 68 7.827 7.827 8.276 -0.449 18792 1931 1 3 . 1 1 69 69 PHE N N 69 115.986 115.986 116.303 -0.317 18792 1932 1 3 . 1 1 69 69 PHE C C 69 177.468 177.468 177.280 0.188 18792 1933 1 3 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.291 -1.242 18792 1934 1 3 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.263 -0.664 18792 1935 1 3 . 1 1 69 69 PHE H H 69 8.517 8.517 7.796 0.721 18792 1936 1 3 . 1 1 70 70 SER N N 70 116.526 116.526 118.063 -1.537 18792 1937 1 3 . 1 1 70 70 SER C C 70 177.640 177.640 176.447 1.193 18792 1938 1 3 . 1 1 70 70 SER CA C 70 61.073 61.073 62.366 -1.293 18792 1939 1 3 . 1 1 70 70 SER CB C 70 61.993 61.993 62.220 -0.227 18792 1940 1 3 . 1 1 70 70 SER H H 70 8.152 8.152 7.302 0.850 18792 1941 1 3 . 1 1 71 71 ASP N N 71 121.181 121.181 121.380 -0.199 18792 1942 1 3 . 1 1 71 71 ASP C C 71 178.546 178.546 178.196 0.350 18792 1943 1 3 . 1 1 71 71 ASP CA C 71 56.448 56.448 56.899 -0.451 18792 1944 1 3 . 1 1 71 71 ASP CB C 71 39.231 39.231 41.168 -1.937 18792 1945 1 3 . 1 1 71 71 ASP H H 71 8.356 8.356 8.130 0.226 18792 1946 1 3 . 1 1 72 72 LEU N N 72 120.747 120.747 121.405 -0.658 18792 1947 1 3 . 1 1 72 72 LEU C C 72 178.963 178.963 178.565 0.398 18792 1948 1 3 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.279 -0.835 18792 1949 1 3 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.254 -1.237 18792 1950 1 3 . 1 1 72 72 LEU H H 72 7.738 7.738 7.494 0.244 18792 1951 1 3 . 1 1 73 73 THR N N 73 109.432 109.432 112.610 -3.178 18792 1952 1 3 . 1 1 73 73 THR C C 73 177.481 177.481 176.747 0.734 18792 1953 1 3 . 1 1 73 73 THR CA C 73 65.128 65.128 66.424 -1.296 18792 1954 1 3 . 1 1 73 73 THR CB C 73 67.720 67.720 68.665 -0.945 18792 1955 1 3 . 1 1 73 73 THR H H 73 8.296 8.296 8.461 -0.165 18792 1956 1 3 . 1 1 74 74 SER N N 74 115.862 115.862 114.079 1.783 18792 1957 1 3 . 1 1 74 74 SER C C 74 175.361 175.361 175.420 -0.059 18792 1958 1 3 . 1 1 74 74 SER CA C 74 60.112 60.112 60.190 -0.078 18792 1959 1 3 . 1 1 74 74 SER CB C 74 62.537 62.537 63.034 -0.497 18792 1960 1 3 . 1 1 74 74 SER H H 74 7.629 7.629 7.586 0.043 18792 1961 1 3 . 1 1 75 75 GLN N N 75 118.551 118.551 118.712 -0.161 18792 1962 1 3 . 1 1 75 75 GLN C C 75 176.316 176.316 177.305 -0.989 18792 1963 1 3 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.330 0.474 18792 1964 1 3 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.160 -0.883 18792 1965 1 3 . 1 1 75 75 GLN H H 75 7.640 7.640 7.485 0.155 18792 1966 1 3 . 1 1 76 76 LEU N N 76 118.313 118.313 117.940 0.373 18792 1967 1 3 . 1 1 76 76 LEU C C 76 174.160 174.160 176.187 -2.027 18792 1968 1 3 . 1 1 76 76 LEU CA C 76 54.740 54.740 56.225 -1.485 18792 1969 1 3 . 1 1 76 76 LEU CB C 76 42.727 42.727 42.387 0.340 18792 1970 1 3 . 1 1 76 76 LEU H H 76 7.411 7.411 7.193 0.218 18792 1971 1 3 . 1 1 77 77 HIS N N 77 120.104 120.104 115.162 4.942 18792 1972 1 3 . 1 1 77 77 HIS C C 77 174.528 174.528 174.893 -0.365 18792 1973 1 3 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.957 -1.750 18792 1974 1 3 . 1 1 77 77 HIS CB C 77 27.966 27.966 27.567 0.399 18792 1975 1 3 . 1 1 77 77 HIS H H 77 8.117 8.117 7.573 0.544 18792 1976 1 3 . 1 1 78 78 ILE N N 78 122.298 122.298 121.608 0.690 18792 1977 1 3 . 1 1 78 78 ILE C C 78 174.240 174.240 176.450 -2.210 18792 1978 1 3 . 1 1 78 78 ILE CA C 78 61.402 61.402 63.174 -1.772 18792 1979 1 3 . 1 1 78 78 ILE CB C 78 37.591 37.591 38.228 -0.637 18792 1980 1 3 . 1 1 78 78 ILE H H 78 8.655 8.655 8.525 0.130 18792 1981 1 3 . 1 1 79 79 THR N N 79 116.442 116.442 112.927 3.515 18792 1982 1 3 . 1 1 79 79 THR C C 79 174.291 174.291 174.131 0.160 18792 1983 1 3 . 1 1 79 79 THR CA C 79 61.632 61.632 63.271 -1.639 18792 1984 1 3 . 1 1 79 79 THR CB C 79 68.704 68.704 67.050 1.653 18792 1985 1 3 . 1 1 79 79 THR H H 79 8.245 8.245 7.953 0.292 18792 1986 1 3 . 1 1 84 84 TYR N N 84 120.888 120.888 120.824 0.064 18792 1987 1 3 . 1 1 84 84 TYR C C 84 176.708 176.708 177.344 -0.636 18792 1988 1 3 . 1 1 84 84 TYR CA C 84 60.432 60.432 60.678 -0.246 18792 1989 1 3 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.390 -0.645 18792 1990 1 3 . 1 1 84 84 TYR H H 84 8.733 8.733 8.444 0.289 18792 1991 1 3 . 1 1 85 85 GLN N N 85 114.530 114.530 118.701 -4.171 18792 1992 1 3 . 1 1 85 85 GLN C C 85 178.473 178.473 178.208 0.265 18792 1993 1 3 . 1 1 85 85 GLN CA C 85 59.294 59.294 58.709 0.585 18792 1994 1 3 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.932 -1.131 18792 1995 1 3 . 1 1 85 85 GLN H H 85 8.413 8.413 7.681 0.732 18792 1996 1 3 . 1 1 86 86 SER N N 86 114.032 114.032 115.922 -1.890 18792 1997 1 3 . 1 1 86 86 SER C C 86 178.473 178.473 176.315 2.158 18792 1998 1 3 . 1 1 86 86 SER CA C 86 62.175 62.175 61.528 0.647 18792 1999 1 3 . 1 1 86 86 SER CB C 86 63.252 63.252 62.437 0.815 18792 2000 1 3 . 1 1 86 86 SER H H 86 7.258 7.258 7.692 -0.434 18792 2001 1 3 . 1 1 88 88 GLU N N 88 119.386 119.386 118.943 0.443 18792 2002 1 3 . 1 1 88 88 GLU C C 88 177.199 177.199 179.208 -2.009 18792 2003 1 3 . 1 1 88 88 GLU CA C 88 58.582 58.582 60.081 -1.498 18792 2004 1 3 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.406 -0.430 18792 2005 1 3 . 1 1 88 88 GLU H H 88 8.534 8.534 8.618 -0.084 18792 2006 1 3 . 1 1 89 89 GLN N N 89 114.678 114.678 119.032 -4.354 18792 2007 1 3 . 1 1 89 89 GLN C C 89 178.669 178.669 178.672 -0.003 18792 2008 1 3 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.287 -0.705 18792 2009 1 3 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.960 -1.538 18792 2010 1 3 . 1 1 89 89 GLN H H 89 7.500 7.500 7.801 -0.301 18792 2011 1 3 . 1 1 90 90 VAL N N 90 118.174 118.174 120.369 -2.195 18792 2012 1 3 . 1 1 90 90 VAL C C 90 178.081 178.081 178.262 -0.181 18792 2013 1 3 . 1 1 90 90 VAL CA C 90 65.555 65.555 66.258 -0.703 18792 2014 1 3 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.266 -0.659 18792 2015 1 3 . 1 1 90 90 VAL H H 90 7.017 7.017 8.383 -1.366 18792 2016 1 3 . 1 1 91 91 VAL N N 91 119.489 119.489 120.447 -0.958 18792 2017 1 3 . 1 1 91 91 VAL C C 91 177.914 177.914 177.952 -0.038 18792 2018 1 3 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.531 -0.762 18792 2019 1 3 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.849 -0.558 18792 2020 1 3 . 1 1 91 91 VAL H H 91 7.833 7.833 8.339 -0.506 18792 2021 1 3 . 1 1 92 92 ASN N N 92 117.180 117.180 117.736 -0.556 18792 2022 1 3 . 1 1 92 92 ASN C C 92 179.110 179.110 177.014 2.096 18792 2023 1 3 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.212 -1.294 18792 2024 1 3 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.744 -2.776 18792 2025 1 3 . 1 1 92 92 ASN H H 92 8.368 8.368 8.254 0.114 18792 2026 1 3 . 1 1 93 93 GLU N N 93 118.476 118.476 119.285 -0.809 18792 2027 1 3 . 1 1 93 93 GLU C C 93 179.355 179.355 179.260 0.095 18792 2028 1 3 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.911 -0.506 18792 2029 1 3 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.980 -2.247 18792 2030 1 3 . 1 1 93 93 GLU H H 93 7.213 7.213 7.901 -0.688 18792 2031 1 3 . 1 1 94 94 LEU N N 94 120.889 120.889 120.623 0.266 18792 2032 1 3 . 1 1 94 94 LEU C C 94 178.473 178.473 178.645 -0.172 18792 2033 1 3 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.062 -0.045 18792 2034 1 3 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.200 -2.270 18792 2035 1 3 . 1 1 94 94 LEU H H 94 7.446 7.446 8.230 -0.784 18792 2036 1 3 . 1 1 95 95 PHE N N 95 112.902 112.902 118.651 -5.749 18792 2037 1 3 . 1 1 95 95 PHE C C 95 176.586 176.586 176.925 -0.339 18792 2038 1 3 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.480 -2.321 18792 2039 1 3 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.174 -0.953 18792 2040 1 3 . 1 1 95 95 PHE H H 95 6.916 6.916 8.459 -1.543 18792 2041 1 3 . 1 1 96 96 ARG N N 96 123.729 123.729 118.677 5.052 18792 2042 1 3 . 1 1 96 96 ARG C C 96 177.272 177.272 176.781 0.491 18792 2043 1 3 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.149 1.074 18792 2044 1 3 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.474 -2.042 18792 2045 1 3 . 1 1 96 96 ARG H H 96 7.126 7.126 7.417 -0.291 18792 2046 1 3 . 1 1 97 97 ASP N N 97 116.576 116.576 115.446 1.130 18792 2047 1 3 . 1 1 97 97 ASP C C 97 175.687 175.687 174.324 1.363 18792 2048 1 3 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.058 -0.385 18792 2049 1 3 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.175 -3.130 18792 2050 1 3 . 1 1 97 97 ASP H H 97 8.644 8.644 7.692 0.952 18792 2051 1 3 . 1 1 98 98 GLY N N 98 108.551 108.551 107.247 1.304 18792 2052 1 3 . 1 1 98 98 GLY C C 98 172.690 172.690 172.467 0.223 18792 2053 1 3 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.127 -1.877 18792 2054 1 3 . 1 1 98 98 GLY H H 98 7.463 7.463 7.519 -0.056 18792 2055 1 3 . 1 1 99 99 VAL N N 99 120.630 120.630 122.605 -1.975 18792 2056 1 3 . 1 1 99 99 VAL C C 99 174.503 174.503 175.023 -0.520 18792 2057 1 3 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.521 -1.203 18792 2058 1 3 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.701 -1.938 18792 2059 1 3 . 1 1 99 99 VAL H H 99 8.184 8.184 8.474 -0.290 18792 2060 1 3 . 1 1 100 100 ASN N N 100 115.485 115.485 118.095 -2.610 18792 2061 1 3 . 1 1 100 100 ASN C C 100 175.239 175.239 176.705 -1.466 18792 2062 1 3 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.919 -3.558 18792 2063 1 3 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.532 0.388 18792 2064 1 3 . 1 1 100 100 ASN H H 100 6.241 6.241 8.190 -1.949 18792 2065 1 3 . 1 1 101 101 TRP N N 101 118.266 118.266 119.793 -1.527 18792 2066 1 3 . 1 1 101 101 TRP C C 101 178.301 178.301 175.495 2.806 18792 2067 1 3 . 1 1 101 101 TRP CA C 101 60.539 60.539 58.844 1.695 18792 2068 1 3 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.452 1.378 18792 2069 1 3 . 1 1 101 101 TRP H H 101 8.409 8.409 8.522 -0.113 18792 2070 1 3 . 1 1 102 102 GLY N N 102 106.147 106.147 104.966 1.181 18792 2071 1 3 . 1 1 102 102 GLY C C 102 177.640 177.640 175.021 2.619 18792 2072 1 3 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.404 2.510 18792 2073 1 3 . 1 1 102 102 GLY H H 102 8.504 8.504 7.432 1.072 18792 2074 1 3 . 1 1 103 103 ARG N N 103 121.347 121.347 121.482 -0.135 18792 2075 1 3 . 1 1 103 103 ARG C C 103 177.738 177.738 177.817 -0.079 18792 2076 1 3 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.598 -0.656 18792 2077 1 3 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.052 0.167 18792 2078 1 3 . 1 1 103 103 ARG H H 103 8.099 8.099 7.981 0.118 18792 2079 1 3 . 1 1 104 104 ILE N N 104 120.930 120.930 119.821 1.109 18792 2080 1 3 . 1 1 104 104 ILE C C 104 178.197 178.197 177.898 0.299 18792 2081 1 3 . 1 1 104 104 ILE CA C 104 66.535 66.535 65.388 1.147 18792 2082 1 3 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.328 -2.283 18792 2083 1 3 . 1 1 104 104 ILE H H 104 7.690 7.690 7.860 -0.170 18792 2084 1 3 . 1 1 105 105 VAL N N 105 120.938 120.938 119.508 1.430 18792 2085 1 3 . 1 1 105 105 VAL C C 105 177.854 177.854 177.893 -0.039 18792 2086 1 3 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.197 1.261 18792 2087 1 3 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.732 -0.358 18792 2088 1 3 . 1 1 105 105 VAL H H 105 8.245 8.245 7.548 0.697 18792 2089 1 3 . 1 1 106 106 ALA N N 106 121.165 121.165 121.238 -0.073 18792 2090 1 3 . 1 1 106 106 ALA C C 106 178.284 178.284 179.424 -1.140 18792 2091 1 3 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.031 0.567 18792 2092 1 3 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.534 -1.019 18792 2093 1 3 . 1 1 106 106 ALA H H 106 7.529 7.529 7.813 -0.284 18792 2094 1 3 . 1 1 107 107 PHE N N 107 119.242 119.242 120.491 -1.249 18792 2095 1 3 . 1 1 107 107 PHE C C 107 176.390 176.390 177.321 -0.931 18792 2096 1 3 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.915 -0.742 18792 2097 1 3 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.746 -1.659 18792 2098 1 3 . 1 1 107 107 PHE H H 107 7.974 7.974 7.903 0.071 18792 2099 1 3 . 1 1 108 108 PHE N N 108 120.009 120.009 119.353 0.656 18792 2100 1 3 . 1 1 108 108 PHE C C 108 177.640 177.640 176.588 1.052 18792 2101 1 3 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.567 0.857 18792 2102 1 3 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.793 -3.447 18792 2103 1 3 . 1 1 108 108 PHE H H 108 7.946 7.946 8.526 -0.580 18792 2104 1 3 . 1 1 109 109 SER N N 109 114.631 114.631 116.017 -1.386 18792 2105 1 3 . 1 1 109 109 SER C C 109 177.770 177.770 176.009 1.761 18792 2106 1 3 . 1 1 109 109 SER CA C 109 63.349 63.349 61.662 1.687 18792 2107 1 3 . 1 1 109 109 SER H H 109 8.424 8.424 7.642 0.782 18792 2108 1 3 . 1 1 110 110 PHE N N 110 124.230 124.230 123.905 0.325 18792 2109 1 3 . 1 1 110 110 PHE C C 110 176.708 176.708 177.161 -0.453 18792 2110 1 3 . 1 1 110 110 PHE CA C 110 59.614 59.614 60.561 -0.947 18792 2111 1 3 . 1 1 110 110 PHE CB C 110 37.444 37.444 39.035 -1.591 18792 2112 1 3 . 1 1 110 110 PHE H H 110 9.052 9.052 8.039 1.013 18792 2113 1 3 . 1 1 111 111 GLY N N 111 105.893 105.893 106.372 -0.479 18792 2114 1 3 . 1 1 111 111 GLY C C 111 176.795 176.795 175.671 1.124 18792 2115 1 3 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.563 0.813 18792 2116 1 3 . 1 1 111 111 GLY H H 111 7.926 7.926 8.717 -0.791 18792 2117 1 3 . 1 1 112 112 GLY N N 112 107.410 107.410 108.907 -1.497 18792 2118 1 3 . 1 1 112 112 GLY C C 112 174.650 174.650 175.663 -1.013 18792 2119 1 3 . 1 1 112 112 GLY CA C 112 47.305 47.305 45.682 1.623 18792 2120 1 3 . 1 1 112 112 GLY H H 112 8.799 8.799 8.003 0.796 18792 2121 1 3 . 1 1 113 113 ALA N N 113 124.313 124.313 124.955 -0.642 18792 2122 1 3 . 1 1 113 113 ALA C C 113 181.300 181.300 178.389 2.911 18792 2123 1 3 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.548 -0.021 18792 2124 1 3 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.539 -1.056 18792 2125 1 3 . 1 1 113 113 ALA H H 113 8.212 8.212 7.807 0.405 18792 2126 1 3 . 1 1 114 114 LEU N N 114 118.878 118.878 119.874 -0.996 18792 2127 1 3 . 1 1 114 114 LEU C C 114 180.286 180.286 178.240 2.046 18792 2128 1 3 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.502 -0.520 18792 2129 1 3 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.129 -0.112 18792 2130 1 3 . 1 1 114 114 LEU H H 114 8.161 8.161 7.769 0.392 18792 2131 1 3 . 1 1 115 115 CYS N N 115 119.002 119.002 117.100 1.902 18792 2132 1 3 . 1 1 115 115 CYS C C 115 176.087 176.087 176.834 -0.747 18792 2133 1 3 . 1 1 115 115 CYS CA C 115 63.944 63.944 61.779 2.165 18792 2134 1 3 . 1 1 115 115 CYS CB C 115 25.635 25.635 25.683 -0.048 18792 2135 1 3 . 1 1 115 115 CYS H H 115 8.070 8.070 7.897 0.173 18792 2136 1 3 . 1 1 116 116 VAL N N 116 118.737 118.737 122.181 -3.444 18792 2137 1 3 . 1 1 116 116 VAL C C 116 177.494 177.494 178.099 -0.605 18792 2138 1 3 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.741 0.021 18792 2139 1 3 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.597 -0.834 18792 2140 1 3 . 1 1 116 116 VAL H H 116 7.995 7.995 7.313 0.682 18792 2141 1 3 . 1 1 117 117 GLU N N 117 118.886 118.886 118.951 -0.065 18792 2142 1 3 . 1 1 117 117 GLU C C 117 178.424 178.424 178.954 -0.530 18792 2143 1 3 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.218 -0.458 18792 2144 1 3 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.432 -1.378 18792 2145 1 3 . 1 1 117 117 GLU H H 117 8.059 8.059 7.881 0.178 18792 2146 1 3 . 1 1 118 118 SER N N 118 113.417 113.417 115.512 -2.095 18792 2147 1 3 . 1 1 118 118 SER C C 118 175.607 175.607 176.374 -0.767 18792 2148 1 3 . 1 1 118 118 SER CA C 118 62.638 62.638 61.515 1.123 18792 2149 1 3 . 1 1 118 118 SER CB C 118 61.061 61.061 62.916 -1.855 18792 2150 1 3 . 1 1 118 118 SER H H 118 7.626 7.626 8.112 -0.486 18792 2151 1 3 . 1 1 119 119 VAL N N 119 120.612 120.612 121.759 -1.147 18792 2152 1 3 . 1 1 119 119 VAL C C 119 179.713 179.713 178.260 1.453 18792 2153 1 3 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.941 0.284 18792 2154 1 3 . 1 1 119 119 VAL CB C 119 30.079 30.079 30.564 -0.485 18792 2155 1 3 . 1 1 119 119 VAL H H 119 7.297 7.297 7.632 -0.335 18792 2156 1 3 . 1 1 120 120 ASP N N 120 122.546 122.546 118.898 3.648 18792 2157 1 3 . 1 1 120 120 ASP C C 120 178.057 178.057 177.139 0.918 18792 2158 1 3 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.595 0.394 18792 2159 1 3 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.486 -0.563 18792 2160 1 3 . 1 1 120 120 ASP H H 120 8.264 8.264 7.715 0.549 18792 2161 1 3 . 1 1 121 121 LYS N N 121 115.636 115.636 118.290 -2.654 18792 2162 1 3 . 1 1 121 121 LYS C C 121 175.159 175.159 175.914 -0.755 18792 2163 1 3 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.166 -0.906 18792 2164 1 3 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.123 -2.348 18792 2165 1 3 . 1 1 121 121 LYS H H 121 7.558 7.558 7.374 0.184 18792 2166 1 3 . 1 1 122 122 GLU N N 122 113.915 113.915 116.509 -2.594 18792 2167 1 3 . 1 1 122 122 GLU C C 122 176.109 176.109 175.963 0.146 18792 2168 1 3 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.952 -0.645 18792 2169 1 3 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.427 -3.095 18792 2170 1 3 . 1 1 122 122 GLU H H 122 7.826 7.826 7.897 -0.071 18792 2171 1 3 . 1 1 124 124 GLN N N 124 119.233 119.233 120.457 -1.224 18792 2172 1 3 . 1 1 124 124 GLN C C 124 177.640 177.640 176.885 0.755 18792 2173 1 3 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.687 0.785 18792 2174 1 3 . 1 1 124 124 GLN CB C 124 26.490 26.490 26.954 -0.464 18792 2175 1 3 . 1 1 124 124 GLN H H 124 8.626 8.626 8.525 0.101 18792 2176 1 3 . 1 1 125 125 VAL N N 125 117.011 117.011 117.886 -0.875 18792 2177 1 3 . 1 1 125 125 VAL C C 125 175.826 175.826 176.460 -0.634 18792 2178 1 3 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.861 -0.725 18792 2179 1 3 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.337 -1.040 18792 2180 1 3 . 1 1 125 125 VAL H H 125 7.870 7.870 7.783 0.087 18792 2181 1 3 . 1 1 126 126 LEU N N 126 117.058 117.058 119.650 -2.592 18792 2182 1 3 . 1 1 126 126 LEU C C 126 178.096 178.096 177.543 0.553 18792 2183 1 3 . 1 1 126 126 LEU CA C 126 55.085 55.085 56.920 -1.835 18792 2184 1 3 . 1 1 126 126 LEU CB C 126 40.273 40.273 43.256 -2.983 18792 2185 1 3 . 1 1 126 126 LEU H H 126 7.747 7.747 8.003 -0.256 18792 2186 1 3 . 1 1 127 127 VAL N N 127 119.457 119.457 118.065 1.392 18792 2187 1 3 . 1 1 127 127 VAL C C 127 177.150 177.150 177.263 -0.113 18792 2188 1 3 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.115 1.041 18792 2189 1 3 . 1 1 127 127 VAL CB C 127 29.753 29.753 31.120 -1.367 18792 2190 1 3 . 1 1 127 127 VAL H H 127 7.306 7.306 7.549 -0.243 18792 2191 1 3 . 1 1 128 128 SER N N 128 110.647 110.647 116.103 -5.456 18792 2192 1 3 . 1 1 128 128 SER C C 128 177.222 177.222 176.422 0.800 18792 2193 1 3 . 1 1 128 128 SER CA C 128 60.752 60.752 61.200 -0.448 18792 2194 1 3 . 1 1 128 128 SER CB C 128 61.605 61.605 63.049 -1.444 18792 2195 1 3 . 1 1 128 128 SER H H 128 8.237 8.237 7.766 0.471 18792 2196 1 3 . 1 1 129 129 ARG N N 129 123.100 123.100 122.375 0.725 18792 2197 1 3 . 1 1 129 129 ARG C C 129 175.802 175.802 178.763 -2.961 18792 2198 1 3 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.758 -0.531 18792 2199 1 3 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.026 -1.827 18792 2200 1 3 . 1 1 129 129 ARG H H 129 6.564 6.564 7.903 -1.339 18792 2201 1 3 . 1 1 130 130 ILE N N 130 118.182 118.182 117.480 0.702 18792 2202 1 3 . 1 1 130 130 ILE C C 130 178.156 178.156 177.687 0.469 18792 2203 1 3 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.097 -0.751 18792 2204 1 3 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.324 -0.642 18792 2205 1 3 . 1 1 130 130 ILE H H 130 7.955 7.955 8.017 -0.062 18792 2206 1 3 . 1 1 131 131 ALA N N 131 119.029 119.029 122.452 -3.423 18792 2207 1 3 . 1 1 131 131 ALA C C 131 179.593 179.593 179.404 0.189 18792 2208 1 3 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.123 -0.525 18792 2209 1 3 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.196 -0.808 18792 2210 1 3 . 1 1 131 131 ALA H H 131 7.582 7.582 8.122 -0.540 18792 2211 1 3 . 1 1 132 132 ALA N N 132 120.336 120.336 122.154 -1.818 18792 2212 1 3 . 1 1 132 132 ALA C C 132 181.095 181.095 178.980 2.115 18792 2213 1 3 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.857 -0.259 18792 2214 1 3 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.857 -2.156 18792 2215 1 3 . 1 1 132 132 ALA H H 132 7.224 7.224 8.019 -0.795 18792 2216 1 3 . 1 1 133 133 TRP N N 133 121.194 121.194 120.314 0.880 18792 2217 1 3 . 1 1 133 133 TRP C C 133 179.698 179.698 177.324 2.374 18792 2218 1 3 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.153 -2.851 18792 2219 1 3 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.888 -2.233 18792 2220 1 3 . 1 1 133 133 TRP H H 133 8.925 8.925 8.798 0.127 18792 2221 1 3 . 1 1 134 134 MET N N 134 116.987 116.987 117.162 -0.175 18792 2222 1 3 . 1 1 134 134 MET C C 134 178.277 178.277 178.506 -0.229 18792 2223 1 3 . 1 1 134 134 MET CA C 134 59.578 59.578 58.914 0.664 18792 2224 1 3 . 1 1 134 134 MET CB C 134 33.559 33.559 32.265 1.294 18792 2225 1 3 . 1 1 134 134 MET H H 134 8.863 8.863 8.310 0.553 18792 2226 1 3 . 1 1 135 135 ALA N N 135 120.523 120.523 121.428 -0.905 18792 2227 1 3 . 1 1 135 135 ALA C C 135 179.298 179.298 179.557 -0.259 18792 2228 1 3 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.148 0.285 18792 2229 1 3 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.195 -1.558 18792 2230 1 3 . 1 1 135 135 ALA H H 135 8.152 8.152 8.379 -0.227 18792 2231 1 3 . 1 1 136 136 THR N N 136 116.715 116.715 117.140 -0.425 18792 2232 1 3 . 1 1 136 136 THR C C 136 175.106 175.106 176.137 -1.031 18792 2233 1 3 . 1 1 136 136 THR CA C 136 66.729 66.729 67.727 -0.998 18792 2234 1 3 . 1 1 136 136 THR CB C 136 68.441 68.441 69.078 -0.637 18792 2235 1 3 . 1 1 136 136 THR H H 136 8.532 8.532 7.975 0.557 18792 2236 1 3 . 1 1 137 137 TYR N N 137 123.204 123.204 121.946 1.258 18792 2237 1 3 . 1 1 137 137 TYR C C 137 179.592 179.592 177.374 2.218 18792 2238 1 3 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.418 1.647 18792 2239 1 3 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.080 -0.092 18792 2240 1 3 . 1 1 137 137 TYR H H 137 8.809 8.809 7.530 1.279 18792 2241 1 3 . 1 1 138 138 LEU N N 138 119.247 119.247 121.207 -1.960 18792 2242 1 3 . 1 1 138 138 LEU C C 138 178.385 178.385 177.639 0.746 18792 2243 1 3 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.549 0.389 18792 2244 1 3 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.336 -0.628 18792 2245 1 3 . 1 1 138 138 LEU H H 138 8.742 8.742 8.508 0.234 18792 2246 1 3 . 1 1 139 139 ASN N N 139 117.122 117.122 115.869 1.253 18792 2247 1 3 . 1 1 139 139 ASN C C 139 176.417 176.417 177.525 -1.108 18792 2248 1 3 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.670 0.778 18792 2249 1 3 . 1 1 139 139 ASN CB C 139 38.652 38.652 37.944 0.708 18792 2250 1 3 . 1 1 139 139 ASN H H 139 8.307 8.307 7.993 0.314 18792 2251 1 3 . 1 1 140 140 ASP N N 140 115.394 115.394 119.450 -4.056 18792 2252 1 3 . 1 1 140 140 ASP C C 140 177.919 177.919 177.409 0.510 18792 2253 1 3 . 1 1 140 140 ASP CA C 140 55.953 55.953 57.023 -1.069 18792 2254 1 3 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.076 -1.690 18792 2255 1 3 . 1 1 140 140 ASP H H 140 8.439 8.439 7.798 0.641 18792 2256 1 3 . 1 1 141 141 HIS N N 141 111.695 111.695 113.924 -2.229 18792 2257 1 3 . 1 1 141 141 HIS C C 141 175.949 175.949 175.815 0.134 18792 2258 1 3 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.578 -0.521 18792 2259 1 3 . 1 1 141 141 HIS CB C 141 29.908 29.908 31.966 -2.058 18792 2260 1 3 . 1 1 141 141 HIS H H 141 8.043 8.043 7.453 0.590 18792 2261 1 3 . 1 1 142 142 LEU N N 142 117.054 117.054 122.253 -5.199 18792 2262 1 3 . 1 1 142 142 LEU C C 142 176.530 176.530 178.045 -1.515 18792 2263 1 3 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.662 -2.353 18792 2264 1 3 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.476 0.862 18792 2265 1 3 . 1 1 142 142 LEU H H 142 7.198 7.198 8.211 -1.013 18792 2266 1 3 . 1 1 143 143 GLU N N 143 121.335 121.335 120.258 1.077 18792 2267 1 3 . 1 1 143 143 GLU C C 143 173.964 173.964 175.544 -1.580 18792 2268 1 3 . 1 1 143 143 GLU CA C 143 60.254 60.254 61.306 -1.052 18792 2269 1 3 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.280 -2.023 18792 2270 1 3 . 1 1 143 143 GLU H H 143 8.565 8.565 7.846 0.719 18792 2271 1 3 . 1 1 145 145 TRP N N 145 117.973 117.973 119.940 -1.967 18792 2272 1 3 . 1 1 145 145 TRP C C 145 179.526 179.526 177.726 1.800 18792 2273 1 3 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.564 1.042 18792 2274 1 3 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.557 -1.669 18792 2275 1 3 . 1 1 145 145 TRP H H 145 7.078 7.078 8.199 -1.121 18792 2276 1 3 . 1 1 146 146 ILE N N 146 122.101 122.101 112.056 10.045 18792 2277 1 3 . 1 1 146 146 ILE C C 146 179.110 179.110 177.470 1.640 18792 2278 1 3 . 1 1 146 146 ILE CA C 146 65.334 65.334 62.076 3.258 18792 2279 1 3 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.305 -1.483 18792 2280 1 3 . 1 1 146 146 ILE H H 146 8.389 8.389 7.578 0.811 18792 2281 1 3 . 1 1 147 147 GLN N N 147 116.344 116.344 120.767 -4.423 18792 2282 1 3 . 1 1 147 147 GLN C C 147 179.526 179.526 177.990 1.536 18792 2283 1 3 . 1 1 147 147 GLN CA C 147 58.013 58.013 59.160 -1.147 18792 2284 1 3 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.194 -1.471 18792 2285 1 3 . 1 1 147 147 GLN H H 147 8.376 8.376 8.166 0.210 18792 2286 1 3 . 1 1 148 148 GLU N N 148 118.913 118.913 120.538 -1.625 18792 2287 1 3 . 1 1 148 148 GLU C C 148 176.880 176.880 177.175 -0.295 18792 2288 1 3 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.137 -2.764 18792 2289 1 3 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.486 -1.054 18792 2290 1 3 . 1 1 148 148 GLU H H 148 7.504 7.504 8.190 -0.686 18792 2291 1 3 . 1 1 149 149 ASN N N 149 116.616 116.616 112.632 3.984 18792 2292 1 3 . 1 1 149 149 ASN C C 149 173.964 173.964 176.663 -2.699 18792 2293 1 3 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.258 -0.012 18792 2294 1 3 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.386 -2.253 18792 2295 1 3 . 1 1 149 149 ASN H H 149 7.070 7.070 8.179 -1.109 18792 2296 1 3 . 1 1 150 150 GLY N N 150 104.750 104.750 107.180 -2.430 18792 2297 1 3 . 1 1 150 150 GLY C C 150 176.022 176.022 174.522 1.500 18792 2298 1 3 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.399 -0.157 18792 2299 1 3 . 1 1 150 150 GLY H H 150 7.313 7.313 8.200 -0.886 18792 2300 1 3 . 1 1 151 151 GLY N N 151 108.385 108.385 109.426 -1.041 18792 2301 1 3 . 1 1 151 151 GLY C C 151 173.449 173.449 175.056 -1.607 18792 2302 1 3 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.403 -1.371 18792 2303 1 3 . 1 1 151 151 GLY H H 151 8.452 8.452 7.510 0.942 18792 2304 1 3 . 1 1 152 152 TRP N N 152 118.092 118.092 122.286 -4.194 18792 2305 1 3 . 1 1 152 152 TRP C C 152 178.571 178.571 177.960 0.611 18792 2306 1 3 . 1 1 152 152 TRP CA C 152 60.077 60.077 61.703 -1.626 18792 2307 1 3 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.576 -0.988 18792 2308 1 3 . 1 1 152 152 TRP H H 152 8.644 8.644 9.080 -0.436 18792 2309 1 3 . 1 1 153 153 ASP N N 153 117.758 117.758 117.966 -0.208 18792 2310 1 3 . 1 1 153 153 ASP C C 153 179.796 179.796 178.702 1.094 18792 2311 1 3 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.970 -0.668 18792 2312 1 3 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.712 -1.481 18792 2313 1 3 . 1 1 153 153 ASP H H 153 8.827 8.827 8.688 0.139 18792 2314 1 3 . 1 1 154 154 THR N N 154 116.817 116.817 117.385 -0.568 18792 2315 1 3 . 1 1 154 154 THR C C 154 175.352 175.352 176.783 -1.431 18792 2316 1 3 . 1 1 154 154 THR CA C 154 65.910 65.910 66.605 -0.695 18792 2317 1 3 . 1 1 154 154 THR CB C 154 67.712 67.712 68.855 -1.143 18792 2318 1 3 . 1 1 154 154 THR H H 154 7.494 7.494 7.634 -0.140 18792 2319 1 3 . 1 1 155 155 PHE N N 155 122.196 122.196 121.576 0.620 18792 2320 1 3 . 1 1 155 155 PHE C C 155 176.831 176.831 177.481 -0.650 18792 2321 1 3 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.188 0.098 18792 2322 1 3 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.231 -1.564 18792 2323 1 3 . 1 1 155 155 PHE H H 155 6.477 6.477 8.673 -2.196 18792 2324 1 3 . 1 1 156 156 VAL N N 156 117.387 117.387 119.053 -1.666 18792 2325 1 3 . 1 1 156 156 VAL C C 156 178.497 178.497 178.242 0.255 18792 2326 1 3 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.796 -0.565 18792 2327 1 3 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.106 -0.421 18792 2328 1 3 . 1 1 156 156 VAL H H 156 7.788 7.788 8.102 -0.314 18792 2329 1 3 . 1 1 157 157 GLU N N 157 119.876 119.876 119.864 0.012 18792 2330 1 3 . 1 1 157 157 GLU C C 157 178.399 178.399 178.201 0.198 18792 2331 1 3 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.343 -0.583 18792 2332 1 3 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.673 -1.396 18792 2333 1 3 . 1 1 157 157 GLU H H 157 7.409 7.409 7.996 -0.587 18792 2334 1 3 . 1 1 158 158 LEU N N 158 117.194 117.194 119.462 -2.268 18792 2335 1 3 . 1 1 158 158 LEU C C 158 178.595 178.595 179.430 -0.835 18792 2336 1 3 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.643 -1.266 18792 2337 1 3 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.375 0.196 18792 2338 1 3 . 1 1 158 158 LEU H H 158 7.584 7.584 7.814 -0.230 18792 2339 1 3 . 1 1 159 159 TYR N N 159 115.549 115.549 120.735 -5.186 18792 2340 1 3 . 1 1 159 159 TYR C C 159 177.032 177.032 177.134 -0.102 18792 2341 1 3 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.417 -0.301 18792 2342 1 3 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.670 -1.071 18792 2343 1 3 . 1 1 159 159 TYR H H 159 8.099 8.099 8.476 -0.377 18792 2344 1 3 . 1 1 160 160 GLY N N 160 108.334 108.334 105.502 2.832 18792 2345 1 3 . 1 1 160 160 GLY C C 160 173.973 173.973 173.752 0.221 18792 2346 1 3 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.459 0.605 18792 2347 1 3 . 1 1 160 160 GLY H H 160 8.020 8.020 7.819 0.201 18792 2348 1 3 . 1 1 161 161 ASN N N 161 118.189 118.189 117.901 0.288 18792 2349 1 3 . 1 1 161 161 ASN C C 161 175.513 175.513 173.374 2.139 18792 2350 1 3 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.815 -1.711 18792 2351 1 3 . 1 1 161 161 ASN CB C 161 38.203 38.203 38.693 -0.490 18792 2352 1 3 . 1 1 161 161 ASN H H 161 8.327 8.327 7.675 0.652 18792 2353 1 3 . 1 1 162 162 ASN N N 162 119.022 119.022 117.980 1.042 18792 2354 1 3 . 1 1 162 162 ASN C C 162 175.690 175.690 173.348 2.342 18792 2355 1 3 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.332 0.092 18792 2356 1 3 . 1 1 162 162 ASN CB C 162 38.203 38.203 40.929 -2.726 18792 2357 1 3 . 1 1 162 162 ASN H H 162 8.363 8.363 8.498 -0.135 18792 2358 1 3 . 1 1 163 163 ALA N N 163 123.275 123.275 124.116 -0.841 18792 2359 1 3 . 1 1 163 163 ALA C C 163 178.598 178.598 177.556 1.042 18792 2360 1 3 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.304 -0.067 18792 2361 1 3 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.862 -2.251 18792 2362 1 3 . 1 1 163 163 ALA H H 163 8.103 8.103 8.517 -0.414 18792 2363 1 3 . 1 1 164 164 ALA N N 164 121.521 121.521 120.648 0.873 18792 2364 1 3 . 1 1 164 164 ALA C C 164 178.642 178.642 179.684 -1.042 18792 2365 1 3 . 1 1 164 164 ALA CA C 164 52.584 52.584 53.386 -0.802 18792 2366 1 3 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.994 -1.175 18792 2367 1 3 . 1 1 164 164 ALA H H 164 8.053 8.053 7.741 0.312 18792 2368 1 3 . 1 1 165 165 ALA N N 165 122.101 122.101 121.767 0.334 18792 2369 1 3 . 1 1 165 165 ALA C C 165 179.124 179.124 178.390 0.734 18792 2370 1 3 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.706 -1.567 18792 2371 1 3 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.668 -0.690 18792 2372 1 3 . 1 1 165 165 ALA H H 165 7.949 7.949 8.131 -0.182 18792 2373 1 3 . 1 1 166 166 GLU N N 166 118.381 118.381 116.963 1.418 18792 2374 1 3 . 1 1 166 166 GLU C C 166 177.664 177.664 176.563 1.101 18792 2375 1 3 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.380 0.708 18792 2376 1 3 . 1 1 166 166 GLU CB C 166 28.354 28.354 28.793 -0.439 18792 2377 1 3 . 1 1 166 166 GLU H H 166 8.202 8.202 8.127 0.075 18792 2378 1 3 . 1 1 167 167 SER N N 167 115.193 115.193 115.953 -0.760 18792 2379 1 3 . 1 1 167 167 SER C C 167 175.312 175.312 174.761 0.551 18792 2380 1 3 . 1 1 167 167 SER CA C 167 58.831 58.831 60.333 -1.502 18792 2381 1 3 . 1 1 167 167 SER CB C 167 62.537 62.537 63.414 -0.878 18792 2382 1 3 . 1 1 167 167 SER H H 167 8.029 8.029 7.472 0.557 18792 2383 1 3 . 1 1 168 168 ARG N N 168 121.696 121.696 119.753 1.943 18792 2384 1 3 . 1 1 168 168 ARG C C 168 176.880 176.880 175.223 1.657 18792 2385 1 3 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.606 -0.443 18792 2386 1 3 . 1 1 168 168 ARG CB C 168 29.209 29.209 28.479 0.730 18792 2387 1 3 . 1 1 168 168 ARG H H 168 7.967 7.967 7.920 0.047 18792 2388 1 3 . 1 1 169 169 LYS N N 169 120.917 120.917 122.100 -1.183 18792 2389 1 3 . 1 1 169 169 LYS C C 169 177.640 177.640 176.544 1.096 18792 2390 1 3 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.152 0.545 18792 2391 1 3 . 1 1 169 169 LYS CB C 169 31.462 31.462 30.307 1.155 18792 2392 1 3 . 1 1 169 169 LYS H H 169 8.011 8.011 8.356 -0.345 18792 2393 1 3 . 1 1 170 170 GLY N N 170 109.155 109.155 110.636 -1.481 18792 2394 1 3 . 1 1 170 170 GLY C C 170 174.479 174.479 172.879 1.600 18792 2395 1 3 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.139 -0.075 18792 2396 1 3 . 1 1 170 170 GLY H H 170 8.329 8.329 7.927 0.402 18792 2397 1 3 . 1 1 171 171 GLN N N 171 119.292 119.292 118.384 0.908 18792 2398 1 3 . 1 1 171 171 GLN C C 171 176.463 176.463 174.595 1.868 18792 2399 1 3 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.150 0.516 18792 2400 1 3 . 1 1 171 171 GLN CB C 171 28.199 28.199 29.938 -1.739 18792 2401 1 3 . 1 1 171 171 GLN H H 171 8.035 8.035 8.170 -0.135 18792 2402 1 3 . 1 1 172 172 GLU N N 172 121.703 121.703 119.316 2.387 18792 2403 1 3 . 1 1 172 172 GLU C C 172 176.414 176.414 174.982 1.432 18792 2404 1 3 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.070 1.271 18792 2405 1 3 . 1 1 172 172 GLU CB C 172 28.821 28.821 32.806 -3.985 18792 2406 1 3 . 1 1 172 172 GLU H H 172 8.405 8.405 8.693 -0.288 18792 2407 1 3 . 1 1 173 173 ARG N N 173 121.852 121.852 119.535 2.317 18792 2408 1 3 . 1 1 173 173 ARG C C 173 176.365 176.365 174.497 1.868 18792 2409 1 3 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.107 1.092 18792 2410 1 3 . 1 1 173 173 ARG CB C 173 29.131 29.131 32.436 -3.305 18792 2411 1 3 . 1 1 173 173 ARG H H 173 8.335 8.335 8.541 -0.206 18792 2412 1 3 . 1 1 174 174 LEU N N 174 122.640 122.640 120.172 2.468 18792 2413 1 3 . 1 1 174 174 LEU C C 174 176.523 176.523 175.686 0.837 18792 2414 1 3 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.555 0.213 18792 2415 1 3 . 1 1 174 174 LEU CB C 174 40.784 40.784 43.962 -3.178 18792 2416 1 3 . 1 1 174 174 LEU H H 174 8.082 8.082 8.205 -0.123 18792 2417 1 3 . 1 1 175 175 GLU N N 175 125.909 125.909 121.008 4.901 18792 2418 1 3 . 1 1 175 175 GLU C C 175 181.029 181.029 174.931 6.098 18792 2419 1 3 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.492 0.906 18792 2420 1 3 . 1 1 175 175 GLU CB C 175 30.050 30.050 30.045 0.005 18792 2421 1 3 . 1 1 175 175 GLU H H 175 7.785 7.785 8.541 -0.756 18792 2422 1 4 . 1 1 4 4 ALA N N 4 124.786 124.786 124.516 0.270 18792 2423 1 4 . 1 1 4 4 ALA C C 4 178.272 178.272 179.448 -1.176 18792 2424 1 4 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.956 -2.390 18792 2425 1 4 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.618 -0.384 18792 2426 1 4 . 1 1 4 4 ALA H H 4 8.414 8.414 8.570 -0.156 18792 2427 1 4 . 1 1 5 5 MET N N 5 119.681 119.681 117.953 1.728 18792 2428 1 4 . 1 1 5 5 MET C C 5 176.929 176.929 177.990 -1.061 18792 2429 1 4 . 1 1 5 5 MET CA C 5 55.594 55.594 57.787 -2.193 18792 2430 1 4 . 1 1 5 5 MET CB C 5 31.540 31.540 32.121 -0.581 18792 2431 1 4 . 1 1 5 5 MET H H 5 8.336 8.336 8.423 -0.087 18792 2432 1 4 . 1 1 6 6 SER N N 6 116.162 116.162 115.778 0.384 18792 2433 1 4 . 1 1 6 6 SER C C 6 175.924 175.924 176.545 -0.621 18792 2434 1 4 . 1 1 6 6 SER CA C 6 59.009 59.009 61.533 -2.524 18792 2435 1 4 . 1 1 6 6 SER CB C 6 62.537 62.537 62.480 0.057 18792 2436 1 4 . 1 1 6 6 SER H H 6 8.272 8.272 8.392 -0.120 18792 2437 1 4 . 1 1 7 7 GLN N N 7 122.263 122.263 121.765 0.498 18792 2438 1 4 . 1 1 7 7 GLN C C 7 177.027 177.027 178.158 -1.131 18792 2439 1 4 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.908 -2.638 18792 2440 1 4 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.371 -0.632 18792 2441 1 4 . 1 1 7 7 GLN H H 7 8.314 8.314 7.865 0.449 18792 2442 1 4 . 1 1 8 8 SER N N 8 116.625 116.625 114.478 2.147 18792 2443 1 4 . 1 1 8 8 SER C C 8 176.457 176.457 176.590 -0.133 18792 2444 1 4 . 1 1 8 8 SER CA C 8 59.650 59.650 61.706 -2.055 18792 2445 1 4 . 1 1 8 8 SER CB C 8 62.226 62.226 63.076 -0.850 18792 2446 1 4 . 1 1 8 8 SER H H 8 8.333 8.333 8.297 0.036 18792 2447 1 4 . 1 1 9 9 ASN N N 9 121.307 121.307 119.824 1.483 18792 2448 1 4 . 1 1 9 9 ASN C C 9 177.419 177.419 177.395 0.024 18792 2449 1 4 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.441 -0.953 18792 2450 1 4 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.801 -1.669 18792 2451 1 4 . 1 1 9 9 ASN H H 9 8.611 8.611 7.916 0.695 18792 2452 1 4 . 1 1 10 10 ARG N N 10 119.830 119.830 121.027 -1.197 18792 2453 1 4 . 1 1 10 10 ARG C C 10 177.615 177.615 178.526 -0.911 18792 2454 1 4 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.543 -0.285 18792 2455 1 4 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.426 -2.227 18792 2456 1 4 . 1 1 10 10 ARG H H 10 7.996 7.996 8.628 -0.632 18792 2457 1 4 . 1 1 11 11 GLU N N 11 117.270 117.270 119.719 -2.449 18792 2458 1 4 . 1 1 11 11 GLU C C 11 179.649 179.649 178.456 1.193 18792 2459 1 4 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.341 -0.332 18792 2460 1 4 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.696 -1.575 18792 2461 1 4 . 1 1 11 11 GLU H H 11 7.885 7.885 8.454 -0.569 18792 2462 1 4 . 1 1 12 12 LEU N N 12 119.900 119.900 121.882 -1.982 18792 2463 1 4 . 1 1 12 12 LEU C C 12 178.473 178.473 178.041 0.432 18792 2464 1 4 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.417 -0.724 18792 2465 1 4 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.734 -1.105 18792 2466 1 4 . 1 1 12 12 LEU H H 12 7.691 7.691 8.068 -0.377 18792 2467 1 4 . 1 1 13 13 VAL N N 13 117.320 117.320 118.177 -0.857 18792 2468 1 4 . 1 1 13 13 VAL C C 13 177.272 177.272 177.567 -0.295 18792 2469 1 4 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.019 1.137 18792 2470 1 4 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.980 -0.751 18792 2471 1 4 . 1 1 13 13 VAL H H 13 7.629 7.629 7.631 -0.002 18792 2472 1 4 . 1 1 14 14 VAL N N 14 116.659 116.659 120.045 -3.386 18792 2473 1 4 . 1 1 14 14 VAL C C 14 178.718 178.718 177.679 1.039 18792 2474 1 4 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.603 -0.087 18792 2475 1 4 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.602 -1.228 18792 2476 1 4 . 1 1 14 14 VAL H H 14 8.210 8.210 7.712 0.498 18792 2477 1 4 . 1 1 15 15 ASP N N 15 120.374 120.374 121.314 -0.940 18792 2478 1 4 . 1 1 15 15 ASP C C 15 177.557 177.557 178.166 -0.609 18792 2479 1 4 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.866 0.610 18792 2480 1 4 . 1 1 15 15 ASP CB C 15 42.553 42.553 41.234 1.319 18792 2481 1 4 . 1 1 15 15 ASP H H 15 7.967 7.967 8.616 -0.649 18792 2482 1 4 . 1 1 16 16 PHE N N 16 119.864 119.864 121.527 -1.663 18792 2483 1 4 . 1 1 16 16 PHE C C 16 178.252 178.252 177.561 0.691 18792 2484 1 4 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.569 2.212 18792 2485 1 4 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.016 0.044 18792 2486 1 4 . 1 1 16 16 PHE H H 16 8.228 8.228 8.030 0.198 18792 2487 1 4 . 1 1 17 17 LEU N N 17 116.312 116.312 118.816 -2.504 18792 2488 1 4 . 1 1 17 17 LEU C C 17 179.649 179.649 178.968 0.681 18792 2489 1 4 . 1 1 17 17 LEU CA C 17 57.764 57.764 57.986 -0.222 18792 2490 1 4 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.603 -1.518 18792 2491 1 4 . 1 1 17 17 LEU H H 17 8.766 8.766 8.108 0.658 18792 2492 1 4 . 1 1 18 18 SER N N 18 113.715 113.715 115.423 -1.708 18792 2493 1 4 . 1 1 18 18 SER C C 18 177.362 177.362 176.766 0.596 18792 2494 1 4 . 1 1 18 18 SER CA C 18 61.948 61.948 61.398 0.551 18792 2495 1 4 . 1 1 18 18 SER CB C 18 63.003 63.003 63.234 -0.231 18792 2496 1 4 . 1 1 18 18 SER H H 18 8.384 8.384 7.936 0.448 18792 2497 1 4 . 1 1 19 19 TYR N N 19 124.570 124.570 123.580 0.990 18792 2498 1 4 . 1 1 19 19 TYR C C 19 178.415 178.415 177.522 0.893 18792 2499 1 4 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.647 -1.883 18792 2500 1 4 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.865 -1.849 18792 2501 1 4 . 1 1 19 19 TYR H H 19 8.155 8.155 8.974 -0.819 18792 2502 1 4 . 1 1 20 20 LYS N N 20 119.739 119.739 120.754 -1.015 18792 2503 1 4 . 1 1 20 20 LYS C C 20 180.456 180.456 178.829 1.627 18792 2504 1 4 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.181 -2.693 18792 2505 1 4 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.444 -4.285 18792 2506 1 4 . 1 1 20 20 LYS H H 20 8.224 8.224 8.012 0.212 18792 2507 1 4 . 1 1 21 21 LEU N N 21 118.092 118.092 120.073 -1.981 18792 2508 1 4 . 1 1 21 21 LEU C C 21 179.989 179.989 178.972 1.017 18792 2509 1 4 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.107 0.019 18792 2510 1 4 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.906 -2.298 18792 2511 1 4 . 1 1 21 21 LEU H H 21 8.586 8.586 7.801 0.785 18792 2512 1 4 . 1 1 22 22 SER N N 22 117.304 117.304 113.205 4.099 18792 2513 1 4 . 1 1 22 22 SER C C 22 180.152 180.152 176.755 3.397 18792 2514 1 4 . 1 1 22 22 SER CA C 22 61.287 61.287 60.262 1.025 18792 2515 1 4 . 1 1 22 22 SER H H 22 8.266 8.266 7.804 0.462 18792 2516 1 4 . 1 1 23 23 GLN N N 23 122.497 122.497 122.188 0.309 18792 2517 1 4 . 1 1 23 23 GLN C C 23 177.297 177.297 177.832 -0.535 18792 2518 1 4 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.384 -0.442 18792 2519 1 4 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.556 -0.745 18792 2520 1 4 . 1 1 23 23 GLN H H 23 7.571 7.571 8.251 -0.680 18792 2521 1 4 . 1 1 24 24 LYS N N 24 116.038 116.038 116.750 -0.712 18792 2522 1 4 . 1 1 24 24 LYS C C 24 175.704 175.704 176.882 -1.178 18792 2523 1 4 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.730 -3.235 18792 2524 1 4 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.590 -2.361 18792 2525 1 4 . 1 1 24 24 LYS H H 24 7.134 7.134 7.797 -0.663 18792 2526 1 4 . 1 1 25 25 GLY N N 25 105.283 105.283 106.156 -0.873 18792 2527 1 4 . 1 1 25 25 GLY C C 25 174.013 174.013 173.750 0.263 18792 2528 1 4 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.633 0.146 18792 2529 1 4 . 1 1 25 25 GLY H H 25 7.483 7.483 7.839 -0.356 18792 2530 1 4 . 1 1 26 26 TYR N N 26 119.547 119.547 120.432 -0.885 18792 2531 1 4 . 1 1 26 26 TYR C C 26 175.122 175.122 174.646 0.476 18792 2532 1 4 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.292 -1.160 18792 2533 1 4 . 1 1 26 26 TYR CB C 26 40.080 40.080 38.458 1.622 18792 2534 1 4 . 1 1 26 26 TYR H H 26 7.788 7.788 7.742 0.046 18792 2535 1 4 . 1 1 27 27 SER N N 27 115.088 115.088 117.677 -2.589 18792 2536 1 4 . 1 1 27 27 SER C C 27 174.452 174.452 175.051 -0.599 18792 2537 1 4 . 1 1 27 27 SER CA C 27 56.306 56.306 54.892 1.415 18792 2538 1 4 . 1 1 27 27 SER CB C 27 63.921 63.921 65.294 -1.373 18792 2539 1 4 . 1 1 27 27 SER H H 27 8.473 8.473 8.486 -0.013 18792 2540 1 4 . 1 1 28 28 TRP N N 28 127.014 127.014 124.204 2.810 18792 2541 1 4 . 1 1 28 28 TRP C C 28 177.002 177.002 177.314 -0.312 18792 2542 1 4 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.961 -0.489 18792 2543 1 4 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.388 0.442 18792 2544 1 4 . 1 1 28 28 TRP H H 28 8.897 8.897 8.887 0.010 18792 2545 1 4 . 1 1 29 29 SER N N 29 112.044 112.044 111.773 0.271 18792 2546 1 4 . 1 1 29 29 SER C C 29 175.106 175.106 174.172 0.934 18792 2547 1 4 . 1 1 29 29 SER CA C 29 59.472 59.472 58.676 0.796 18792 2548 1 4 . 1 1 29 29 SER CB C 29 62.226 62.226 63.071 -0.845 18792 2549 1 4 . 1 1 29 29 SER H H 29 8.129 8.129 8.399 -0.270 18792 2550 1 4 . 1 1 30 30 GLN N N 30 119.160 119.160 119.399 -0.239 18792 2551 1 4 . 1 1 30 30 GLN C C 30 176.218 176.218 177.520 -1.302 18792 2552 1 4 . 1 1 30 30 GLN CA C 30 56.412 56.412 55.992 0.420 18792 2553 1 4 . 1 1 30 30 GLN CB C 30 27.578 27.578 30.688 -3.110 18792 2554 1 4 . 1 1 30 30 GLN H H 30 7.370 7.370 7.811 -0.441 18792 2555 1 4 . 1 1 31 31 PHE N N 31 116.277 116.277 119.256 -2.979 18792 2556 1 4 . 1 1 31 31 PHE C C 31 175.217 175.217 175.408 -0.191 18792 2557 1 4 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.749 -2.515 18792 2558 1 4 . 1 1 31 31 PHE CB C 31 39.066 39.066 38.398 0.669 18792 2559 1 4 . 1 1 31 31 PHE H H 31 7.248 7.248 8.288 -1.040 18792 2560 1 4 . 1 1 32 32 SER N N 32 113.683 113.683 114.334 -0.651 18792 2561 1 4 . 1 1 32 32 SER C C 32 173.793 173.793 173.563 0.230 18792 2562 1 4 . 1 1 32 32 SER CA C 32 57.124 57.124 56.900 0.224 18792 2563 1 4 . 1 1 32 32 SER CB C 32 63.081 63.081 64.756 -1.675 18792 2564 1 4 . 1 1 32 32 SER H H 32 7.242 7.242 7.390 -0.148 18792 2565 1 4 . 1 1 33 33 ASP N N 33 122.195 122.195 119.590 2.605 18792 2566 1 4 . 1 1 33 33 ASP C C 33 176.394 176.394 175.420 0.974 18792 2567 1 4 . 1 1 33 33 ASP CA C 33 53.748 53.748 54.283 -0.535 18792 2568 1 4 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.735 -0.337 18792 2569 1 4 . 1 1 33 33 ASP H H 33 8.257 8.257 8.436 -0.179 18792 2570 1 4 . 1 1 34 34 VAL N N 34 118.913 118.913 118.143 0.770 18792 2571 1 4 . 1 1 34 34 VAL C C 34 176.328 176.328 175.835 0.493 18792 2572 1 4 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.992 -1.101 18792 2573 1 4 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.652 -0.637 18792 2574 1 4 . 1 1 34 34 VAL H H 34 7.852 7.852 7.765 0.087 18792 2575 1 4 . 1 1 35 35 GLU N N 35 124.205 124.205 119.016 5.189 18792 2576 1 4 . 1 1 35 35 GLU C C 35 176.586 176.586 175.298 1.288 18792 2577 1 4 . 1 1 35 35 GLU CA C 35 56.057 56.057 55.877 0.180 18792 2578 1 4 . 1 1 35 35 GLU CB C 35 28.898 28.898 33.071 -4.173 18792 2579 1 4 . 1 1 35 35 GLU H H 35 8.401 8.401 7.598 0.803 18792 2580 1 4 . 1 1 36 36 GLU N N 36 121.670 121.670 118.558 3.112 18792 2581 1 4 . 1 1 36 36 GLU C C 36 176.218 176.218 175.365 0.853 18792 2582 1 4 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.459 -0.471 18792 2583 1 4 . 1 1 36 36 GLU CB C 36 29.442 29.442 31.477 -2.035 18792 2584 1 4 . 1 1 36 36 GLU H H 36 8.239 8.239 8.655 -0.416 18792 2585 1 4 . 1 1 37 37 ASN N N 37 119.252 119.252 116.685 2.567 18792 2586 1 4 . 1 1 37 37 ASN C C 37 175.003 175.003 173.661 1.342 18792 2587 1 4 . 1 1 37 37 ASN CA C 37 52.655 52.655 54.207 -1.552 18792 2588 1 4 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.209 -0.997 18792 2589 1 4 . 1 1 37 37 ASN H H 37 8.412 8.412 8.312 0.100 18792 2590 1 4 . 1 1 38 38 ARG N N 38 121.622 121.622 119.317 2.305 18792 2591 1 4 . 1 1 38 38 ARG C C 38 176.610 176.610 175.225 1.385 18792 2592 1 4 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.274 -0.910 18792 2593 1 4 . 1 1 38 38 ARG CB C 38 29.419 29.419 32.669 -3.249 18792 2594 1 4 . 1 1 38 38 ARG H H 38 8.227 8.227 8.563 -0.336 18792 2595 1 4 . 1 1 39 39 THR N N 39 115.681 115.681 114.346 1.335 18792 2596 1 4 . 1 1 39 39 THR C C 39 174.500 174.500 174.774 -0.274 18792 2597 1 4 . 1 1 39 39 THR CA C 39 61.606 61.606 62.024 -0.418 18792 2598 1 4 . 1 1 39 39 THR CB C 39 69.163 69.163 69.654 -0.492 18792 2599 1 4 . 1 1 39 39 THR H H 39 8.173 8.173 8.386 -0.213 18792 2600 1 4 . 1 1 40 40 GLU N N 40 122.708 122.708 119.751 2.957 18792 2601 1 4 . 1 1 40 40 GLU C C 40 175.728 175.728 175.077 0.651 18792 2602 1 4 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.627 -0.855 18792 2603 1 4 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.440 -0.386 18792 2604 1 4 . 1 1 40 40 GLU H H 40 8.298 8.298 7.863 0.435 18792 2605 1 4 . 1 1 41 41 ALA N N 41 125.922 125.922 123.900 2.022 18792 2606 1 4 . 1 1 41 41 ALA C C 41 175.557 175.557 175.104 0.453 18792 2607 1 4 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.935 -1.962 18792 2608 1 4 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.872 -0.627 18792 2609 1 4 . 1 1 41 41 ALA H H 41 8.212 8.212 8.273 -0.061 18792 2610 1 4 . 1 1 43 43 GLU N N 43 120.783 120.783 124.619 -3.836 18792 2611 1 4 . 1 1 43 43 GLU C C 43 177.174 177.174 174.841 2.333 18792 2612 1 4 . 1 1 43 43 GLU CA C 43 56.341 56.341 57.242 -0.902 18792 2613 1 4 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.618 -1.331 18792 2614 1 4 . 1 1 43 43 GLU H H 43 8.519 8.519 8.756 -0.237 18792 2615 1 4 . 1 1 44 44 GLY N N 44 110.022 110.022 109.307 0.715 18792 2616 1 4 . 1 1 44 44 GLY C C 44 174.773 174.773 173.962 0.811 18792 2617 1 4 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.697 -0.669 18792 2618 1 4 . 1 1 44 44 GLY H H 44 8.429 8.429 8.267 0.162 18792 2619 1 4 . 1 1 45 45 THR N N 45 112.790 112.790 113.775 -0.985 18792 2620 1 4 . 1 1 45 45 THR C C 45 175.726 175.726 175.543 0.183 18792 2621 1 4 . 1 1 45 45 THR CA C 45 61.987 61.987 61.989 -0.002 18792 2622 1 4 . 1 1 45 45 THR CB C 45 69.304 69.304 69.410 -0.106 18792 2623 1 4 . 1 1 45 45 THR H H 45 8.125 8.125 7.987 0.138 18792 2624 1 4 . 1 1 46 46 GLU N N 46 122.752 122.752 120.719 2.033 18792 2625 1 4 . 1 1 46 46 GLU C C 46 177.419 177.419 175.819 1.600 18792 2626 1 4 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.487 0.744 18792 2627 1 4 . 1 1 46 46 GLU CB C 46 28.199 28.199 30.226 -2.027 18792 2628 1 4 . 1 1 46 46 GLU H H 46 8.765 8.765 8.362 0.403 18792 2629 1 4 . 1 1 47 47 SER N N 47 114.895 114.895 113.832 1.063 18792 2630 1 4 . 1 1 47 47 SER C C 47 175.826 175.826 174.502 1.324 18792 2631 1 4 . 1 1 47 47 SER CA C 47 58.582 58.582 58.164 0.418 18792 2632 1 4 . 1 1 47 47 SER CB C 47 62.537 62.537 63.688 -1.151 18792 2633 1 4 . 1 1 47 47 SER H H 47 8.355 8.355 7.971 0.384 18792 2634 1 4 . 1 1 48 48 GLU N N 48 122.429 122.429 123.503 -1.074 18792 2635 1 4 . 1 1 48 48 GLU C C 48 178.099 178.099 177.482 0.617 18792 2636 1 4 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.182 -0.564 18792 2637 1 4 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.676 -1.201 18792 2638 1 4 . 1 1 48 48 GLU H H 48 8.139 8.139 8.888 -0.749 18792 2639 1 4 . 1 1 49 49 ALA N N 49 120.374 120.374 121.581 -1.207 18792 2640 1 4 . 1 1 49 49 ALA C C 49 180.843 180.843 179.199 1.644 18792 2641 1 4 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.191 -0.708 18792 2642 1 4 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.161 -0.726 18792 2643 1 4 . 1 1 49 49 ALA H H 49 8.079 8.079 7.954 0.125 18792 2644 1 4 . 1 1 50 50 VAL N N 50 118.599 118.599 117.405 1.194 18792 2645 1 4 . 1 1 50 50 VAL C C 50 176.921 176.921 177.233 -0.312 18792 2646 1 4 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.479 0.081 18792 2647 1 4 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.883 -0.585 18792 2648 1 4 . 1 1 50 50 VAL H H 50 7.419 7.419 7.511 -0.092 18792 2649 1 4 . 1 1 51 51 LYS N N 51 117.469 117.469 120.270 -2.801 18792 2650 1 4 . 1 1 51 51 LYS C C 51 179.061 179.061 178.603 0.458 18792 2651 1 4 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.836 -0.613 18792 2652 1 4 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.026 -1.030 18792 2653 1 4 . 1 1 51 51 LYS H H 51 7.359 7.359 7.537 -0.178 18792 2654 1 4 . 1 1 52 52 GLN N N 52 115.930 115.930 117.710 -1.780 18792 2655 1 4 . 1 1 52 52 GLN C C 52 177.713 177.713 178.035 -0.322 18792 2656 1 4 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.951 -0.475 18792 2657 1 4 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.608 -2.040 18792 2658 1 4 . 1 1 52 52 GLN H H 52 8.025 8.025 7.981 0.044 18792 2659 1 4 . 1 1 53 53 ALA N N 53 119.782 119.782 122.182 -2.400 18792 2660 1 4 . 1 1 53 53 ALA C C 53 180.008 180.008 179.412 0.596 18792 2661 1 4 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.485 -0.100 18792 2662 1 4 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.178 -0.663 18792 2663 1 4 . 1 1 53 53 ALA H H 53 7.655 7.655 7.645 0.010 18792 2664 1 4 . 1 1 54 54 LEU N N 54 120.443 120.443 118.829 1.614 18792 2665 1 4 . 1 1 54 54 LEU C C 54 179.330 179.330 177.914 1.416 18792 2666 1 4 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.285 1.728 18792 2667 1 4 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.532 -0.670 18792 2668 1 4 . 1 1 54 54 LEU H H 54 8.419 8.419 7.731 0.688 18792 2669 1 4 . 1 1 55 55 ARG N N 55 118.423 118.423 119.908 -1.485 18792 2670 1 4 . 1 1 55 55 ARG C C 55 178.767 178.767 178.132 0.635 18792 2671 1 4 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.472 0.924 18792 2672 1 4 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.161 -1.418 18792 2673 1 4 . 1 1 55 55 ARG H H 55 8.062 8.062 7.798 0.264 18792 2674 1 4 . 1 1 56 56 GLU N N 56 115.988 115.988 117.693 -1.705 18792 2675 1 4 . 1 1 56 56 GLU C C 56 180.090 180.090 178.592 1.498 18792 2676 1 4 . 1 1 56 56 GLU CA C 56 58.760 58.760 58.620 0.140 18792 2677 1 4 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.161 -0.807 18792 2678 1 4 . 1 1 56 56 GLU H H 56 7.772 7.772 8.231 -0.459 18792 2679 1 4 . 1 1 57 57 ALA N N 57 122.837 122.837 122.139 0.698 18792 2680 1 4 . 1 1 57 57 ALA C C 57 181.861 181.861 179.752 2.109 18792 2681 1 4 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.830 -0.196 18792 2682 1 4 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.775 -0.302 18792 2683 1 4 . 1 1 57 57 ALA H H 57 8.774 8.774 7.484 1.290 18792 2684 1 4 . 1 1 58 58 GLY N N 58 108.409 108.409 106.436 1.973 18792 2685 1 4 . 1 1 58 58 GLY C C 58 175.331 175.331 176.039 -0.708 18792 2686 1 4 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.874 -0.206 18792 2687 1 4 . 1 1 58 58 GLY H H 58 9.073 9.073 8.258 0.815 18792 2688 1 4 . 1 1 59 59 ASP N N 59 122.074 122.074 121.981 0.093 18792 2689 1 4 . 1 1 59 59 ASP C C 59 179.023 179.023 178.262 0.761 18792 2690 1 4 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.343 -0.041 18792 2691 1 4 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.444 -1.603 18792 2692 1 4 . 1 1 59 59 ASP H H 59 8.049 8.049 8.387 -0.338 18792 2693 1 4 . 1 1 60 60 GLU N N 60 120.131 120.131 120.710 -0.579 18792 2694 1 4 . 1 1 60 60 GLU C C 60 178.522 178.522 178.790 -0.268 18792 2695 1 4 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.213 -0.204 18792 2696 1 4 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.686 -1.487 18792 2697 1 4 . 1 1 60 60 GLU H H 60 8.136 8.136 7.774 0.362 18792 2698 1 4 . 1 1 61 61 PHE N N 61 121.309 121.309 119.766 1.543 18792 2699 1 4 . 1 1 61 61 PHE C C 61 176.904 176.904 178.466 -1.562 18792 2700 1 4 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.660 -0.338 18792 2701 1 4 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.135 -0.526 18792 2702 1 4 . 1 1 61 61 PHE H H 61 8.523 8.523 8.189 0.334 18792 2703 1 4 . 1 1 62 62 GLU N N 62 115.971 115.971 119.611 -3.640 18792 2704 1 4 . 1 1 62 62 GLU C C 62 177.713 177.713 178.400 -0.687 18792 2705 1 4 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.365 -1.174 18792 2706 1 4 . 1 1 62 62 GLU CB C 62 28.277 28.277 30.264 -1.987 18792 2707 1 4 . 1 1 62 62 GLU H H 62 7.969 7.969 8.464 -0.495 18792 2708 1 4 . 1 1 63 63 LEU N N 63 116.703 116.703 119.789 -3.086 18792 2709 1 4 . 1 1 63 63 LEU C C 63 178.963 178.963 179.762 -0.799 18792 2710 1 4 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.852 -1.440 18792 2711 1 4 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.253 -0.847 18792 2712 1 4 . 1 1 63 63 LEU H H 63 7.347 7.347 7.945 -0.598 18792 2713 1 4 . 1 1 64 64 ARG N N 64 117.453 117.453 118.828 -1.375 18792 2714 1 4 . 1 1 64 64 ARG C C 64 177.297 177.297 177.564 -0.267 18792 2715 1 4 . 1 1 64 64 ARG CA C 64 57.337 57.337 58.424 -1.087 18792 2716 1 4 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.930 -1.333 18792 2717 1 4 . 1 1 64 64 ARG H H 64 7.995 7.995 8.038 -0.043 18792 2718 1 4 . 1 1 65 65 TYR N N 65 118.956 118.956 119.201 -0.245 18792 2719 1 4 . 1 1 65 65 TYR C C 65 175.278 175.278 174.805 0.473 18792 2720 1 4 . 1 1 65 65 TYR CA C 65 55.701 55.701 55.977 -0.276 18792 2721 1 4 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.229 -3.243 18792 2722 1 4 . 1 1 65 65 TYR H H 65 7.909 7.909 7.934 -0.025 18792 2723 1 4 . 1 1 66 66 ARG N N 66 119.438 119.438 121.713 -2.275 18792 2724 1 4 . 1 1 66 66 ARG C C 66 178.424 178.424 177.826 0.598 18792 2725 1 4 . 1 1 66 66 ARG CA C 66 58.476 58.476 59.677 -1.201 18792 2726 1 4 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.315 -1.494 18792 2727 1 4 . 1 1 66 66 ARG H H 66 7.244 7.244 7.816 -0.572 18792 2728 1 4 . 1 1 67 67 ARG N N 67 118.936 118.936 118.299 0.637 18792 2729 1 4 . 1 1 67 67 ARG C C 67 177.542 177.542 177.783 -0.241 18792 2730 1 4 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.429 -1.985 18792 2731 1 4 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.659 -1.538 18792 2732 1 4 . 1 1 67 67 ARG H H 67 8.417 8.417 8.513 -0.096 18792 2733 1 4 . 1 1 68 68 ALA N N 68 121.797 121.797 121.410 0.387 18792 2734 1 4 . 1 1 68 68 ALA C C 68 180.337 180.337 179.083 1.254 18792 2735 1 4 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.275 -0.139 18792 2736 1 4 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.988 -0.520 18792 2737 1 4 . 1 1 68 68 ALA H H 68 7.827 7.827 7.318 0.509 18792 2738 1 4 . 1 1 69 69 PHE N N 69 115.986 115.986 120.178 -4.192 18792 2739 1 4 . 1 1 69 69 PHE C C 69 177.468 177.468 177.211 0.257 18792 2740 1 4 . 1 1 69 69 PHE CA C 69 58.049 58.049 61.723 -3.674 18792 2741 1 4 . 1 1 69 69 PHE CB C 69 37.599 37.599 39.044 -1.445 18792 2742 1 4 . 1 1 69 69 PHE H H 69 8.517 8.517 7.696 0.821 18792 2743 1 4 . 1 1 70 70 SER N N 70 116.526 116.526 115.291 1.235 18792 2744 1 4 . 1 1 70 70 SER C C 70 177.640 177.640 176.389 1.251 18792 2745 1 4 . 1 1 70 70 SER CA C 70 61.073 61.073 61.593 -0.520 18792 2746 1 4 . 1 1 70 70 SER CB C 70 61.993 61.993 63.423 -1.430 18792 2747 1 4 . 1 1 70 70 SER H H 70 8.152 8.152 7.790 0.362 18792 2748 1 4 . 1 1 71 71 ASP N N 71 121.181 121.181 122.499 -1.318 18792 2749 1 4 . 1 1 71 71 ASP C C 71 178.546 178.546 178.503 0.043 18792 2750 1 4 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.028 -0.580 18792 2751 1 4 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.330 -1.099 18792 2752 1 4 . 1 1 71 71 ASP H H 71 8.356 8.356 7.949 0.407 18792 2753 1 4 . 1 1 72 72 LEU N N 72 120.747 120.747 120.448 0.299 18792 2754 1 4 . 1 1 72 72 LEU C C 72 178.963 178.963 178.438 0.525 18792 2755 1 4 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.303 -0.859 18792 2756 1 4 . 1 1 72 72 LEU CB C 72 41.017 41.017 41.266 -0.249 18792 2757 1 4 . 1 1 72 72 LEU H H 72 7.738 7.738 8.475 -0.737 18792 2758 1 4 . 1 1 73 73 THR N N 73 109.432 109.432 114.023 -4.591 18792 2759 1 4 . 1 1 73 73 THR C C 73 177.481 177.481 176.835 0.646 18792 2760 1 4 . 1 1 73 73 THR CA C 73 65.128 65.128 66.451 -1.323 18792 2761 1 4 . 1 1 73 73 THR CB C 73 67.720 67.720 68.497 -0.777 18792 2762 1 4 . 1 1 73 73 THR H H 73 8.296 8.296 7.621 0.675 18792 2763 1 4 . 1 1 74 74 SER N N 74 115.862 115.862 116.574 -0.712 18792 2764 1 4 . 1 1 74 74 SER C C 74 175.361 175.361 175.670 -0.309 18792 2765 1 4 . 1 1 74 74 SER CA C 74 60.112 60.112 61.365 -1.253 18792 2766 1 4 . 1 1 74 74 SER CB C 74 62.537 62.537 62.905 -0.368 18792 2767 1 4 . 1 1 74 74 SER H H 74 7.629 7.629 8.470 -0.841 18792 2768 1 4 . 1 1 75 75 GLN N N 75 118.551 118.551 119.501 -0.950 18792 2769 1 4 . 1 1 75 75 GLN C C 75 176.316 176.316 177.444 -1.128 18792 2770 1 4 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.797 -0.993 18792 2771 1 4 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.546 -1.269 18792 2772 1 4 . 1 1 75 75 GLN H H 75 7.640 7.640 7.605 0.035 18792 2773 1 4 . 1 1 76 76 LEU N N 76 118.313 118.313 119.538 -1.225 18792 2774 1 4 . 1 1 76 76 LEU C C 76 174.160 174.160 177.677 -3.517 18792 2775 1 4 . 1 1 76 76 LEU CA C 76 54.740 54.740 56.584 -1.843 18792 2776 1 4 . 1 1 76 76 LEU CB C 76 42.727 42.727 42.375 0.352 18792 2777 1 4 . 1 1 76 76 LEU H H 76 7.411 7.411 7.964 -0.553 18792 2778 1 4 . 1 1 77 77 HIS N N 77 120.104 120.104 115.217 4.887 18792 2779 1 4 . 1 1 77 77 HIS C C 77 174.528 174.528 174.028 0.500 18792 2780 1 4 . 1 1 77 77 HIS CA C 77 54.207 54.207 56.525 -2.318 18792 2781 1 4 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.280 -0.314 18792 2782 1 4 . 1 1 77 77 HIS H H 77 8.117 8.117 7.795 0.322 18792 2783 1 4 . 1 1 78 78 ILE N N 78 122.298 122.298 125.768 -3.470 18792 2784 1 4 . 1 1 78 78 ILE C C 78 174.240 174.240 175.121 -0.881 18792 2785 1 4 . 1 1 78 78 ILE CA C 78 61.402 61.402 62.814 -1.412 18792 2786 1 4 . 1 1 78 78 ILE CB C 78 37.591 37.591 38.019 -0.428 18792 2787 1 4 . 1 1 78 78 ILE H H 78 8.655 8.655 8.311 0.344 18792 2788 1 4 . 1 1 79 79 THR N N 79 116.442 116.442 122.787 -6.345 18792 2789 1 4 . 1 1 79 79 THR C C 79 174.291 174.291 172.269 2.022 18792 2790 1 4 . 1 1 79 79 THR CA C 79 61.632 61.632 62.307 -0.675 18792 2791 1 4 . 1 1 79 79 THR CB C 79 68.704 68.704 68.813 -0.109 18792 2792 1 4 . 1 1 79 79 THR H H 79 8.245 8.245 8.565 -0.320 18792 2793 1 4 . 1 1 84 84 TYR N N 84 120.888 120.888 118.724 2.164 18792 2794 1 4 . 1 1 84 84 TYR C C 84 176.708 176.708 177.502 -0.794 18792 2795 1 4 . 1 1 84 84 TYR CA C 84 60.432 60.432 60.976 -0.544 18792 2796 1 4 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.152 -0.407 18792 2797 1 4 . 1 1 84 84 TYR H H 84 8.733 8.733 8.480 0.253 18792 2798 1 4 . 1 1 85 85 GLN N N 85 114.530 114.530 118.870 -4.340 18792 2799 1 4 . 1 1 85 85 GLN C C 85 178.473 178.473 178.549 -0.076 18792 2800 1 4 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.715 -0.421 18792 2801 1 4 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.992 -1.191 18792 2802 1 4 . 1 1 85 85 GLN H H 85 8.413 8.413 7.421 0.992 18792 2803 1 4 . 1 1 86 86 SER N N 86 114.032 114.032 116.178 -2.146 18792 2804 1 4 . 1 1 86 86 SER C C 86 178.473 178.473 176.972 1.501 18792 2805 1 4 . 1 1 86 86 SER CA C 86 62.175 62.175 61.262 0.913 18792 2806 1 4 . 1 1 86 86 SER CB C 86 63.252 63.252 62.964 0.288 18792 2807 1 4 . 1 1 86 86 SER H H 86 7.258 7.258 8.237 -0.979 18792 2808 1 4 . 1 1 88 88 GLU N N 88 119.386 119.386 119.731 -0.345 18792 2809 1 4 . 1 1 88 88 GLU C C 88 177.199 177.199 179.010 -1.811 18792 2810 1 4 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.903 -1.321 18792 2811 1 4 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.505 -0.529 18792 2812 1 4 . 1 1 88 88 GLU H H 88 8.534 8.534 8.059 0.475 18792 2813 1 4 . 1 1 89 89 GLN N N 89 114.678 114.678 119.234 -4.556 18792 2814 1 4 . 1 1 89 89 GLN C C 89 178.669 178.669 178.456 0.213 18792 2815 1 4 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.243 -0.661 18792 2816 1 4 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.887 -1.465 18792 2817 1 4 . 1 1 89 89 GLN H H 89 7.500 7.500 7.819 -0.319 18792 2818 1 4 . 1 1 90 90 VAL N N 90 118.174 118.174 119.995 -1.821 18792 2819 1 4 . 1 1 90 90 VAL C C 90 178.081 178.081 177.618 0.463 18792 2820 1 4 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.531 0.024 18792 2821 1 4 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.159 -0.552 18792 2822 1 4 . 1 1 90 90 VAL H H 90 7.017 7.017 7.552 -0.535 18792 2823 1 4 . 1 1 91 91 VAL N N 91 119.489 119.489 120.171 -0.682 18792 2824 1 4 . 1 1 91 91 VAL C C 91 177.914 177.914 178.147 -0.233 18792 2825 1 4 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.585 -0.816 18792 2826 1 4 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.106 -0.815 18792 2827 1 4 . 1 1 91 91 VAL H H 91 7.833 7.833 8.160 -0.327 18792 2828 1 4 . 1 1 92 92 ASN N N 92 117.180 117.180 117.670 -0.490 18792 2829 1 4 . 1 1 92 92 ASN C C 92 179.110 179.110 176.888 2.222 18792 2830 1 4 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.237 -1.319 18792 2831 1 4 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.807 -2.839 18792 2832 1 4 . 1 1 92 92 ASN H H 92 8.368 8.368 8.396 -0.028 18792 2833 1 4 . 1 1 93 93 GLU N N 93 118.476 118.476 117.739 0.737 18792 2834 1 4 . 1 1 93 93 GLU C C 93 179.355 179.355 179.081 0.274 18792 2835 1 4 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.736 -0.331 18792 2836 1 4 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.134 -2.401 18792 2837 1 4 . 1 1 93 93 GLU H H 93 7.213 7.213 7.869 -0.656 18792 2838 1 4 . 1 1 94 94 LEU N N 94 120.889 120.889 120.773 0.116 18792 2839 1 4 . 1 1 94 94 LEU C C 94 178.473 178.473 178.615 -0.142 18792 2840 1 4 . 1 1 94 94 LEU CA C 94 57.017 57.017 56.477 0.540 18792 2841 1 4 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.104 -1.174 18792 2842 1 4 . 1 1 94 94 LEU H H 94 7.446 7.446 8.489 -1.043 18792 2843 1 4 . 1 1 95 95 PHE N N 95 112.902 112.902 119.008 -6.106 18792 2844 1 4 . 1 1 95 95 PHE C C 95 176.586 176.586 177.620 -1.034 18792 2845 1 4 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.510 -2.351 18792 2846 1 4 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.745 -0.524 18792 2847 1 4 . 1 1 95 95 PHE H H 95 6.916 6.916 7.731 -0.815 18792 2848 1 4 . 1 1 96 96 ARG N N 96 123.729 123.729 118.501 5.228 18792 2849 1 4 . 1 1 96 96 ARG C C 96 177.272 177.272 177.394 -0.122 18792 2850 1 4 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.361 0.862 18792 2851 1 4 . 1 1 96 96 ARG CB C 96 28.432 28.432 29.838 -1.406 18792 2852 1 4 . 1 1 96 96 ARG H H 96 7.126 7.126 7.945 -0.819 18792 2853 1 4 . 1 1 97 97 ASP N N 97 116.576 116.576 116.257 0.319 18792 2854 1 4 . 1 1 97 97 ASP C C 97 175.687 175.687 176.205 -0.518 18792 2855 1 4 . 1 1 97 97 ASP CA C 97 53.673 53.673 55.006 -1.333 18792 2856 1 4 . 1 1 97 97 ASP CB C 97 40.045 40.045 41.860 -1.815 18792 2857 1 4 . 1 1 97 97 ASP H H 97 8.644 8.644 7.928 0.716 18792 2858 1 4 . 1 1 98 98 GLY N N 98 108.551 108.551 104.970 3.581 18792 2859 1 4 . 1 1 98 98 GLY C C 98 172.690 172.690 171.434 1.256 18792 2860 1 4 . 1 1 98 98 GLY CA C 98 43.250 43.250 44.748 -1.498 18792 2861 1 4 . 1 1 98 98 GLY H H 98 7.463 7.463 7.609 -0.146 18792 2862 1 4 . 1 1 99 99 VAL N N 99 120.630 120.630 120.182 0.448 18792 2863 1 4 . 1 1 99 99 VAL C C 99 174.503 174.503 174.224 0.279 18792 2864 1 4 . 1 1 99 99 VAL CA C 99 62.318 62.318 60.273 2.045 18792 2865 1 4 . 1 1 99 99 VAL CB C 99 30.763 30.763 33.537 -2.774 18792 2866 1 4 . 1 1 99 99 VAL H H 99 8.184 8.184 7.882 0.302 18792 2867 1 4 . 1 1 100 100 ASN N N 100 115.485 115.485 120.081 -4.596 18792 2868 1 4 . 1 1 100 100 ASN C C 100 175.239 175.239 176.108 -0.869 18792 2869 1 4 . 1 1 100 100 ASN CA C 100 51.361 51.361 56.145 -4.784 18792 2870 1 4 . 1 1 100 100 ASN CB C 100 38.920 38.920 37.373 1.547 18792 2871 1 4 . 1 1 100 100 ASN H H 100 6.241 6.241 8.469 -2.228 18792 2872 1 4 . 1 1 101 101 TRP N N 101 118.266 118.266 120.665 -2.399 18792 2873 1 4 . 1 1 101 101 TRP C C 101 178.301 178.301 176.395 1.906 18792 2874 1 4 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.184 1.355 18792 2875 1 4 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.835 0.995 18792 2876 1 4 . 1 1 101 101 TRP H H 101 8.409 8.409 8.215 0.194 18792 2877 1 4 . 1 1 102 102 GLY N N 102 106.147 106.147 106.816 -0.669 18792 2878 1 4 . 1 1 102 102 GLY C C 102 177.640 177.640 174.610 3.030 18792 2879 1 4 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.268 2.646 18792 2880 1 4 . 1 1 102 102 GLY H H 102 8.504 8.504 6.601 1.903 18792 2881 1 4 . 1 1 103 103 ARG N N 103 121.347 121.347 121.334 0.013 18792 2882 1 4 . 1 1 103 103 ARG C C 103 177.738 177.738 177.941 -0.203 18792 2883 1 4 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.233 -0.291 18792 2884 1 4 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.741 0.478 18792 2885 1 4 . 1 1 103 103 ARG H H 103 8.099 8.099 7.865 0.234 18792 2886 1 4 . 1 1 104 104 ILE N N 104 120.930 120.930 119.531 1.399 18792 2887 1 4 . 1 1 104 104 ILE C C 104 178.197 178.197 177.555 0.642 18792 2888 1 4 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.677 1.858 18792 2889 1 4 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.831 -1.786 18792 2890 1 4 . 1 1 104 104 ILE H H 104 7.690 7.690 7.971 -0.281 18792 2891 1 4 . 1 1 105 105 VAL N N 105 120.938 120.938 117.646 3.292 18792 2892 1 4 . 1 1 105 105 VAL C C 105 177.854 177.854 177.607 0.247 18792 2893 1 4 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.120 1.339 18792 2894 1 4 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.465 -0.091 18792 2895 1 4 . 1 1 105 105 VAL H H 105 8.245 8.245 7.644 0.601 18792 2896 1 4 . 1 1 106 106 ALA N N 106 121.165 121.165 121.684 -0.519 18792 2897 1 4 . 1 1 106 106 ALA C C 106 178.284 178.284 179.510 -1.226 18792 2898 1 4 . 1 1 106 106 ALA CA C 106 54.598 54.598 53.941 0.657 18792 2899 1 4 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.531 -1.016 18792 2900 1 4 . 1 1 106 106 ALA H H 106 7.529 7.529 7.621 -0.092 18792 2901 1 4 . 1 1 107 107 PHE N N 107 119.242 119.242 120.211 -0.969 18792 2902 1 4 . 1 1 107 107 PHE C C 107 176.390 176.390 177.206 -0.816 18792 2903 1 4 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.064 0.109 18792 2904 1 4 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.944 -1.857 18792 2905 1 4 . 1 1 107 107 PHE H H 107 7.974 7.974 7.697 0.277 18792 2906 1 4 . 1 1 108 108 PHE N N 108 120.009 120.009 120.190 -0.181 18792 2907 1 4 . 1 1 108 108 PHE C C 108 177.640 177.640 176.919 0.721 18792 2908 1 4 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.358 1.066 18792 2909 1 4 . 1 1 108 108 PHE CB C 108 35.346 35.346 39.284 -3.938 18792 2910 1 4 . 1 1 108 108 PHE H H 108 7.946 7.946 8.534 -0.588 18792 2911 1 4 . 1 1 109 109 SER N N 109 114.631 114.631 116.449 -1.818 18792 2912 1 4 . 1 1 109 109 SER C C 109 177.770 177.770 176.413 1.357 18792 2913 1 4 . 1 1 109 109 SER CA C 109 63.349 63.349 60.866 2.483 18792 2914 1 4 . 1 1 109 109 SER H H 109 8.424 8.424 7.797 0.627 18792 2915 1 4 . 1 1 110 110 PHE N N 110 124.230 124.230 124.805 -0.575 18792 2916 1 4 . 1 1 110 110 PHE C C 110 176.708 176.708 177.184 -0.476 18792 2917 1 4 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.234 0.380 18792 2918 1 4 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.980 -1.536 18792 2919 1 4 . 1 1 110 110 PHE H H 110 9.052 9.052 8.349 0.703 18792 2920 1 4 . 1 1 111 111 GLY N N 111 105.893 105.893 106.198 -0.305 18792 2921 1 4 . 1 1 111 111 GLY C C 111 176.795 176.795 175.598 1.197 18792 2922 1 4 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.212 1.165 18792 2923 1 4 . 1 1 111 111 GLY H H 111 7.926 7.926 8.535 -0.609 18792 2924 1 4 . 1 1 112 112 GLY N N 112 107.410 107.410 109.248 -1.838 18792 2925 1 4 . 1 1 112 112 GLY C C 112 174.650 174.650 175.264 -0.614 18792 2926 1 4 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.168 1.137 18792 2927 1 4 . 1 1 112 112 GLY H H 112 8.799 8.799 7.986 0.813 18792 2928 1 4 . 1 1 113 113 ALA N N 113 124.313 124.313 124.234 0.079 18792 2929 1 4 . 1 1 113 113 ALA C C 113 181.300 181.300 179.166 2.134 18792 2930 1 4 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.338 0.189 18792 2931 1 4 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.032 -0.549 18792 2932 1 4 . 1 1 113 113 ALA H H 113 8.212 8.212 7.547 0.665 18792 2933 1 4 . 1 1 114 114 LEU N N 114 118.878 118.878 119.281 -0.403 18792 2934 1 4 . 1 1 114 114 LEU C C 114 180.286 180.286 178.211 2.075 18792 2935 1 4 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.383 -0.401 18792 2936 1 4 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.728 -0.711 18792 2937 1 4 . 1 1 114 114 LEU H H 114 8.161 8.161 7.575 0.586 18792 2938 1 4 . 1 1 115 115 CYS N N 115 119.002 119.002 117.668 1.334 18792 2939 1 4 . 1 1 115 115 CYS C C 115 176.087 176.087 176.524 -0.437 18792 2940 1 4 . 1 1 115 115 CYS CA C 115 63.944 63.944 64.375 -0.431 18792 2941 1 4 . 1 1 115 115 CYS CB C 115 25.635 25.635 26.786 -1.151 18792 2942 1 4 . 1 1 115 115 CYS H H 115 8.070 8.070 8.385 -0.315 18792 2943 1 4 . 1 1 116 116 VAL N N 116 118.737 118.737 120.166 -1.429 18792 2944 1 4 . 1 1 116 116 VAL C C 116 177.494 177.494 177.131 0.363 18792 2945 1 4 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.068 0.694 18792 2946 1 4 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.587 -0.824 18792 2947 1 4 . 1 1 116 116 VAL H H 116 7.995 7.995 7.987 0.008 18792 2948 1 4 . 1 1 117 117 GLU N N 117 118.886 118.886 119.632 -0.746 18792 2949 1 4 . 1 1 117 117 GLU C C 117 178.424 178.424 178.590 -0.166 18792 2950 1 4 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.308 -0.548 18792 2951 1 4 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.492 -1.438 18792 2952 1 4 . 1 1 117 117 GLU H H 117 8.059 8.059 7.908 0.151 18792 2953 1 4 . 1 1 118 118 SER N N 118 113.417 113.417 116.060 -2.643 18792 2954 1 4 . 1 1 118 118 SER C C 118 175.607 175.607 176.594 -0.987 18792 2955 1 4 . 1 1 118 118 SER CA C 118 62.638 62.638 61.916 0.723 18792 2956 1 4 . 1 1 118 118 SER CB C 118 61.061 61.061 63.070 -2.009 18792 2957 1 4 . 1 1 118 118 SER H H 118 7.626 7.626 7.440 0.186 18792 2958 1 4 . 1 1 119 119 VAL N N 119 120.612 120.612 120.781 -0.169 18792 2959 1 4 . 1 1 119 119 VAL C C 119 179.713 179.713 178.018 1.695 18792 2960 1 4 . 1 1 119 119 VAL CA C 119 66.225 66.225 66.401 -0.176 18792 2961 1 4 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.079 -1.000 18792 2962 1 4 . 1 1 119 119 VAL H H 119 7.297 7.297 7.712 -0.415 18792 2963 1 4 . 1 1 120 120 ASP N N 120 122.546 122.546 118.791 3.755 18792 2964 1 4 . 1 1 120 120 ASP C C 120 178.057 178.057 177.254 0.803 18792 2965 1 4 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.385 0.604 18792 2966 1 4 . 1 1 120 120 ASP CB C 120 39.923 39.923 41.096 -1.173 18792 2967 1 4 . 1 1 120 120 ASP H H 120 8.264 8.264 7.823 0.441 18792 2968 1 4 . 1 1 121 121 LYS N N 121 115.636 115.636 118.638 -3.002 18792 2969 1 4 . 1 1 121 121 LYS C C 121 175.159 175.159 175.465 -0.306 18792 2970 1 4 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.567 -1.307 18792 2971 1 4 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.808 -2.033 18792 2972 1 4 . 1 1 121 121 LYS H H 121 7.558 7.558 7.287 0.271 18792 2973 1 4 . 1 1 122 122 GLU N N 122 113.915 113.915 113.202 0.713 18792 2974 1 4 . 1 1 122 122 GLU C C 122 176.109 176.109 176.469 -0.360 18792 2975 1 4 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.026 -0.719 18792 2976 1 4 . 1 1 122 122 GLU CB C 122 25.332 25.332 26.737 -1.405 18792 2977 1 4 . 1 1 122 122 GLU H H 122 7.826 7.826 7.978 -0.152 18792 2978 1 4 . 1 1 124 124 GLN N N 124 119.233 119.233 121.487 -2.254 18792 2979 1 4 . 1 1 124 124 GLN C C 124 177.640 177.640 177.153 0.487 18792 2980 1 4 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.751 0.721 18792 2981 1 4 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.000 -1.510 18792 2982 1 4 . 1 1 124 124 GLN H H 124 8.626 8.626 8.464 0.162 18792 2983 1 4 . 1 1 125 125 VAL N N 125 117.011 117.011 119.775 -2.764 18792 2984 1 4 . 1 1 125 125 VAL C C 125 175.826 175.826 176.794 -0.968 18792 2985 1 4 . 1 1 125 125 VAL CA C 125 63.136 63.136 65.135 -1.999 18792 2986 1 4 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.600 -1.303 18792 2987 1 4 . 1 1 125 125 VAL H H 125 7.870 7.870 7.901 -0.031 18792 2988 1 4 . 1 1 126 126 LEU N N 126 117.058 117.058 114.675 2.383 18792 2989 1 4 . 1 1 126 126 LEU C C 126 178.096 178.096 178.004 0.092 18792 2990 1 4 . 1 1 126 126 LEU CA C 126 55.085 55.085 56.176 -1.091 18792 2991 1 4 . 1 1 126 126 LEU CB C 126 40.273 40.273 41.582 -1.309 18792 2992 1 4 . 1 1 126 126 LEU H H 126 7.747 7.747 7.694 0.053 18792 2993 1 4 . 1 1 127 127 VAL N N 127 119.457 119.457 122.826 -3.369 18792 2994 1 4 . 1 1 127 127 VAL C C 127 177.150 177.150 177.826 -0.676 18792 2995 1 4 . 1 1 127 127 VAL CA C 127 67.156 67.156 67.491 -0.335 18792 2996 1 4 . 1 1 127 127 VAL CB C 127 29.753 29.753 31.098 -1.345 18792 2997 1 4 . 1 1 127 127 VAL H H 127 7.306 7.306 7.394 -0.087 18792 2998 1 4 . 1 1 128 128 SER N N 128 110.647 110.647 114.441 -3.794 18792 2999 1 4 . 1 1 128 128 SER C C 128 177.222 177.222 176.755 0.467 18792 3000 1 4 . 1 1 128 128 SER CA C 128 60.752 60.752 61.539 -0.788 18792 3001 1 4 . 1 1 128 128 SER CB C 128 61.605 61.605 62.845 -1.240 18792 3002 1 4 . 1 1 128 128 SER H H 128 8.237 8.237 7.746 0.491 18792 3003 1 4 . 1 1 129 129 ARG N N 129 123.100 123.100 121.764 1.336 18792 3004 1 4 . 1 1 129 129 ARG C C 129 175.802 175.802 178.604 -2.802 18792 3005 1 4 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.122 -0.895 18792 3006 1 4 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.179 -1.980 18792 3007 1 4 . 1 1 129 129 ARG H H 129 6.564 6.564 7.784 -1.220 18792 3008 1 4 . 1 1 130 130 ILE N N 130 118.182 118.182 120.423 -2.241 18792 3009 1 4 . 1 1 130 130 ILE C C 130 178.156 178.156 177.717 0.439 18792 3010 1 4 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.172 -0.826 18792 3011 1 4 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.427 -0.745 18792 3012 1 4 . 1 1 130 130 ILE H H 130 7.955 7.955 8.292 -0.337 18792 3013 1 4 . 1 1 131 131 ALA N N 131 119.029 119.029 121.865 -2.836 18792 3014 1 4 . 1 1 131 131 ALA C C 131 179.593 179.593 179.303 0.290 18792 3015 1 4 . 1 1 131 131 ALA CA C 131 54.598 54.598 54.786 -0.188 18792 3016 1 4 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.299 -0.911 18792 3017 1 4 . 1 1 131 131 ALA H H 131 7.582 7.582 8.298 -0.716 18792 3018 1 4 . 1 1 132 132 ALA N N 132 120.336 120.336 121.866 -1.530 18792 3019 1 4 . 1 1 132 132 ALA C C 132 181.095 181.095 179.315 1.780 18792 3020 1 4 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.793 -0.195 18792 3021 1 4 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.817 -2.116 18792 3022 1 4 . 1 1 132 132 ALA H H 132 7.224 7.224 7.870 -0.646 18792 3023 1 4 . 1 1 133 133 TRP N N 133 121.194 121.194 121.689 -0.495 18792 3024 1 4 . 1 1 133 133 TRP C C 133 179.698 179.698 178.336 1.362 18792 3025 1 4 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.125 -2.823 18792 3026 1 4 . 1 1 133 133 TRP CB C 133 27.655 27.655 30.428 -2.773 18792 3027 1 4 . 1 1 133 133 TRP H H 133 8.925 8.925 8.596 0.329 18792 3028 1 4 . 1 1 134 134 MET N N 134 116.987 116.987 115.794 1.193 18792 3029 1 4 . 1 1 134 134 MET C C 134 178.277 178.277 177.944 0.333 18792 3030 1 4 . 1 1 134 134 MET CA C 134 59.578 59.578 59.006 0.572 18792 3031 1 4 . 1 1 134 134 MET CB C 134 33.559 33.559 32.529 1.030 18792 3032 1 4 . 1 1 134 134 MET H H 134 8.863 8.863 8.689 0.174 18792 3033 1 4 . 1 1 135 135 ALA N N 135 120.523 120.523 122.402 -1.879 18792 3034 1 4 . 1 1 135 135 ALA C C 135 179.298 179.298 179.667 -0.369 18792 3035 1 4 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.168 0.265 18792 3036 1 4 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.709 -2.071 18792 3037 1 4 . 1 1 135 135 ALA H H 135 8.152 8.152 8.186 -0.034 18792 3038 1 4 . 1 1 136 136 THR N N 136 116.715 116.715 114.929 1.786 18792 3039 1 4 . 1 1 136 136 THR C C 136 175.106 175.106 176.443 -1.337 18792 3040 1 4 . 1 1 136 136 THR CA C 136 66.729 66.729 66.359 0.370 18792 3041 1 4 . 1 1 136 136 THR CB C 136 68.441 68.441 68.710 -0.270 18792 3042 1 4 . 1 1 136 136 THR H H 136 8.532 8.532 8.156 0.376 18792 3043 1 4 . 1 1 137 137 TYR N N 137 123.204 123.204 122.280 0.924 18792 3044 1 4 . 1 1 137 137 TYR C C 137 179.592 179.592 178.173 1.419 18792 3045 1 4 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.734 1.331 18792 3046 1 4 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.669 0.319 18792 3047 1 4 . 1 1 137 137 TYR H H 137 8.809 8.809 7.572 1.237 18792 3048 1 4 . 1 1 138 138 LEU N N 138 119.247 119.247 120.483 -1.236 18792 3049 1 4 . 1 1 138 138 LEU C C 138 178.385 178.385 177.954 0.431 18792 3050 1 4 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.355 0.583 18792 3051 1 4 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.322 -0.614 18792 3052 1 4 . 1 1 138 138 LEU H H 138 8.742 8.742 8.067 0.675 18792 3053 1 4 . 1 1 139 139 ASN N N 139 117.122 117.122 115.583 1.539 18792 3054 1 4 . 1 1 139 139 ASN C C 139 176.417 176.417 177.242 -0.825 18792 3055 1 4 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.553 0.895 18792 3056 1 4 . 1 1 139 139 ASN CB C 139 38.652 38.652 37.920 0.732 18792 3057 1 4 . 1 1 139 139 ASN H H 139 8.307 8.307 7.972 0.335 18792 3058 1 4 . 1 1 140 140 ASP N N 140 115.394 115.394 119.990 -4.596 18792 3059 1 4 . 1 1 140 140 ASP C C 140 177.919 177.919 177.119 0.800 18792 3060 1 4 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.919 -0.966 18792 3061 1 4 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.840 -1.454 18792 3062 1 4 . 1 1 140 140 ASP H H 140 8.439 8.439 7.958 0.481 18792 3063 1 4 . 1 1 141 141 HIS N N 141 111.695 111.695 111.500 0.195 18792 3064 1 4 . 1 1 141 141 HIS C C 141 175.949 175.949 176.403 -0.454 18792 3065 1 4 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.207 -0.150 18792 3066 1 4 . 1 1 141 141 HIS CB C 141 29.908 29.908 30.141 -0.233 18792 3067 1 4 . 1 1 141 141 HIS H H 141 8.043 8.043 7.194 0.849 18792 3068 1 4 . 1 1 142 142 LEU N N 142 117.054 117.054 122.979 -5.925 18792 3069 1 4 . 1 1 142 142 LEU C C 142 176.530 176.530 177.852 -1.322 18792 3070 1 4 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.028 -2.719 18792 3071 1 4 . 1 1 142 142 LEU CB C 142 42.338 42.338 42.064 0.274 18792 3072 1 4 . 1 1 142 142 LEU H H 142 7.198 7.198 8.205 -1.007 18792 3073 1 4 . 1 1 143 143 GLU N N 143 121.335 121.335 120.138 1.197 18792 3074 1 4 . 1 1 143 143 GLU C C 143 173.964 173.964 175.640 -1.676 18792 3075 1 4 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.578 -0.324 18792 3076 1 4 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.380 -2.123 18792 3077 1 4 . 1 1 143 143 GLU H H 143 8.565 8.565 7.801 0.764 18792 3078 1 4 . 1 1 145 145 TRP N N 145 117.973 117.973 120.179 -2.206 18792 3079 1 4 . 1 1 145 145 TRP C C 145 179.526 179.526 177.486 2.040 18792 3080 1 4 . 1 1 145 145 TRP CA C 145 61.606 61.606 59.539 2.067 18792 3081 1 4 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.966 -2.078 18792 3082 1 4 . 1 1 145 145 TRP H H 145 7.078 7.078 8.393 -1.315 18792 3083 1 4 . 1 1 146 146 ILE N N 146 122.101 122.101 111.557 10.544 18792 3084 1 4 . 1 1 146 146 ILE C C 146 179.110 179.110 177.238 1.872 18792 3085 1 4 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.142 4.191 18792 3086 1 4 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.911 -1.089 18792 3087 1 4 . 1 1 146 146 ILE H H 146 8.389 8.389 7.676 0.713 18792 3088 1 4 . 1 1 147 147 GLN N N 147 116.344 116.344 121.832 -5.488 18792 3089 1 4 . 1 1 147 147 GLN C C 147 179.526 179.526 177.893 1.633 18792 3090 1 4 . 1 1 147 147 GLN CA C 147 58.013 58.013 59.184 -1.171 18792 3091 1 4 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.354 -1.631 18792 3092 1 4 . 1 1 147 147 GLN H H 147 8.376 8.376 8.217 0.159 18792 3093 1 4 . 1 1 148 148 GLU N N 148 118.913 118.913 120.178 -1.265 18792 3094 1 4 . 1 1 148 148 GLU C C 148 176.880 176.880 177.630 -0.750 18792 3095 1 4 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.250 -2.877 18792 3096 1 4 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.617 -1.185 18792 3097 1 4 . 1 1 148 148 GLU H H 148 7.504 7.504 8.236 -0.732 18792 3098 1 4 . 1 1 149 149 ASN N N 149 116.616 116.616 112.700 3.916 18792 3099 1 4 . 1 1 149 149 ASN C C 149 173.964 173.964 176.659 -2.695 18792 3100 1 4 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.283 -0.037 18792 3101 1 4 . 1 1 149 149 ASN CB C 149 37.133 37.133 38.883 -1.750 18792 3102 1 4 . 1 1 149 149 ASN H H 149 7.070 7.070 8.069 -0.999 18792 3103 1 4 . 1 1 150 150 GLY N N 150 104.750 104.750 106.680 -1.930 18792 3104 1 4 . 1 1 150 150 GLY C C 150 176.022 176.022 174.226 1.796 18792 3105 1 4 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.119 0.123 18792 3106 1 4 . 1 1 150 150 GLY H H 150 7.313 7.313 8.172 -0.859 18792 3107 1 4 . 1 1 151 151 GLY N N 151 108.385 108.385 109.040 -0.655 18792 3108 1 4 . 1 1 151 151 GLY C C 151 173.449 173.449 175.131 -1.682 18792 3109 1 4 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.405 -1.373 18792 3110 1 4 . 1 1 151 151 GLY H H 151 8.452 8.452 7.474 0.978 18792 3111 1 4 . 1 1 152 152 TRP N N 152 118.092 118.092 122.457 -4.365 18792 3112 1 4 . 1 1 152 152 TRP C C 152 178.571 178.571 178.113 0.458 18792 3113 1 4 . 1 1 152 152 TRP CA C 152 60.077 60.077 62.357 -2.280 18792 3114 1 4 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.740 -1.152 18792 3115 1 4 . 1 1 152 152 TRP H H 152 8.644 8.644 9.245 -0.601 18792 3116 1 4 . 1 1 153 153 ASP N N 153 117.758 117.758 117.374 0.384 18792 3117 1 4 . 1 1 153 153 ASP C C 153 179.796 179.796 178.359 1.437 18792 3118 1 4 . 1 1 153 153 ASP CA C 153 57.302 57.302 58.179 -0.877 18792 3119 1 4 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.099 -1.868 18792 3120 1 4 . 1 1 153 153 ASP H H 153 8.827 8.827 8.519 0.308 18792 3121 1 4 . 1 1 154 154 THR N N 154 116.817 116.817 114.334 2.483 18792 3122 1 4 . 1 1 154 154 THR C C 154 175.352 175.352 176.085 -0.733 18792 3123 1 4 . 1 1 154 154 THR CA C 154 65.910 65.910 65.614 0.296 18792 3124 1 4 . 1 1 154 154 THR CB C 154 67.712 67.712 68.365 -0.653 18792 3125 1 4 . 1 1 154 154 THR H H 154 7.494 7.494 7.582 -0.088 18792 3126 1 4 . 1 1 155 155 PHE N N 155 122.196 122.196 122.328 -0.132 18792 3127 1 4 . 1 1 155 155 PHE C C 155 176.831 176.831 177.810 -0.979 18792 3128 1 4 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.168 0.118 18792 3129 1 4 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.257 -1.590 18792 3130 1 4 . 1 1 155 155 PHE H H 155 6.477 6.477 8.474 -1.997 18792 3131 1 4 . 1 1 156 156 VAL N N 156 117.387 117.387 117.636 -0.249 18792 3132 1 4 . 1 1 156 156 VAL C C 156 178.497 178.497 177.719 0.778 18792 3133 1 4 . 1 1 156 156 VAL CA C 156 66.231 66.231 65.463 0.768 18792 3134 1 4 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.057 -0.372 18792 3135 1 4 . 1 1 156 156 VAL H H 156 7.788 7.788 7.921 -0.133 18792 3136 1 4 . 1 1 157 157 GLU N N 157 119.876 119.876 120.386 -0.510 18792 3137 1 4 . 1 1 157 157 GLU C C 157 178.399 178.399 178.253 0.146 18792 3138 1 4 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.847 -0.087 18792 3139 1 4 . 1 1 157 157 GLU CB C 157 28.277 28.277 30.087 -1.810 18792 3140 1 4 . 1 1 157 157 GLU H H 157 7.409 7.409 7.963 -0.554 18792 3141 1 4 . 1 1 158 158 LEU N N 158 117.194 117.194 118.554 -1.360 18792 3142 1 4 . 1 1 158 158 LEU C C 158 178.595 178.595 176.954 1.641 18792 3143 1 4 . 1 1 158 158 LEU CA C 158 56.377 56.377 55.203 1.174 18792 3144 1 4 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.829 -0.258 18792 3145 1 4 . 1 1 158 158 LEU H H 158 7.584 7.584 8.033 -0.449 18792 3146 1 4 . 1 1 159 159 TYR N N 159 115.549 115.549 118.056 -2.507 18792 3147 1 4 . 1 1 159 159 TYR C C 159 177.032 177.032 175.930 1.102 18792 3148 1 4 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.019 0.097 18792 3149 1 4 . 1 1 159 159 TYR CB C 159 37.599 37.599 36.321 1.278 18792 3150 1 4 . 1 1 159 159 TYR H H 159 8.099 8.099 7.586 0.513 18792 3151 1 4 . 1 1 160 160 GLY N N 160 108.334 108.334 108.080 0.254 18792 3152 1 4 . 1 1 160 160 GLY C C 160 173.973 173.973 174.334 -0.361 18792 3153 1 4 . 1 1 160 160 GLY CA C 160 45.064 45.064 45.561 -0.497 18792 3154 1 4 . 1 1 160 160 GLY H H 160 8.020 8.020 8.313 -0.293 18792 3155 1 4 . 1 1 161 161 ASN N N 161 118.189 118.189 115.946 2.243 18792 3156 1 4 . 1 1 161 161 ASN C C 161 175.513 175.513 174.874 0.639 18792 3157 1 4 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.475 -1.371 18792 3158 1 4 . 1 1 161 161 ASN CB C 161 38.203 38.203 37.858 0.344 18792 3159 1 4 . 1 1 161 161 ASN H H 161 8.327 8.327 8.157 0.170 18792 3160 1 4 . 1 1 162 162 ASN N N 162 119.022 119.022 120.300 -1.278 18792 3161 1 4 . 1 1 162 162 ASN C C 162 175.690 175.690 174.628 1.062 18792 3162 1 4 . 1 1 162 162 ASN CA C 162 53.424 53.424 54.196 -0.772 18792 3163 1 4 . 1 1 162 162 ASN CB C 162 38.203 38.203 36.839 1.364 18792 3164 1 4 . 1 1 162 162 ASN H H 162 8.363 8.363 8.736 -0.373 18792 3165 1 4 . 1 1 163 163 ALA N N 163 123.275 123.275 125.447 -2.172 18792 3166 1 4 . 1 1 163 163 ALA C C 163 178.598 178.598 177.900 0.698 18792 3167 1 4 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.789 0.449 18792 3168 1 4 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.256 -1.645 18792 3169 1 4 . 1 1 163 163 ALA H H 163 8.103 8.103 8.496 -0.393 18792 3170 1 4 . 1 1 164 164 ALA N N 164 121.521 121.521 121.670 -0.149 18792 3171 1 4 . 1 1 164 164 ALA C C 164 178.642 178.642 179.657 -1.015 18792 3172 1 4 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.146 -1.562 18792 3173 1 4 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.803 -0.984 18792 3174 1 4 . 1 1 164 164 ALA H H 164 8.053 8.053 8.570 -0.517 18792 3175 1 4 . 1 1 165 165 ALA N N 165 122.101 122.101 120.033 2.068 18792 3176 1 4 . 1 1 165 165 ALA C C 165 179.124 179.124 177.648 1.476 18792 3177 1 4 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.050 -0.911 18792 3178 1 4 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.542 -0.564 18792 3179 1 4 . 1 1 165 165 ALA H H 165 7.949 7.949 8.096 -0.147 18792 3180 1 4 . 1 1 166 166 GLU N N 166 118.381 118.381 116.417 1.964 18792 3181 1 4 . 1 1 166 166 GLU C C 166 177.664 177.664 176.746 0.918 18792 3182 1 4 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.648 0.440 18792 3183 1 4 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.672 -1.318 18792 3184 1 4 . 1 1 166 166 GLU H H 166 8.202 8.202 8.050 0.152 18792 3185 1 4 . 1 1 167 167 SER N N 167 115.193 115.193 115.295 -0.102 18792 3186 1 4 . 1 1 167 167 SER C C 167 175.312 175.312 175.500 -0.188 18792 3187 1 4 . 1 1 167 167 SER CA C 167 58.831 58.831 60.220 -1.389 18792 3188 1 4 . 1 1 167 167 SER CB C 167 62.537 62.537 64.093 -1.556 18792 3189 1 4 . 1 1 167 167 SER H H 167 8.029 8.029 8.105 -0.076 18792 3190 1 4 . 1 1 168 168 ARG N N 168 121.696 121.696 117.298 4.398 18792 3191 1 4 . 1 1 168 168 ARG C C 168 176.880 176.880 174.746 2.134 18792 3192 1 4 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.622 -0.459 18792 3193 1 4 . 1 1 168 168 ARG CB C 168 29.209 29.209 31.437 -2.228 18792 3194 1 4 . 1 1 168 168 ARG H H 168 7.967 7.967 8.454 -0.487 18792 3195 1 4 . 1 1 169 169 LYS N N 169 120.917 120.917 119.648 1.269 18792 3196 1 4 . 1 1 169 169 LYS C C 169 177.640 177.640 175.370 2.270 18792 3197 1 4 . 1 1 169 169 LYS CA C 169 56.697 56.697 55.881 0.816 18792 3198 1 4 . 1 1 169 169 LYS CB C 169 31.462 31.462 33.610 -2.148 18792 3199 1 4 . 1 1 169 169 LYS H H 169 8.011 8.011 7.987 0.024 18792 3200 1 4 . 1 1 170 170 GLY N N 170 109.155 109.155 107.377 1.778 18792 3201 1 4 . 1 1 170 170 GLY C C 170 174.479 174.479 173.960 0.519 18792 3202 1 4 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.776 0.288 18792 3203 1 4 . 1 1 170 170 GLY H H 170 8.329 8.329 8.308 0.021 18792 3204 1 4 . 1 1 171 171 GLN N N 171 119.292 119.292 117.820 1.472 18792 3205 1 4 . 1 1 171 171 GLN C C 171 176.463 176.463 174.734 1.729 18792 3206 1 4 . 1 1 171 171 GLN CA C 171 55.666 55.666 56.507 -0.841 18792 3207 1 4 . 1 1 171 171 GLN CB C 171 28.199 28.199 28.808 -0.609 18792 3208 1 4 . 1 1 171 171 GLN H H 171 8.035 8.035 8.288 -0.253 18792 3209 1 4 . 1 1 172 172 GLU N N 172 121.703 121.703 119.837 1.866 18792 3210 1 4 . 1 1 172 172 GLU C C 172 176.414 176.414 175.014 1.400 18792 3211 1 4 . 1 1 172 172 GLU CA C 172 56.341 56.341 56.406 -0.065 18792 3212 1 4 . 1 1 172 172 GLU CB C 172 28.821 28.821 30.297 -1.476 18792 3213 1 4 . 1 1 172 172 GLU H H 172 8.405 8.405 8.524 -0.119 18792 3214 1 4 . 1 1 173 173 ARG N N 173 121.852 121.852 119.600 2.252 18792 3215 1 4 . 1 1 173 173 ARG C C 173 176.365 176.365 176.155 0.210 18792 3216 1 4 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.479 0.720 18792 3217 1 4 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.525 -2.394 18792 3218 1 4 . 1 1 173 173 ARG H H 173 8.335 8.335 7.971 0.364 18792 3219 1 4 . 1 1 174 174 LEU N N 174 122.640 122.640 118.419 4.221 18792 3220 1 4 . 1 1 174 174 LEU C C 174 176.523 176.523 177.473 -0.950 18792 3221 1 4 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.709 -0.941 18792 3222 1 4 . 1 1 174 174 LEU CB C 174 40.784 40.784 42.601 -1.817 18792 3223 1 4 . 1 1 174 174 LEU H H 174 8.082 8.082 8.130 -0.049 18792 3224 1 4 . 1 1 175 175 GLU N N 175 125.909 125.909 118.153 7.756 18792 3225 1 4 . 1 1 175 175 GLU C C 175 181.029 181.029 175.471 5.558 18792 3226 1 4 . 1 1 175 175 GLU CA C 175 57.398 57.398 57.021 0.377 18792 3227 1 4 . 1 1 175 175 GLU CB C 175 30.050 30.050 30.532 -0.482 18792 3228 1 4 . 1 1 175 175 GLU H H 175 7.785 7.785 8.599 -0.814 18792 3229 1 5 . 1 1 4 4 ALA N N 4 124.786 124.786 124.046 0.740 18792 3230 1 5 . 1 1 4 4 ALA C C 4 178.272 178.272 178.582 -0.310 18792 3231 1 5 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.713 -2.147 18792 3232 1 5 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.847 -0.613 18792 3233 1 5 . 1 1 4 4 ALA H H 4 8.414 8.414 8.664 -0.250 18792 3234 1 5 . 1 1 5 5 MET N N 5 119.681 119.681 117.098 2.583 18792 3235 1 5 . 1 1 5 5 MET C C 5 176.929 176.929 176.680 0.249 18792 3236 1 5 . 1 1 5 5 MET CA C 5 55.594 55.594 54.495 1.099 18792 3237 1 5 . 1 1 5 5 MET CB C 5 31.540 31.540 31.352 0.188 18792 3238 1 5 . 1 1 5 5 MET H H 5 8.336 8.336 8.105 0.231 18792 3239 1 5 . 1 1 6 6 SER N N 6 116.162 116.162 117.213 -1.051 18792 3240 1 5 . 1 1 6 6 SER C C 6 175.924 175.924 176.351 -0.427 18792 3241 1 5 . 1 1 6 6 SER CA C 6 59.009 59.009 61.030 -2.021 18792 3242 1 5 . 1 1 6 6 SER CB C 6 62.537 62.537 63.166 -0.630 18792 3243 1 5 . 1 1 6 6 SER H H 6 8.272 8.272 7.704 0.568 18792 3244 1 5 . 1 1 7 7 GLN N N 7 122.263 122.263 120.016 2.247 18792 3245 1 5 . 1 1 7 7 GLN C C 7 177.027 177.027 177.568 -0.541 18792 3246 1 5 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.464 -2.194 18792 3247 1 5 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.668 -0.929 18792 3248 1 5 . 1 1 7 7 GLN H H 7 8.314 8.314 8.612 -0.298 18792 3249 1 5 . 1 1 8 8 SER N N 8 116.625 116.625 116.720 -0.095 18792 3250 1 5 . 1 1 8 8 SER C C 8 176.457 176.457 176.099 0.358 18792 3251 1 5 . 1 1 8 8 SER CA C 8 59.650 59.650 61.251 -1.601 18792 3252 1 5 . 1 1 8 8 SER CB C 8 62.226 62.226 62.795 -0.569 18792 3253 1 5 . 1 1 8 8 SER H H 8 8.333 8.333 8.167 0.166 18792 3254 1 5 . 1 1 9 9 ASN N N 9 121.307 121.307 119.210 2.097 18792 3255 1 5 . 1 1 9 9 ASN C C 9 177.419 177.419 177.380 0.039 18792 3256 1 5 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.368 -0.881 18792 3257 1 5 . 1 1 9 9 ASN CB C 9 37.133 37.133 37.999 -0.866 18792 3258 1 5 . 1 1 9 9 ASN H H 9 8.611 8.611 7.885 0.726 18792 3259 1 5 . 1 1 10 10 ARG N N 10 119.830 119.830 120.857 -1.027 18792 3260 1 5 . 1 1 10 10 ARG C C 10 177.615 177.615 178.549 -0.934 18792 3261 1 5 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.717 -0.459 18792 3262 1 5 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.291 -2.092 18792 3263 1 5 . 1 1 10 10 ARG H H 10 7.996 7.996 7.473 0.523 18792 3264 1 5 . 1 1 11 11 GLU N N 11 117.270 117.270 120.075 -2.805 18792 3265 1 5 . 1 1 11 11 GLU C C 11 179.649 179.649 178.713 0.936 18792 3266 1 5 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.511 -0.502 18792 3267 1 5 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.298 -1.177 18792 3268 1 5 . 1 1 11 11 GLU H H 11 7.885 7.885 8.266 -0.381 18792 3269 1 5 . 1 1 12 12 LEU N N 12 119.900 119.900 120.942 -1.042 18792 3270 1 5 . 1 1 12 12 LEU C C 12 178.473 178.473 178.491 -0.018 18792 3271 1 5 . 1 1 12 12 LEU CA C 12 57.693 57.693 57.915 -0.222 18792 3272 1 5 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.591 -0.962 18792 3273 1 5 . 1 1 12 12 LEU H H 12 7.691 7.691 7.977 -0.286 18792 3274 1 5 . 1 1 13 13 VAL N N 13 117.320 117.320 118.541 -1.221 18792 3275 1 5 . 1 1 13 13 VAL C C 13 177.272 177.272 178.251 -0.979 18792 3276 1 5 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.577 0.579 18792 3277 1 5 . 1 1 13 13 VAL CB C 13 31.229 31.229 30.966 0.263 18792 3278 1 5 . 1 1 13 13 VAL H H 13 7.629 7.629 7.578 0.051 18792 3279 1 5 . 1 1 14 14 VAL N N 14 116.659 116.659 120.712 -4.053 18792 3280 1 5 . 1 1 14 14 VAL C C 14 178.718 178.718 177.956 0.762 18792 3281 1 5 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.700 -0.184 18792 3282 1 5 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.307 -0.933 18792 3283 1 5 . 1 1 14 14 VAL H H 14 8.210 8.210 7.816 0.394 18792 3284 1 5 . 1 1 15 15 ASP N N 15 120.374 120.374 121.520 -1.146 18792 3285 1 5 . 1 1 15 15 ASP C C 15 177.557 177.557 178.545 -0.988 18792 3286 1 5 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.897 0.579 18792 3287 1 5 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.695 1.858 18792 3288 1 5 . 1 1 15 15 ASP H H 15 7.967 7.967 8.589 -0.622 18792 3289 1 5 . 1 1 16 16 PHE N N 16 119.864 119.864 121.456 -1.592 18792 3290 1 5 . 1 1 16 16 PHE C C 16 178.252 178.252 177.542 0.710 18792 3291 1 5 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.675 1.105 18792 3292 1 5 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.143 -0.083 18792 3293 1 5 . 1 1 16 16 PHE H H 16 8.228 8.228 7.898 0.330 18792 3294 1 5 . 1 1 17 17 LEU N N 17 116.312 116.312 120.047 -3.735 18792 3295 1 5 . 1 1 17 17 LEU C C 17 179.649 179.649 178.805 0.844 18792 3296 1 5 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.838 -1.074 18792 3297 1 5 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.684 -1.599 18792 3298 1 5 . 1 1 17 17 LEU H H 17 8.766 8.766 8.342 0.424 18792 3299 1 5 . 1 1 18 18 SER N N 18 113.715 113.715 114.698 -0.983 18792 3300 1 5 . 1 1 18 18 SER C C 18 177.362 177.362 176.363 0.999 18792 3301 1 5 . 1 1 18 18 SER CA C 18 61.948 61.948 61.395 0.553 18792 3302 1 5 . 1 1 18 18 SER CB C 18 63.003 63.003 63.121 -0.118 18792 3303 1 5 . 1 1 18 18 SER H H 18 8.384 8.384 8.420 -0.036 18792 3304 1 5 . 1 1 19 19 TYR N N 19 124.570 124.570 122.931 1.639 18792 3305 1 5 . 1 1 19 19 TYR C C 19 178.415 178.415 177.760 0.655 18792 3306 1 5 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.997 -2.233 18792 3307 1 5 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.689 -1.673 18792 3308 1 5 . 1 1 19 19 TYR H H 19 8.155 8.155 8.672 -0.517 18792 3309 1 5 . 1 1 20 20 LYS N N 20 119.739 119.739 120.270 -0.531 18792 3310 1 5 . 1 1 20 20 LYS C C 20 180.456 180.456 179.274 1.182 18792 3311 1 5 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.391 -2.903 18792 3312 1 5 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.378 -4.219 18792 3313 1 5 . 1 1 20 20 LYS H H 20 8.224 8.224 8.204 0.020 18792 3314 1 5 . 1 1 21 21 LEU N N 21 118.092 118.092 120.036 -1.944 18792 3315 1 5 . 1 1 21 21 LEU C C 21 179.989 179.989 178.731 1.258 18792 3316 1 5 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.358 -0.231 18792 3317 1 5 . 1 1 21 21 LEU CB C 21 39.608 39.608 42.119 -2.511 18792 3318 1 5 . 1 1 21 21 LEU H H 21 8.586 8.586 8.253 0.333 18792 3319 1 5 . 1 1 22 22 SER N N 22 117.304 117.304 113.714 3.590 18792 3320 1 5 . 1 1 22 22 SER C C 22 180.152 180.152 177.202 2.950 18792 3321 1 5 . 1 1 22 22 SER CA C 22 61.287 61.287 61.098 0.189 18792 3322 1 5 . 1 1 22 22 SER H H 22 8.266 8.266 7.779 0.487 18792 3323 1 5 . 1 1 23 23 GLN N N 23 122.497 122.497 121.648 0.849 18792 3324 1 5 . 1 1 23 23 GLN C C 23 177.297 177.297 178.065 -0.768 18792 3325 1 5 . 1 1 23 23 GLN CA C 23 57.942 57.942 57.993 -0.051 18792 3326 1 5 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.146 -0.335 18792 3327 1 5 . 1 1 23 23 GLN H H 23 7.571 7.571 8.333 -0.762 18792 3328 1 5 . 1 1 24 24 LYS N N 24 116.038 116.038 116.922 -0.884 18792 3329 1 5 . 1 1 24 24 LYS C C 24 175.704 175.704 177.058 -1.354 18792 3330 1 5 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.467 -2.972 18792 3331 1 5 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.152 -1.923 18792 3332 1 5 . 1 1 24 24 LYS H H 24 7.134 7.134 7.700 -0.566 18792 3333 1 5 . 1 1 25 25 GLY N N 25 105.283 105.283 106.678 -1.395 18792 3334 1 5 . 1 1 25 25 GLY C C 25 174.013 174.013 173.132 0.881 18792 3335 1 5 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.888 -0.109 18792 3336 1 5 . 1 1 25 25 GLY H H 25 7.483 7.483 8.142 -0.659 18792 3337 1 5 . 1 1 26 26 TYR N N 26 119.547 119.547 120.030 -0.483 18792 3338 1 5 . 1 1 26 26 TYR C C 26 175.122 175.122 173.896 1.226 18792 3339 1 5 . 1 1 26 26 TYR CA C 26 55.132 55.132 57.685 -2.553 18792 3340 1 5 . 1 1 26 26 TYR CB C 26 40.080 40.080 40.082 -0.002 18792 3341 1 5 . 1 1 26 26 TYR H H 26 7.788 7.788 7.655 0.133 18792 3342 1 5 . 1 1 27 27 SER N N 27 115.088 115.088 120.204 -5.116 18792 3343 1 5 . 1 1 27 27 SER C C 27 174.452 174.452 175.169 -0.717 18792 3344 1 5 . 1 1 27 27 SER CA C 27 56.306 56.306 57.440 -1.134 18792 3345 1 5 . 1 1 27 27 SER CB C 27 63.921 63.921 64.593 -0.672 18792 3346 1 5 . 1 1 27 27 SER H H 27 8.473 8.473 9.202 -0.729 18792 3347 1 5 . 1 1 28 28 TRP N N 28 127.014 127.014 125.832 1.182 18792 3348 1 5 . 1 1 28 28 TRP C C 28 177.002 177.002 177.726 -0.724 18792 3349 1 5 . 1 1 28 28 TRP CA C 28 59.472 59.472 60.320 -0.848 18792 3350 1 5 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.093 0.737 18792 3351 1 5 . 1 1 28 28 TRP H H 28 8.897 8.897 8.864 0.033 18792 3352 1 5 . 1 1 29 29 SER N N 29 112.044 112.044 112.957 -0.913 18792 3353 1 5 . 1 1 29 29 SER C C 29 175.106 175.106 175.963 -0.857 18792 3354 1 5 . 1 1 29 29 SER CA C 29 59.472 59.472 60.597 -1.125 18792 3355 1 5 . 1 1 29 29 SER CB C 29 62.226 62.226 62.936 -0.710 18792 3356 1 5 . 1 1 29 29 SER H H 29 8.129 8.129 8.296 -0.167 18792 3357 1 5 . 1 1 30 30 GLN N N 30 119.160 119.160 119.590 -0.430 18792 3358 1 5 . 1 1 30 30 GLN C C 30 176.218 176.218 176.822 -0.604 18792 3359 1 5 . 1 1 30 30 GLN CA C 30 56.412 56.412 55.676 0.736 18792 3360 1 5 . 1 1 30 30 GLN CB C 30 27.578 27.578 30.305 -2.727 18792 3361 1 5 . 1 1 30 30 GLN H H 30 7.370 7.370 7.692 -0.322 18792 3362 1 5 . 1 1 31 31 PHE N N 31 116.277 116.277 118.656 -2.379 18792 3363 1 5 . 1 1 31 31 PHE C C 31 175.217 175.217 173.908 1.309 18792 3364 1 5 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.400 -3.166 18792 3365 1 5 . 1 1 31 31 PHE CB C 31 39.066 39.066 37.353 1.713 18792 3366 1 5 . 1 1 31 31 PHE H H 31 7.248 7.248 8.762 -1.514 18792 3367 1 5 . 1 1 32 32 SER N N 32 113.683 113.683 112.106 1.577 18792 3368 1 5 . 1 1 32 32 SER C C 32 173.793 173.793 172.133 1.660 18792 3369 1 5 . 1 1 32 32 SER CA C 32 57.124 57.124 55.563 1.561 18792 3370 1 5 . 1 1 32 32 SER CB C 32 63.081 63.081 65.050 -1.969 18792 3371 1 5 . 1 1 32 32 SER H H 32 7.242 7.242 7.204 0.038 18792 3372 1 5 . 1 1 33 33 ASP N N 33 122.195 122.195 119.762 2.433 18792 3373 1 5 . 1 1 33 33 ASP C C 33 176.394 176.394 177.237 -0.843 18792 3374 1 5 . 1 1 33 33 ASP CA C 33 53.748 53.748 54.090 -0.342 18792 3375 1 5 . 1 1 33 33 ASP CB C 33 40.398 40.398 41.278 -0.880 18792 3376 1 5 . 1 1 33 33 ASP H H 33 8.257 8.257 8.405 -0.148 18792 3377 1 5 . 1 1 34 34 VAL N N 34 118.913 118.913 119.545 -0.632 18792 3378 1 5 . 1 1 34 34 VAL C C 34 176.328 176.328 176.081 0.247 18792 3379 1 5 . 1 1 34 34 VAL CA C 34 61.891 61.891 64.459 -2.568 18792 3380 1 5 . 1 1 34 34 VAL CB C 34 32.015 32.015 31.737 0.278 18792 3381 1 5 . 1 1 34 34 VAL H H 34 7.852 7.852 7.423 0.429 18792 3382 1 5 . 1 1 35 35 GLU N N 35 124.205 124.205 116.553 7.652 18792 3383 1 5 . 1 1 35 35 GLU C C 35 176.586 176.586 175.303 1.283 18792 3384 1 5 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.385 -1.328 18792 3385 1 5 . 1 1 35 35 GLU CB C 35 28.898 28.898 28.512 0.386 18792 3386 1 5 . 1 1 35 35 GLU H H 35 8.401 8.401 8.232 0.169 18792 3387 1 5 . 1 1 36 36 GLU N N 36 121.670 121.670 119.628 2.042 18792 3388 1 5 . 1 1 36 36 GLU C C 36 176.218 176.218 175.602 0.616 18792 3389 1 5 . 1 1 36 36 GLU CA C 36 55.988 55.988 55.634 0.354 18792 3390 1 5 . 1 1 36 36 GLU CB C 36 29.442 29.442 29.530 -0.088 18792 3391 1 5 . 1 1 36 36 GLU H H 36 8.239 8.239 8.519 -0.280 18792 3392 1 5 . 1 1 37 37 ASN N N 37 119.252 119.252 119.070 0.182 18792 3393 1 5 . 1 1 37 37 ASN C C 37 175.003 175.003 175.149 -0.146 18792 3394 1 5 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.361 -0.706 18792 3395 1 5 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.351 -1.139 18792 3396 1 5 . 1 1 37 37 ASN H H 37 8.412 8.412 8.384 0.028 18792 3397 1 5 . 1 1 38 38 ARG N N 38 121.622 121.622 119.499 2.123 18792 3398 1 5 . 1 1 38 38 ARG C C 38 176.610 176.610 174.753 1.857 18792 3399 1 5 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.596 -1.232 18792 3400 1 5 . 1 1 38 38 ARG CB C 38 29.419 29.419 30.727 -1.308 18792 3401 1 5 . 1 1 38 38 ARG H H 38 8.227 8.227 8.505 -0.278 18792 3402 1 5 . 1 1 39 39 THR N N 39 115.681 115.681 116.088 -0.407 18792 3403 1 5 . 1 1 39 39 THR C C 39 174.500 174.500 174.554 -0.054 18792 3404 1 5 . 1 1 39 39 THR CA C 39 61.606 61.606 62.023 -0.417 18792 3405 1 5 . 1 1 39 39 THR CB C 39 69.163 69.163 69.845 -0.682 18792 3406 1 5 . 1 1 39 39 THR H H 39 8.173 8.173 8.051 0.122 18792 3407 1 5 . 1 1 40 40 GLU N N 40 122.708 122.708 121.160 1.548 18792 3408 1 5 . 1 1 40 40 GLU C C 40 175.728 175.728 174.874 0.854 18792 3409 1 5 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.484 -0.712 18792 3410 1 5 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.046 0.008 18792 3411 1 5 . 1 1 40 40 GLU H H 40 8.298 8.298 8.400 -0.102 18792 3412 1 5 . 1 1 41 41 ALA N N 41 125.922 125.922 123.314 2.608 18792 3413 1 5 . 1 1 41 41 ALA C C 41 175.557 175.557 175.894 -0.337 18792 3414 1 5 . 1 1 41 41 ALA CA C 41 49.973 49.973 50.818 -0.845 18792 3415 1 5 . 1 1 41 41 ALA CB C 41 17.245 17.245 18.892 -1.647 18792 3416 1 5 . 1 1 41 41 ALA H H 41 8.212 8.212 8.012 0.200 18792 3417 1 5 . 1 1 43 43 GLU N N 43 120.783 120.783 120.392 0.391 18792 3418 1 5 . 1 1 43 43 GLU C C 43 177.174 177.174 176.783 0.391 18792 3419 1 5 . 1 1 43 43 GLU CA C 43 56.341 56.341 55.820 0.521 18792 3420 1 5 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.459 -0.172 18792 3421 1 5 . 1 1 43 43 GLU H H 43 8.519 8.519 8.706 -0.187 18792 3422 1 5 . 1 1 44 44 GLY N N 44 110.022 110.022 109.193 0.829 18792 3423 1 5 . 1 1 44 44 GLY C C 44 174.773 174.773 174.630 0.143 18792 3424 1 5 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.302 -0.274 18792 3425 1 5 . 1 1 44 44 GLY H H 44 8.429 8.429 7.719 0.710 18792 3426 1 5 . 1 1 45 45 THR N N 45 112.790 112.790 108.397 4.393 18792 3427 1 5 . 1 1 45 45 THR C C 45 175.726 175.726 174.226 1.500 18792 3428 1 5 . 1 1 45 45 THR CA C 45 61.987 61.987 63.416 -1.429 18792 3429 1 5 . 1 1 45 45 THR CB C 45 69.304 69.304 67.881 1.423 18792 3430 1 5 . 1 1 45 45 THR H H 45 8.125 8.125 8.252 -0.127 18792 3431 1 5 . 1 1 46 46 GLU N N 46 122.752 122.752 119.649 3.103 18792 3432 1 5 . 1 1 46 46 GLU C C 46 177.419 177.419 175.635 1.784 18792 3433 1 5 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.290 0.941 18792 3434 1 5 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.697 -1.498 18792 3435 1 5 . 1 1 46 46 GLU H H 46 8.765 8.765 8.527 0.238 18792 3436 1 5 . 1 1 47 47 SER N N 47 114.895 114.895 110.450 4.445 18792 3437 1 5 . 1 1 47 47 SER C C 47 175.826 175.826 175.078 0.748 18792 3438 1 5 . 1 1 47 47 SER CA C 47 58.582 58.582 57.791 0.791 18792 3439 1 5 . 1 1 47 47 SER CB C 47 62.537 62.537 64.018 -1.481 18792 3440 1 5 . 1 1 47 47 SER H H 47 8.355 8.355 7.795 0.560 18792 3441 1 5 . 1 1 48 48 GLU N N 48 122.429 122.429 122.137 0.292 18792 3442 1 5 . 1 1 48 48 GLU C C 48 178.099 178.099 177.321 0.778 18792 3443 1 5 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.192 -0.574 18792 3444 1 5 . 1 1 48 48 GLU CB C 48 28.475 28.475 28.793 -0.318 18792 3445 1 5 . 1 1 48 48 GLU H H 48 8.139 8.139 8.472 -0.333 18792 3446 1 5 . 1 1 49 49 ALA N N 49 120.374 120.374 122.494 -2.120 18792 3447 1 5 . 1 1 49 49 ALA C C 49 180.843 180.843 179.147 1.696 18792 3448 1 5 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.449 0.034 18792 3449 1 5 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.236 -0.801 18792 3450 1 5 . 1 1 49 49 ALA H H 49 8.079 8.079 8.055 0.024 18792 3451 1 5 . 1 1 50 50 VAL N N 50 118.599 118.599 118.912 -0.313 18792 3452 1 5 . 1 1 50 50 VAL C C 50 176.921 176.921 177.355 -0.434 18792 3453 1 5 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.112 0.448 18792 3454 1 5 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.690 -1.393 18792 3455 1 5 . 1 1 50 50 VAL H H 50 7.419 7.419 8.031 -0.612 18792 3456 1 5 . 1 1 51 51 LYS N N 51 117.469 117.469 120.329 -2.860 18792 3457 1 5 . 1 1 51 51 LYS C C 51 179.061 179.061 178.975 0.086 18792 3458 1 5 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.689 -0.466 18792 3459 1 5 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.890 -0.894 18792 3460 1 5 . 1 1 51 51 LYS H H 51 7.359 7.359 7.571 -0.212 18792 3461 1 5 . 1 1 52 52 GLN N N 52 115.930 115.930 118.313 -2.383 18792 3462 1 5 . 1 1 52 52 GLN C C 52 177.713 177.713 178.129 -0.416 18792 3463 1 5 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.752 -0.276 18792 3464 1 5 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.191 -1.623 18792 3465 1 5 . 1 1 52 52 GLN H H 52 8.025 8.025 7.892 0.133 18792 3466 1 5 . 1 1 53 53 ALA N N 53 119.782 119.782 122.122 -2.340 18792 3467 1 5 . 1 1 53 53 ALA C C 53 180.008 180.008 179.348 0.660 18792 3468 1 5 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.884 -0.499 18792 3469 1 5 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.501 -0.986 18792 3470 1 5 . 1 1 53 53 ALA H H 53 7.655 7.655 7.837 -0.182 18792 3471 1 5 . 1 1 54 54 LEU N N 54 120.443 120.443 119.471 0.972 18792 3472 1 5 . 1 1 54 54 LEU C C 54 179.330 179.330 178.646 0.684 18792 3473 1 5 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.202 0.812 18792 3474 1 5 . 1 1 54 54 LEU CB C 54 40.862 40.862 42.261 -1.399 18792 3475 1 5 . 1 1 54 54 LEU H H 54 8.419 8.419 8.192 0.227 18792 3476 1 5 . 1 1 55 55 ARG N N 55 118.423 118.423 120.597 -2.174 18792 3477 1 5 . 1 1 55 55 ARG C C 55 178.767 178.767 178.409 0.358 18792 3478 1 5 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.483 0.914 18792 3479 1 5 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.796 -1.053 18792 3480 1 5 . 1 1 55 55 ARG H H 55 8.062 8.062 8.182 -0.120 18792 3481 1 5 . 1 1 56 56 GLU N N 56 115.988 115.988 118.776 -2.788 18792 3482 1 5 . 1 1 56 56 GLU C C 56 180.090 180.090 178.242 1.848 18792 3483 1 5 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.518 -0.758 18792 3484 1 5 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.850 -1.496 18792 3485 1 5 . 1 1 56 56 GLU H H 56 7.772 7.772 8.538 -0.766 18792 3486 1 5 . 1 1 57 57 ALA N N 57 122.837 122.837 120.881 1.956 18792 3487 1 5 . 1 1 57 57 ALA C C 57 181.861 181.861 180.096 1.765 18792 3488 1 5 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.749 -0.115 18792 3489 1 5 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.360 0.112 18792 3490 1 5 . 1 1 57 57 ALA H H 57 8.774 8.774 7.668 1.106 18792 3491 1 5 . 1 1 58 58 GLY N N 58 108.409 108.409 106.654 1.755 18792 3492 1 5 . 1 1 58 58 GLY C C 58 175.331 175.331 175.986 -0.655 18792 3493 1 5 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.831 -0.163 18792 3494 1 5 . 1 1 58 58 GLY H H 58 9.073 9.073 8.469 0.604 18792 3495 1 5 . 1 1 59 59 ASP N N 59 122.074 122.074 122.150 -0.076 18792 3496 1 5 . 1 1 59 59 ASP C C 59 179.023 179.023 178.414 0.609 18792 3497 1 5 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.581 -0.280 18792 3498 1 5 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.218 -2.377 18792 3499 1 5 . 1 1 59 59 ASP H H 59 8.049 8.049 8.273 -0.224 18792 3500 1 5 . 1 1 60 60 GLU N N 60 120.131 120.131 119.661 0.470 18792 3501 1 5 . 1 1 60 60 GLU C C 60 178.522 178.522 179.076 -0.554 18792 3502 1 5 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.394 -0.385 18792 3503 1 5 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.728 -1.529 18792 3504 1 5 . 1 1 60 60 GLU H H 60 8.136 8.136 8.324 -0.188 18792 3505 1 5 . 1 1 61 61 PHE N N 61 121.309 121.309 120.653 0.656 18792 3506 1 5 . 1 1 61 61 PHE C C 61 176.904 176.904 177.749 -0.845 18792 3507 1 5 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.379 -0.057 18792 3508 1 5 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.616 -1.007 18792 3509 1 5 . 1 1 61 61 PHE H H 61 8.523 8.523 8.240 0.283 18792 3510 1 5 . 1 1 62 62 GLU N N 62 115.971 115.971 120.480 -4.509 18792 3511 1 5 . 1 1 62 62 GLU C C 62 177.713 177.713 178.289 -0.576 18792 3512 1 5 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.633 -1.442 18792 3513 1 5 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.997 -1.720 18792 3514 1 5 . 1 1 62 62 GLU H H 62 7.969 7.969 8.270 -0.301 18792 3515 1 5 . 1 1 63 63 LEU N N 63 116.703 116.703 119.054 -2.351 18792 3516 1 5 . 1 1 63 63 LEU C C 63 178.963 178.963 178.682 0.281 18792 3517 1 5 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.830 -0.418 18792 3518 1 5 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.138 -0.732 18792 3519 1 5 . 1 1 63 63 LEU H H 63 7.347 7.347 8.220 -0.873 18792 3520 1 5 . 1 1 64 64 ARG N N 64 117.453 117.453 118.511 -1.058 18792 3521 1 5 . 1 1 64 64 ARG C C 64 177.297 177.297 177.422 -0.125 18792 3522 1 5 . 1 1 64 64 ARG CA C 64 57.337 57.337 57.661 -0.324 18792 3523 1 5 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.078 -1.481 18792 3524 1 5 . 1 1 64 64 ARG H H 64 7.995 7.995 8.215 -0.220 18792 3525 1 5 . 1 1 65 65 TYR N N 65 118.956 118.956 120.297 -1.341 18792 3526 1 5 . 1 1 65 65 TYR C C 65 175.278 175.278 174.786 0.492 18792 3527 1 5 . 1 1 65 65 TYR CA C 65 55.701 55.701 55.650 0.051 18792 3528 1 5 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.757 -3.771 18792 3529 1 5 . 1 1 65 65 TYR H H 65 7.909 7.909 8.204 -0.295 18792 3530 1 5 . 1 1 66 66 ARG N N 66 119.438 119.438 120.997 -1.559 18792 3531 1 5 . 1 1 66 66 ARG C C 66 178.424 178.424 177.960 0.464 18792 3532 1 5 . 1 1 66 66 ARG CA C 66 58.476 58.476 59.767 -1.291 18792 3533 1 5 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.088 -1.267 18792 3534 1 5 . 1 1 66 66 ARG H H 66 7.244 7.244 8.015 -0.771 18792 3535 1 5 . 1 1 67 67 ARG N N 67 118.936 118.936 120.503 -1.567 18792 3536 1 5 . 1 1 67 67 ARG C C 67 177.542 177.542 178.026 -0.484 18792 3537 1 5 . 1 1 67 67 ARG CA C 67 57.444 57.444 58.849 -1.405 18792 3538 1 5 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.185 -1.064 18792 3539 1 5 . 1 1 67 67 ARG H H 67 8.417 8.417 8.478 -0.061 18792 3540 1 5 . 1 1 68 68 ALA N N 68 121.797 121.797 121.390 0.407 18792 3541 1 5 . 1 1 68 68 ALA C C 68 180.337 180.337 179.811 0.526 18792 3542 1 5 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.219 -0.083 18792 3543 1 5 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.700 -0.233 18792 3544 1 5 . 1 1 68 68 ALA H H 68 7.827 7.827 7.501 0.326 18792 3545 1 5 . 1 1 69 69 PHE N N 69 115.986 115.986 119.894 -3.908 18792 3546 1 5 . 1 1 69 69 PHE C C 69 177.468 177.468 177.083 0.385 18792 3547 1 5 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.335 -1.286 18792 3548 1 5 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.887 -1.288 18792 3549 1 5 . 1 1 69 69 PHE H H 69 8.517 8.517 8.327 0.190 18792 3550 1 5 . 1 1 70 70 SER N N 70 116.526 116.526 114.996 1.530 18792 3551 1 5 . 1 1 70 70 SER C C 70 177.640 177.640 176.461 1.179 18792 3552 1 5 . 1 1 70 70 SER CA C 70 61.073 61.073 61.124 -0.051 18792 3553 1 5 . 1 1 70 70 SER CB C 70 61.993 61.993 62.665 -0.672 18792 3554 1 5 . 1 1 70 70 SER H H 70 8.152 8.152 8.053 0.099 18792 3555 1 5 . 1 1 71 71 ASP N N 71 121.181 121.181 122.129 -0.948 18792 3556 1 5 . 1 1 71 71 ASP C C 71 178.546 178.546 178.156 0.390 18792 3557 1 5 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.160 -0.712 18792 3558 1 5 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.869 -1.638 18792 3559 1 5 . 1 1 71 71 ASP H H 71 8.356 8.356 7.707 0.649 18792 3560 1 5 . 1 1 72 72 LEU N N 72 120.747 120.747 120.487 0.260 18792 3561 1 5 . 1 1 72 72 LEU C C 72 178.963 178.963 178.334 0.629 18792 3562 1 5 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.510 -1.065 18792 3563 1 5 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.170 -1.153 18792 3564 1 5 . 1 1 72 72 LEU H H 72 7.738 7.738 7.577 0.161 18792 3565 1 5 . 1 1 73 73 THR N N 73 109.432 109.432 114.755 -5.323 18792 3566 1 5 . 1 1 73 73 THR C C 73 177.481 177.481 176.937 0.544 18792 3567 1 5 . 1 1 73 73 THR CA C 73 65.128 65.128 67.035 -1.907 18792 3568 1 5 . 1 1 73 73 THR CB C 73 67.720 67.720 68.445 -0.725 18792 3569 1 5 . 1 1 73 73 THR H H 73 8.296 8.296 7.584 0.712 18792 3570 1 5 . 1 1 74 74 SER N N 74 115.862 115.862 116.129 -0.267 18792 3571 1 5 . 1 1 74 74 SER C C 74 175.361 175.361 175.887 -0.526 18792 3572 1 5 . 1 1 74 74 SER CA C 74 60.112 60.112 60.783 -0.672 18792 3573 1 5 . 1 1 74 74 SER CB C 74 62.537 62.537 63.014 -0.477 18792 3574 1 5 . 1 1 74 74 SER H H 74 7.629 7.629 8.486 -0.857 18792 3575 1 5 . 1 1 75 75 GLN N N 75 118.551 118.551 119.908 -1.357 18792 3576 1 5 . 1 1 75 75 GLN C C 75 176.316 176.316 177.166 -0.850 18792 3577 1 5 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.033 -0.229 18792 3578 1 5 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.437 -1.160 18792 3579 1 5 . 1 1 75 75 GLN H H 75 7.640 7.640 7.801 -0.161 18792 3580 1 5 . 1 1 76 76 LEU N N 76 118.313 118.313 120.621 -2.308 18792 3581 1 5 . 1 1 76 76 LEU C C 76 174.160 174.160 177.099 -2.939 18792 3582 1 5 . 1 1 76 76 LEU CA C 76 54.740 54.740 56.051 -1.311 18792 3583 1 5 . 1 1 76 76 LEU CB C 76 42.727 42.727 43.112 -0.385 18792 3584 1 5 . 1 1 76 76 LEU H H 76 7.411 7.411 7.755 -0.344 18792 3585 1 5 . 1 1 77 77 HIS N N 77 120.104 120.104 117.792 2.312 18792 3586 1 5 . 1 1 77 77 HIS C C 77 174.528 174.528 174.158 0.370 18792 3587 1 5 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.834 -1.627 18792 3588 1 5 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.108 -0.142 18792 3589 1 5 . 1 1 77 77 HIS H H 77 8.117 8.117 7.664 0.453 18792 3590 1 5 . 1 1 78 78 ILE N N 78 122.298 122.298 123.127 -0.829 18792 3591 1 5 . 1 1 78 78 ILE C C 78 174.240 174.240 174.435 -0.195 18792 3592 1 5 . 1 1 78 78 ILE CA C 78 61.402 61.402 63.070 -1.668 18792 3593 1 5 . 1 1 78 78 ILE CB C 78 37.591 37.591 37.944 -0.353 18792 3594 1 5 . 1 1 78 78 ILE H H 78 8.655 8.655 8.347 0.308 18792 3595 1 5 . 1 1 79 79 THR N N 79 116.442 116.442 121.623 -5.181 18792 3596 1 5 . 1 1 79 79 THR C C 79 174.291 174.291 173.088 1.203 18792 3597 1 5 . 1 1 79 79 THR CA C 79 61.632 61.632 62.777 -1.145 18792 3598 1 5 . 1 1 79 79 THR CB C 79 68.704 68.704 68.308 0.396 18792 3599 1 5 . 1 1 79 79 THR H H 79 8.245 8.245 8.509 -0.264 18792 3600 1 5 . 1 1 84 84 TYR N N 84 120.888 120.888 120.065 0.823 18792 3601 1 5 . 1 1 84 84 TYR C C 84 176.708 176.708 177.655 -0.947 18792 3602 1 5 . 1 1 84 84 TYR CA C 84 60.432 60.432 60.981 -0.549 18792 3603 1 5 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.767 -1.022 18792 3604 1 5 . 1 1 84 84 TYR H H 84 8.733 8.733 8.580 0.153 18792 3605 1 5 . 1 1 85 85 GLN N N 85 114.530 114.530 119.379 -4.849 18792 3606 1 5 . 1 1 85 85 GLN C C 85 178.473 178.473 177.961 0.512 18792 3607 1 5 . 1 1 85 85 GLN CA C 85 59.294 59.294 58.999 0.295 18792 3608 1 5 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.956 -1.155 18792 3609 1 5 . 1 1 85 85 GLN H H 85 8.413 8.413 7.734 0.679 18792 3610 1 5 . 1 1 86 86 SER N N 86 114.032 114.032 116.601 -2.569 18792 3611 1 5 . 1 1 86 86 SER C C 86 178.473 178.473 176.666 1.807 18792 3612 1 5 . 1 1 86 86 SER CA C 86 62.175 62.175 61.608 0.567 18792 3613 1 5 . 1 1 86 86 SER CB C 86 63.252 63.252 62.427 0.825 18792 3614 1 5 . 1 1 86 86 SER H H 86 7.258 7.258 7.499 -0.241 18792 3615 1 5 . 1 1 88 88 GLU N N 88 119.386 119.386 119.980 -0.594 18792 3616 1 5 . 1 1 88 88 GLU C C 88 177.199 177.199 178.620 -1.421 18792 3617 1 5 . 1 1 88 88 GLU CA C 88 58.582 58.582 60.110 -1.528 18792 3618 1 5 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.387 -0.411 18792 3619 1 5 . 1 1 88 88 GLU H H 88 8.534 8.534 8.612 -0.078 18792 3620 1 5 . 1 1 89 89 GLN N N 89 114.678 114.678 118.719 -4.041 18792 3621 1 5 . 1 1 89 89 GLN C C 89 178.669 178.669 178.776 -0.107 18792 3622 1 5 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.037 -0.455 18792 3623 1 5 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.535 -1.113 18792 3624 1 5 . 1 1 89 89 GLN H H 89 7.500 7.500 7.814 -0.314 18792 3625 1 5 . 1 1 90 90 VAL N N 90 118.174 118.174 119.383 -1.209 18792 3626 1 5 . 1 1 90 90 VAL C C 90 178.081 178.081 178.020 0.061 18792 3627 1 5 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.900 -0.344 18792 3628 1 5 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.736 -0.129 18792 3629 1 5 . 1 1 90 90 VAL H H 90 7.017 7.017 7.627 -0.610 18792 3630 1 5 . 1 1 91 91 VAL N N 91 119.489 119.489 122.023 -2.534 18792 3631 1 5 . 1 1 91 91 VAL C C 91 177.914 177.914 178.630 -0.716 18792 3632 1 5 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.795 -1.026 18792 3633 1 5 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.010 -0.719 18792 3634 1 5 . 1 1 91 91 VAL H H 91 7.833 7.833 8.919 -1.086 18792 3635 1 5 . 1 1 92 92 ASN N N 92 117.180 117.180 118.218 -1.038 18792 3636 1 5 . 1 1 92 92 ASN C C 92 179.110 179.110 178.153 0.957 18792 3637 1 5 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.091 -1.173 18792 3638 1 5 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.233 -2.265 18792 3639 1 5 . 1 1 92 92 ASN H H 92 8.368 8.368 8.622 -0.254 18792 3640 1 5 . 1 1 93 93 GLU N N 93 118.476 118.476 120.172 -1.696 18792 3641 1 5 . 1 1 93 93 GLU C C 93 179.355 179.355 179.253 0.102 18792 3642 1 5 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.320 -0.915 18792 3643 1 5 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.019 -2.286 18792 3644 1 5 . 1 1 93 93 GLU H H 93 7.213 7.213 8.008 -0.795 18792 3645 1 5 . 1 1 94 94 LEU N N 94 120.889 120.889 120.530 0.359 18792 3646 1 5 . 1 1 94 94 LEU C C 94 178.473 178.473 179.172 -0.699 18792 3647 1 5 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.181 -0.164 18792 3648 1 5 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.442 -1.512 18792 3649 1 5 . 1 1 94 94 LEU H H 94 7.446 7.446 8.413 -0.967 18792 3650 1 5 . 1 1 95 95 PHE N N 95 112.902 112.902 120.390 -7.488 18792 3651 1 5 . 1 1 95 95 PHE C C 95 176.586 176.586 176.937 -0.351 18792 3652 1 5 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.942 -2.783 18792 3653 1 5 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.140 -0.919 18792 3654 1 5 . 1 1 95 95 PHE H H 95 6.916 6.916 8.067 -1.151 18792 3655 1 5 . 1 1 96 96 ARG N N 96 123.729 123.729 119.214 4.515 18792 3656 1 5 . 1 1 96 96 ARG C C 96 177.272 177.272 177.880 -0.608 18792 3657 1 5 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.271 0.952 18792 3658 1 5 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.698 -2.266 18792 3659 1 5 . 1 1 96 96 ARG H H 96 7.126 7.126 7.916 -0.790 18792 3660 1 5 . 1 1 97 97 ASP N N 97 116.576 116.576 116.049 0.527 18792 3661 1 5 . 1 1 97 97 ASP C C 97 175.687 175.687 176.643 -0.956 18792 3662 1 5 . 1 1 97 97 ASP CA C 97 53.673 53.673 55.581 -1.908 18792 3663 1 5 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.080 -2.035 18792 3664 1 5 . 1 1 97 97 ASP H H 97 8.644 8.644 7.927 0.717 18792 3665 1 5 . 1 1 98 98 GLY N N 98 108.551 108.551 105.989 2.562 18792 3666 1 5 . 1 1 98 98 GLY C C 98 172.690 172.690 172.339 0.351 18792 3667 1 5 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.424 -2.174 18792 3668 1 5 . 1 1 98 98 GLY H H 98 7.463 7.463 7.683 -0.220 18792 3669 1 5 . 1 1 99 99 VAL N N 99 120.630 120.630 117.052 3.578 18792 3670 1 5 . 1 1 99 99 VAL C C 99 174.503 174.503 174.208 0.295 18792 3671 1 5 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.266 -0.948 18792 3672 1 5 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.827 -2.064 18792 3673 1 5 . 1 1 99 99 VAL H H 99 8.184 8.184 7.821 0.363 18792 3674 1 5 . 1 1 100 100 ASN N N 100 115.485 115.485 118.028 -2.543 18792 3675 1 5 . 1 1 100 100 ASN C C 100 175.239 175.239 175.933 -0.694 18792 3676 1 5 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.273 -2.912 18792 3677 1 5 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.850 0.070 18792 3678 1 5 . 1 1 100 100 ASN H H 100 6.241 6.241 7.470 -1.229 18792 3679 1 5 . 1 1 101 101 TRP N N 101 118.266 118.266 119.925 -1.659 18792 3680 1 5 . 1 1 101 101 TRP C C 101 178.301 178.301 176.368 1.933 18792 3681 1 5 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.357 1.182 18792 3682 1 5 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.444 1.386 18792 3683 1 5 . 1 1 101 101 TRP H H 101 8.409 8.409 7.909 0.500 18792 3684 1 5 . 1 1 102 102 GLY N N 102 106.147 106.147 106.947 -0.800 18792 3685 1 5 . 1 1 102 102 GLY C C 102 177.640 177.640 175.568 2.072 18792 3686 1 5 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.630 2.284 18792 3687 1 5 . 1 1 102 102 GLY H H 102 8.504 8.504 7.938 0.566 18792 3688 1 5 . 1 1 103 103 ARG N N 103 121.347 121.347 121.388 -0.041 18792 3689 1 5 . 1 1 103 103 ARG C C 103 177.738 177.738 177.984 -0.246 18792 3690 1 5 . 1 1 103 103 ARG CA C 103 57.942 57.942 59.106 -1.164 18792 3691 1 5 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.154 0.065 18792 3692 1 5 . 1 1 103 103 ARG H H 103 8.099 8.099 8.027 0.072 18792 3693 1 5 . 1 1 104 104 ILE N N 104 120.930 120.930 119.653 1.277 18792 3694 1 5 . 1 1 104 104 ILE C C 104 178.197 178.197 177.634 0.563 18792 3695 1 5 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.688 1.847 18792 3696 1 5 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.962 -1.917 18792 3697 1 5 . 1 1 104 104 ILE H H 104 7.690 7.690 8.074 -0.384 18792 3698 1 5 . 1 1 105 105 VAL N N 105 120.938 120.938 119.923 1.015 18792 3699 1 5 . 1 1 105 105 VAL C C 105 177.854 177.854 177.195 0.659 18792 3700 1 5 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.454 1.004 18792 3701 1 5 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.475 -0.101 18792 3702 1 5 . 1 1 105 105 VAL H H 105 8.245 8.245 7.430 0.815 18792 3703 1 5 . 1 1 106 106 ALA N N 106 121.165 121.165 122.119 -0.954 18792 3704 1 5 . 1 1 106 106 ALA C C 106 178.284 178.284 179.386 -1.102 18792 3705 1 5 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.836 -0.238 18792 3706 1 5 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.248 -0.733 18792 3707 1 5 . 1 1 106 106 ALA H H 106 7.529 7.529 7.875 -0.346 18792 3708 1 5 . 1 1 107 107 PHE N N 107 119.242 119.242 120.652 -1.410 18792 3709 1 5 . 1 1 107 107 PHE C C 107 176.390 176.390 177.248 -0.858 18792 3710 1 5 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.600 -0.427 18792 3711 1 5 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.016 -1.929 18792 3712 1 5 . 1 1 107 107 PHE H H 107 7.974 7.974 7.520 0.454 18792 3713 1 5 . 1 1 108 108 PHE N N 108 120.009 120.009 117.384 2.625 18792 3714 1 5 . 1 1 108 108 PHE C C 108 177.640 177.640 177.320 0.320 18792 3715 1 5 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.087 2.337 18792 3716 1 5 . 1 1 108 108 PHE CB C 108 35.346 35.346 37.844 -2.498 18792 3717 1 5 . 1 1 108 108 PHE H H 108 7.946 7.946 8.223 -0.277 18792 3718 1 5 . 1 1 109 109 SER N N 109 114.631 114.631 117.013 -2.382 18792 3719 1 5 . 1 1 109 109 SER C C 109 177.770 177.770 176.098 1.672 18792 3720 1 5 . 1 1 109 109 SER CA C 109 63.349 63.349 62.303 1.046 18792 3721 1 5 . 1 1 109 109 SER H H 109 8.424 8.424 6.716 1.708 18792 3722 1 5 . 1 1 110 110 PHE N N 110 124.230 124.230 123.582 0.648 18792 3723 1 5 . 1 1 110 110 PHE C C 110 176.708 176.708 177.689 -0.981 18792 3724 1 5 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.459 0.155 18792 3725 1 5 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.972 -1.528 18792 3726 1 5 . 1 1 110 110 PHE H H 110 9.052 9.052 8.491 0.561 18792 3727 1 5 . 1 1 111 111 GLY N N 111 105.893 105.893 106.689 -0.796 18792 3728 1 5 . 1 1 111 111 GLY C C 111 176.795 176.795 176.055 0.740 18792 3729 1 5 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.563 0.813 18792 3730 1 5 . 1 1 111 111 GLY H H 111 7.926 7.926 8.297 -0.371 18792 3731 1 5 . 1 1 112 112 GLY N N 112 107.410 107.410 109.273 -1.863 18792 3732 1 5 . 1 1 112 112 GLY C C 112 174.650 174.650 175.520 -0.870 18792 3733 1 5 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.080 1.225 18792 3734 1 5 . 1 1 112 112 GLY H H 112 8.799 8.799 8.367 0.432 18792 3735 1 5 . 1 1 113 113 ALA N N 113 124.313 124.313 125.293 -0.980 18792 3736 1 5 . 1 1 113 113 ALA C C 113 181.300 181.300 179.332 1.968 18792 3737 1 5 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.985 -0.458 18792 3738 1 5 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.578 -1.095 18792 3739 1 5 . 1 1 113 113 ALA H H 113 8.212 8.212 8.231 -0.019 18792 3740 1 5 . 1 1 114 114 LEU N N 114 118.878 118.878 118.477 0.401 18792 3741 1 5 . 1 1 114 114 LEU C C 114 180.286 180.286 178.223 2.063 18792 3742 1 5 . 1 1 114 114 LEU CA C 114 56.982 56.982 56.992 -0.010 18792 3743 1 5 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.402 -0.385 18792 3744 1 5 . 1 1 114 114 LEU H H 114 8.161 8.161 7.870 0.291 18792 3745 1 5 . 1 1 115 115 CYS N N 115 119.002 119.002 118.313 0.689 18792 3746 1 5 . 1 1 115 115 CYS C C 115 176.087 176.087 176.312 -0.225 18792 3747 1 5 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.521 0.423 18792 3748 1 5 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.264 -1.629 18792 3749 1 5 . 1 1 115 115 CYS H H 115 8.070 8.070 7.852 0.218 18792 3750 1 5 . 1 1 116 116 VAL N N 116 118.737 118.737 118.862 -0.125 18792 3751 1 5 . 1 1 116 116 VAL C C 116 177.494 177.494 178.225 -0.731 18792 3752 1 5 . 1 1 116 116 VAL CA C 116 66.762 66.762 65.965 0.797 18792 3753 1 5 . 1 1 116 116 VAL CB C 116 30.763 30.763 30.819 -0.056 18792 3754 1 5 . 1 1 116 116 VAL H H 116 7.995 7.995 7.684 0.311 18792 3755 1 5 . 1 1 117 117 GLU N N 117 118.886 118.886 120.939 -2.053 18792 3756 1 5 . 1 1 117 117 GLU C C 117 178.424 178.424 178.633 -0.209 18792 3757 1 5 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.751 -0.991 18792 3758 1 5 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.404 -1.350 18792 3759 1 5 . 1 1 117 117 GLU H H 117 8.059 8.059 7.891 0.168 18792 3760 1 5 . 1 1 118 118 SER N N 118 113.417 113.417 116.204 -2.787 18792 3761 1 5 . 1 1 118 118 SER C C 118 175.607 175.607 176.405 -0.798 18792 3762 1 5 . 1 1 118 118 SER CA C 118 62.638 62.638 62.193 0.445 18792 3763 1 5 . 1 1 118 118 SER CB C 118 61.061 61.061 63.280 -2.219 18792 3764 1 5 . 1 1 118 118 SER H H 118 7.626 7.626 8.047 -0.421 18792 3765 1 5 . 1 1 119 119 VAL N N 119 120.612 120.612 122.119 -1.507 18792 3766 1 5 . 1 1 119 119 VAL C C 119 179.713 179.713 177.198 2.515 18792 3767 1 5 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.896 0.329 18792 3768 1 5 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.699 -1.620 18792 3769 1 5 . 1 1 119 119 VAL H H 119 7.297 7.297 7.987 -0.690 18792 3770 1 5 . 1 1 120 120 ASP N N 120 122.546 122.546 119.129 3.417 18792 3771 1 5 . 1 1 120 120 ASP C C 120 178.057 178.057 177.259 0.798 18792 3772 1 5 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.367 0.622 18792 3773 1 5 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.646 -0.723 18792 3774 1 5 . 1 1 120 120 ASP H H 120 8.264 8.264 7.792 0.472 18792 3775 1 5 . 1 1 121 121 LYS N N 121 115.636 115.636 118.197 -2.561 18792 3776 1 5 . 1 1 121 121 LYS C C 121 175.159 175.159 175.584 -0.425 18792 3777 1 5 . 1 1 121 121 LYS CA C 121 55.260 55.260 55.719 -0.459 18792 3778 1 5 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.956 -2.181 18792 3779 1 5 . 1 1 121 121 LYS H H 121 7.558 7.558 7.336 0.222 18792 3780 1 5 . 1 1 122 122 GLU N N 122 113.915 113.915 118.109 -4.194 18792 3781 1 5 . 1 1 122 122 GLU C C 122 176.109 176.109 175.552 0.557 18792 3782 1 5 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.721 -0.414 18792 3783 1 5 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.979 -2.647 18792 3784 1 5 . 1 1 122 122 GLU H H 122 7.826 7.826 7.938 -0.112 18792 3785 1 5 . 1 1 124 124 GLN N N 124 119.233 119.233 121.239 -2.006 18792 3786 1 5 . 1 1 124 124 GLN C C 124 177.640 177.640 176.476 1.164 18792 3787 1 5 . 1 1 124 124 GLN CA C 124 59.472 59.472 59.381 0.091 18792 3788 1 5 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.345 -1.855 18792 3789 1 5 . 1 1 124 124 GLN H H 124 8.626 8.626 8.503 0.123 18792 3790 1 5 . 1 1 125 125 VAL N N 125 117.011 117.011 116.892 0.119 18792 3791 1 5 . 1 1 125 125 VAL C C 125 175.826 175.826 176.460 -0.634 18792 3792 1 5 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.822 -0.686 18792 3793 1 5 . 1 1 125 125 VAL CB C 125 30.297 30.297 30.636 -0.339 18792 3794 1 5 . 1 1 125 125 VAL H H 125 7.870 7.870 7.986 -0.116 18792 3795 1 5 . 1 1 126 126 LEU N N 126 117.058 117.058 118.375 -1.317 18792 3796 1 5 . 1 1 126 126 LEU C C 126 178.096 178.096 178.147 -0.051 18792 3797 1 5 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.059 -1.974 18792 3798 1 5 . 1 1 126 126 LEU CB C 126 40.273 40.273 43.052 -2.779 18792 3799 1 5 . 1 1 126 126 LEU H H 126 7.747 7.747 7.940 -0.193 18792 3800 1 5 . 1 1 127 127 VAL N N 127 119.457 119.457 117.808 1.649 18792 3801 1 5 . 1 1 127 127 VAL C C 127 177.150 177.150 177.344 -0.194 18792 3802 1 5 . 1 1 127 127 VAL CA C 127 67.156 67.156 65.967 1.189 18792 3803 1 5 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.715 -0.962 18792 3804 1 5 . 1 1 127 127 VAL H H 127 7.306 7.306 7.694 -0.388 18792 3805 1 5 . 1 1 128 128 SER N N 128 110.647 110.647 117.629 -6.982 18792 3806 1 5 . 1 1 128 128 SER C C 128 177.222 177.222 176.685 0.537 18792 3807 1 5 . 1 1 128 128 SER CA C 128 60.752 60.752 62.409 -1.657 18792 3808 1 5 . 1 1 128 128 SER CB C 128 61.605 61.605 62.877 -1.272 18792 3809 1 5 . 1 1 128 128 SER H H 128 8.237 8.237 7.998 0.239 18792 3810 1 5 . 1 1 129 129 ARG N N 129 123.100 123.100 122.701 0.399 18792 3811 1 5 . 1 1 129 129 ARG C C 129 175.802 175.802 178.581 -2.779 18792 3812 1 5 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.079 -0.852 18792 3813 1 5 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.085 -1.886 18792 3814 1 5 . 1 1 129 129 ARG H H 129 6.564 6.564 7.930 -1.366 18792 3815 1 5 . 1 1 130 130 ILE N N 130 118.182 118.182 118.021 0.161 18792 3816 1 5 . 1 1 130 130 ILE C C 130 178.156 178.156 177.754 0.402 18792 3817 1 5 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.148 -0.802 18792 3818 1 5 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.520 -0.838 18792 3819 1 5 . 1 1 130 130 ILE H H 130 7.955 7.955 7.960 -0.005 18792 3820 1 5 . 1 1 131 131 ALA N N 131 119.029 119.029 122.810 -3.781 18792 3821 1 5 . 1 1 131 131 ALA C C 131 179.593 179.593 179.101 0.492 18792 3822 1 5 . 1 1 131 131 ALA CA C 131 54.598 54.598 54.972 -0.374 18792 3823 1 5 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.305 -0.916 18792 3824 1 5 . 1 1 131 131 ALA H H 131 7.582 7.582 8.116 -0.534 18792 3825 1 5 . 1 1 132 132 ALA N N 132 120.336 120.336 122.089 -1.753 18792 3826 1 5 . 1 1 132 132 ALA C C 132 181.095 181.095 179.722 1.373 18792 3827 1 5 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.961 -0.363 18792 3828 1 5 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.445 -1.744 18792 3829 1 5 . 1 1 132 132 ALA H H 132 7.224 7.224 7.897 -0.673 18792 3830 1 5 . 1 1 133 133 TRP N N 133 121.194 121.194 120.469 0.725 18792 3831 1 5 . 1 1 133 133 TRP C C 133 179.698 179.698 177.883 1.815 18792 3832 1 5 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.160 -2.857 18792 3833 1 5 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.944 -2.289 18792 3834 1 5 . 1 1 133 133 TRP H H 133 8.925 8.925 8.822 0.103 18792 3835 1 5 . 1 1 134 134 MET N N 134 116.987 116.987 118.980 -1.993 18792 3836 1 5 . 1 1 134 134 MET C C 134 178.277 178.277 177.980 0.297 18792 3837 1 5 . 1 1 134 134 MET CA C 134 59.578 59.578 58.831 0.747 18792 3838 1 5 . 1 1 134 134 MET CB C 134 33.559 33.559 32.277 1.282 18792 3839 1 5 . 1 1 134 134 MET H H 134 8.863 8.863 8.202 0.661 18792 3840 1 5 . 1 1 135 135 ALA N N 135 120.523 120.523 120.743 -0.220 18792 3841 1 5 . 1 1 135 135 ALA C C 135 179.298 179.298 179.322 -0.024 18792 3842 1 5 . 1 1 135 135 ALA CA C 135 55.433 55.433 54.885 0.548 18792 3843 1 5 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.455 -1.818 18792 3844 1 5 . 1 1 135 135 ALA H H 135 8.152 8.152 8.412 -0.260 18792 3845 1 5 . 1 1 136 136 THR N N 136 116.715 116.715 117.418 -0.703 18792 3846 1 5 . 1 1 136 136 THR C C 136 175.106 175.106 176.525 -1.419 18792 3847 1 5 . 1 1 136 136 THR CA C 136 66.729 66.729 67.382 -0.654 18792 3848 1 5 . 1 1 136 136 THR CB C 136 68.441 68.441 68.835 -0.394 18792 3849 1 5 . 1 1 136 136 THR H H 136 8.532 8.532 8.124 0.408 18792 3850 1 5 . 1 1 137 137 TYR N N 137 123.204 123.204 120.869 2.335 18792 3851 1 5 . 1 1 137 137 TYR C C 137 179.592 179.592 177.793 1.799 18792 3852 1 5 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.624 1.441 18792 3853 1 5 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.976 0.012 18792 3854 1 5 . 1 1 137 137 TYR H H 137 8.809 8.809 7.707 1.102 18792 3855 1 5 . 1 1 138 138 LEU N N 138 119.247 119.247 121.347 -2.100 18792 3856 1 5 . 1 1 138 138 LEU C C 138 178.385 178.385 177.527 0.858 18792 3857 1 5 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.397 0.541 18792 3858 1 5 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.215 -0.506 18792 3859 1 5 . 1 1 138 138 LEU H H 138 8.742 8.742 8.082 0.660 18792 3860 1 5 . 1 1 139 139 ASN N N 139 117.122 117.122 115.108 2.014 18792 3861 1 5 . 1 1 139 139 ASN C C 139 176.417 176.417 177.216 -0.799 18792 3862 1 5 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.456 0.992 18792 3863 1 5 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.050 0.602 18792 3864 1 5 . 1 1 139 139 ASN H H 139 8.307 8.307 7.915 0.392 18792 3865 1 5 . 1 1 140 140 ASP N N 140 115.394 115.394 119.700 -4.306 18792 3866 1 5 . 1 1 140 140 ASP C C 140 177.919 177.919 176.950 0.969 18792 3867 1 5 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.630 -0.677 18792 3868 1 5 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.972 -1.586 18792 3869 1 5 . 1 1 140 140 ASP H H 140 8.439 8.439 7.769 0.670 18792 3870 1 5 . 1 1 141 141 HIS N N 141 111.695 111.695 110.645 1.050 18792 3871 1 5 . 1 1 141 141 HIS C C 141 175.949 175.949 176.003 -0.054 18792 3872 1 5 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.204 -0.147 18792 3873 1 5 . 1 1 141 141 HIS CB C 141 29.908 29.908 31.080 -1.172 18792 3874 1 5 . 1 1 141 141 HIS H H 141 8.043 8.043 6.957 1.086 18792 3875 1 5 . 1 1 142 142 LEU N N 142 117.054 117.054 122.488 -5.434 18792 3876 1 5 . 1 1 142 142 LEU C C 142 176.530 176.530 178.037 -1.507 18792 3877 1 5 . 1 1 142 142 LEU CA C 142 55.309 55.309 56.966 -1.657 18792 3878 1 5 . 1 1 142 142 LEU CB C 142 42.338 42.338 40.583 1.755 18792 3879 1 5 . 1 1 142 142 LEU H H 142 7.198 7.198 7.778 -0.580 18792 3880 1 5 . 1 1 143 143 GLU N N 143 121.335 121.335 120.501 0.834 18792 3881 1 5 . 1 1 143 143 GLU C C 143 173.964 173.964 175.566 -1.602 18792 3882 1 5 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.605 -0.351 18792 3883 1 5 . 1 1 143 143 GLU CB C 143 26.257 26.257 27.629 -1.372 18792 3884 1 5 . 1 1 143 143 GLU H H 143 8.565 8.565 7.751 0.814 18792 3885 1 5 . 1 1 145 145 TRP N N 145 117.973 117.973 120.228 -2.255 18792 3886 1 5 . 1 1 145 145 TRP C C 145 179.526 179.526 177.633 1.893 18792 3887 1 5 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.446 1.160 18792 3888 1 5 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.551 -1.663 18792 3889 1 5 . 1 1 145 145 TRP H H 145 7.078 7.078 8.181 -1.103 18792 3890 1 5 . 1 1 146 146 ILE N N 146 122.101 122.101 110.861 11.240 18792 3891 1 5 . 1 1 146 146 ILE C C 146 179.110 179.110 177.269 1.841 18792 3892 1 5 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.296 4.038 18792 3893 1 5 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.673 -0.851 18792 3894 1 5 . 1 1 146 146 ILE H H 146 8.389 8.389 7.421 0.968 18792 3895 1 5 . 1 1 147 147 GLN N N 147 116.344 116.344 120.836 -4.492 18792 3896 1 5 . 1 1 147 147 GLN C C 147 179.526 179.526 177.128 2.398 18792 3897 1 5 . 1 1 147 147 GLN CA C 147 58.013 58.013 57.711 0.302 18792 3898 1 5 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.391 -0.668 18792 3899 1 5 . 1 1 147 147 GLN H H 147 8.376 8.376 7.872 0.504 18792 3900 1 5 . 1 1 148 148 GLU N N 148 118.913 118.913 119.728 -0.815 18792 3901 1 5 . 1 1 148 148 GLU C C 148 176.880 176.880 177.815 -0.935 18792 3902 1 5 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.366 -2.993 18792 3903 1 5 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.375 -0.943 18792 3904 1 5 . 1 1 148 148 GLU H H 148 7.504 7.504 7.680 -0.176 18792 3905 1 5 . 1 1 149 149 ASN N N 149 116.616 116.616 116.658 -0.042 18792 3906 1 5 . 1 1 149 149 ASN C C 149 173.964 173.964 177.112 -3.148 18792 3907 1 5 . 1 1 149 149 ASN CA C 149 53.246 53.246 54.343 -1.097 18792 3908 1 5 . 1 1 149 149 ASN CB C 149 37.133 37.133 38.578 -1.445 18792 3909 1 5 . 1 1 149 149 ASN H H 149 7.070 7.070 8.387 -1.317 18792 3910 1 5 . 1 1 150 150 GLY N N 150 104.750 104.750 105.561 -0.811 18792 3911 1 5 . 1 1 150 150 GLY C C 150 176.022 176.022 174.060 1.962 18792 3912 1 5 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.367 -0.125 18792 3913 1 5 . 1 1 150 150 GLY H H 150 7.313 7.313 8.015 -0.702 18792 3914 1 5 . 1 1 151 151 GLY N N 151 108.385 108.385 108.647 -0.262 18792 3915 1 5 . 1 1 151 151 GLY C C 151 173.449 173.449 174.587 -1.138 18792 3916 1 5 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.220 -0.188 18792 3917 1 5 . 1 1 151 151 GLY H H 151 8.452 8.452 7.199 1.253 18792 3918 1 5 . 1 1 152 152 TRP N N 152 118.092 118.092 121.409 -3.317 18792 3919 1 5 . 1 1 152 152 TRP C C 152 178.571 178.571 178.362 0.209 18792 3920 1 5 . 1 1 152 152 TRP CA C 152 60.077 60.077 58.950 1.127 18792 3921 1 5 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.887 -1.299 18792 3922 1 5 . 1 1 152 152 TRP H H 152 8.644 8.644 7.387 1.257 18792 3923 1 5 . 1 1 153 153 ASP N N 153 117.758 117.758 119.479 -1.721 18792 3924 1 5 . 1 1 153 153 ASP C C 153 179.796 179.796 178.704 1.092 18792 3925 1 5 . 1 1 153 153 ASP CA C 153 57.302 57.302 58.664 -1.362 18792 3926 1 5 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.629 -1.398 18792 3927 1 5 . 1 1 153 153 ASP H H 153 8.827 8.827 8.073 0.754 18792 3928 1 5 . 1 1 154 154 THR N N 154 116.817 116.817 116.960 -0.143 18792 3929 1 5 . 1 1 154 154 THR C C 154 175.352 175.352 176.957 -1.605 18792 3930 1 5 . 1 1 154 154 THR CA C 154 65.910 65.910 66.469 -0.559 18792 3931 1 5 . 1 1 154 154 THR CB C 154 67.712 67.712 69.095 -1.383 18792 3932 1 5 . 1 1 154 154 THR H H 154 7.494 7.494 7.643 -0.149 18792 3933 1 5 . 1 1 155 155 PHE N N 155 122.196 122.196 121.983 0.213 18792 3934 1 5 . 1 1 155 155 PHE C C 155 176.831 176.831 177.643 -0.812 18792 3935 1 5 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.979 0.307 18792 3936 1 5 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.437 -1.770 18792 3937 1 5 . 1 1 155 155 PHE H H 155 6.477 6.477 8.480 -2.003 18792 3938 1 5 . 1 1 156 156 VAL N N 156 117.387 117.387 119.095 -1.708 18792 3939 1 5 . 1 1 156 156 VAL C C 156 178.497 178.497 178.120 0.377 18792 3940 1 5 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.648 -0.417 18792 3941 1 5 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.184 -0.499 18792 3942 1 5 . 1 1 156 156 VAL H H 156 7.788 7.788 9.011 -1.223 18792 3943 1 5 . 1 1 157 157 GLU N N 157 119.876 119.876 120.438 -0.562 18792 3944 1 5 . 1 1 157 157 GLU C C 157 178.399 178.399 179.222 -0.823 18792 3945 1 5 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.437 -0.677 18792 3946 1 5 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.678 -1.401 18792 3947 1 5 . 1 1 157 157 GLU H H 157 7.409 7.409 8.088 -0.679 18792 3948 1 5 . 1 1 158 158 LEU N N 158 117.194 117.194 120.322 -3.128 18792 3949 1 5 . 1 1 158 158 LEU C C 158 178.595 178.595 178.379 0.216 18792 3950 1 5 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.479 -1.102 18792 3951 1 5 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.281 0.290 18792 3952 1 5 . 1 1 158 158 LEU H H 158 7.584 7.584 7.887 -0.303 18792 3953 1 5 . 1 1 159 159 TYR N N 159 115.549 115.549 119.571 -4.022 18792 3954 1 5 . 1 1 159 159 TYR C C 159 177.032 177.032 176.850 0.182 18792 3955 1 5 . 1 1 159 159 TYR CA C 159 59.116 59.116 60.011 -0.895 18792 3956 1 5 . 1 1 159 159 TYR CB C 159 37.599 37.599 39.655 -2.056 18792 3957 1 5 . 1 1 159 159 TYR H H 159 8.099 8.099 7.979 0.120 18792 3958 1 5 . 1 1 160 160 GLY N N 160 108.334 108.334 105.113 3.221 18792 3959 1 5 . 1 1 160 160 GLY C C 160 173.973 173.973 174.136 -0.163 18792 3960 1 5 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.643 0.421 18792 3961 1 5 . 1 1 160 160 GLY H H 160 8.020 8.020 7.936 0.084 18792 3962 1 5 . 1 1 161 161 ASN N N 161 118.189 118.189 117.289 0.900 18792 3963 1 5 . 1 1 161 161 ASN C C 161 175.513 175.513 175.330 0.183 18792 3964 1 5 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.325 -1.221 18792 3965 1 5 . 1 1 161 161 ASN CB C 161 38.203 38.203 37.562 0.641 18792 3966 1 5 . 1 1 161 161 ASN H H 161 8.327 8.327 8.700 -0.373 18792 3967 1 5 . 1 1 162 162 ASN N N 162 119.022 119.022 119.976 -0.954 18792 3968 1 5 . 1 1 162 162 ASN C C 162 175.690 175.690 175.212 0.478 18792 3969 1 5 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.233 0.191 18792 3970 1 5 . 1 1 162 162 ASN CB C 162 38.203 38.203 36.943 1.260 18792 3971 1 5 . 1 1 162 162 ASN H H 162 8.363 8.363 8.700 -0.337 18792 3972 1 5 . 1 1 163 163 ALA N N 163 123.275 123.275 124.985 -1.710 18792 3973 1 5 . 1 1 163 163 ALA C C 163 178.598 178.598 177.966 0.632 18792 3974 1 5 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.260 -0.022 18792 3975 1 5 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.817 -2.207 18792 3976 1 5 . 1 1 163 163 ALA H H 163 8.103 8.103 7.969 0.134 18792 3977 1 5 . 1 1 164 164 ALA N N 164 121.521 121.521 120.686 0.835 18792 3978 1 5 . 1 1 164 164 ALA C C 164 178.642 178.642 178.787 -0.145 18792 3979 1 5 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.688 -2.104 18792 3980 1 5 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.371 -0.552 18792 3981 1 5 . 1 1 164 164 ALA H H 164 8.053 8.053 8.579 -0.526 18792 3982 1 5 . 1 1 165 165 ALA N N 165 122.101 122.101 117.619 4.482 18792 3983 1 5 . 1 1 165 165 ALA C C 165 179.124 179.124 178.091 1.033 18792 3984 1 5 . 1 1 165 165 ALA CA C 165 53.139 53.139 52.972 0.167 18792 3985 1 5 . 1 1 165 165 ALA CB C 165 17.978 17.978 19.189 -1.211 18792 3986 1 5 . 1 1 165 165 ALA H H 165 7.949 7.949 7.784 0.165 18792 3987 1 5 . 1 1 166 166 GLU N N 166 118.381 118.381 119.373 -0.992 18792 3988 1 5 . 1 1 166 166 GLU C C 166 177.664 177.664 177.410 0.254 18792 3989 1 5 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.714 0.374 18792 3990 1 5 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.373 -1.019 18792 3991 1 5 . 1 1 166 166 GLU H H 166 8.202 8.202 8.133 0.069 18792 3992 1 5 . 1 1 167 167 SER N N 167 115.193 115.193 115.080 0.113 18792 3993 1 5 . 1 1 167 167 SER C C 167 175.312 175.312 176.032 -0.720 18792 3994 1 5 . 1 1 167 167 SER CA C 167 58.831 58.831 60.796 -1.965 18792 3995 1 5 . 1 1 167 167 SER CB C 167 62.537 62.537 63.297 -0.760 18792 3996 1 5 . 1 1 167 167 SER H H 167 8.029 8.029 8.109 -0.080 18792 3997 1 5 . 1 1 168 168 ARG N N 168 121.696 121.696 120.855 0.841 18792 3998 1 5 . 1 1 168 168 ARG C C 168 176.880 176.880 176.422 0.458 18792 3999 1 5 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.012 0.151 18792 4000 1 5 . 1 1 168 168 ARG CB C 168 29.209 29.209 30.737 -1.528 18792 4001 1 5 . 1 1 168 168 ARG H H 168 7.967 7.967 8.229 -0.262 18792 4002 1 5 . 1 1 169 169 LYS N N 169 120.917 120.917 116.813 4.104 18792 4003 1 5 . 1 1 169 169 LYS C C 169 177.640 177.640 177.287 0.353 18792 4004 1 5 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.653 0.044 18792 4005 1 5 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.548 -1.086 18792 4006 1 5 . 1 1 169 169 LYS H H 169 8.011 8.011 8.207 -0.196 18792 4007 1 5 . 1 1 170 170 GLY N N 170 109.155 109.155 108.553 0.602 18792 4008 1 5 . 1 1 170 170 GLY C C 170 174.479 174.479 173.411 1.068 18792 4009 1 5 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.939 0.125 18792 4010 1 5 . 1 1 170 170 GLY H H 170 8.329 8.329 8.411 -0.082 18792 4011 1 5 . 1 1 171 171 GLN N N 171 119.292 119.292 118.347 0.945 18792 4012 1 5 . 1 1 171 171 GLN C C 171 176.463 176.463 175.372 1.091 18792 4013 1 5 . 1 1 171 171 GLN CA C 171 55.666 55.666 54.958 0.708 18792 4014 1 5 . 1 1 171 171 GLN CB C 171 28.199 28.199 30.068 -1.869 18792 4015 1 5 . 1 1 171 171 GLN H H 171 8.035 8.035 8.127 -0.092 18792 4016 1 5 . 1 1 172 172 GLU N N 172 121.703 121.703 121.304 0.399 18792 4017 1 5 . 1 1 172 172 GLU C C 172 176.414 176.414 175.179 1.235 18792 4018 1 5 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.660 0.681 18792 4019 1 5 . 1 1 172 172 GLU CB C 172 28.821 28.821 31.556 -2.735 18792 4020 1 5 . 1 1 172 172 GLU H H 172 8.405 8.405 8.708 -0.303 18792 4021 1 5 . 1 1 173 173 ARG N N 173 121.852 121.852 120.419 1.433 18792 4022 1 5 . 1 1 173 173 ARG C C 173 176.365 176.365 174.692 1.673 18792 4023 1 5 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.858 0.341 18792 4024 1 5 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.322 -2.191 18792 4025 1 5 . 1 1 173 173 ARG H H 173 8.335 8.335 8.683 -0.348 18792 4026 1 5 . 1 1 174 174 LEU N N 174 122.640 122.640 122.915 -0.275 18792 4027 1 5 . 1 1 174 174 LEU C C 174 176.523 176.523 175.179 1.344 18792 4028 1 5 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.904 -1.136 18792 4029 1 5 . 1 1 174 174 LEU CB C 174 40.784 40.784 41.704 -0.920 18792 4030 1 5 . 1 1 174 174 LEU H H 174 8.082 8.082 8.640 -0.558 18792 4031 1 5 . 1 1 175 175 GLU N N 175 125.909 125.909 123.794 2.115 18792 4032 1 5 . 1 1 175 175 GLU C C 175 181.029 181.029 175.621 5.408 18792 4033 1 5 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.679 0.719 18792 4034 1 5 . 1 1 175 175 GLU CB C 175 30.050 30.050 30.329 -0.279 18792 4035 1 5 . 1 1 175 175 GLU H H 175 7.785 7.785 8.499 -0.714 18792 4036 1 6 . 1 1 4 4 ALA N N 4 124.786 124.786 124.193 0.593 18792 4037 1 6 . 1 1 4 4 ALA C C 4 178.272 178.272 178.623 -0.351 18792 4038 1 6 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.833 -2.267 18792 4039 1 6 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.832 -0.598 18792 4040 1 6 . 1 1 4 4 ALA H H 4 8.414 8.414 8.598 -0.184 18792 4041 1 6 . 1 1 5 5 MET N N 5 119.681 119.681 118.086 1.595 18792 4042 1 6 . 1 1 5 5 MET C C 5 176.929 176.929 176.864 0.065 18792 4043 1 6 . 1 1 5 5 MET CA C 5 55.594 55.594 54.314 1.280 18792 4044 1 6 . 1 1 5 5 MET CB C 5 31.540 31.540 31.637 -0.097 18792 4045 1 6 . 1 1 5 5 MET H H 5 8.336 8.336 8.227 0.109 18792 4046 1 6 . 1 1 6 6 SER N N 6 116.162 116.162 118.116 -1.954 18792 4047 1 6 . 1 1 6 6 SER C C 6 175.924 175.924 176.066 -0.142 18792 4048 1 6 . 1 1 6 6 SER CA C 6 59.009 59.009 61.395 -2.386 18792 4049 1 6 . 1 1 6 6 SER CB C 6 62.537 62.537 62.972 -0.435 18792 4050 1 6 . 1 1 6 6 SER H H 6 8.272 8.272 8.098 0.174 18792 4051 1 6 . 1 1 7 7 GLN N N 7 122.263 122.263 122.296 -0.033 18792 4052 1 6 . 1 1 7 7 GLN C C 7 177.027 177.027 177.790 -0.763 18792 4053 1 6 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.928 -2.658 18792 4054 1 6 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.399 -0.660 18792 4055 1 6 . 1 1 7 7 GLN H H 7 8.314 8.314 8.642 -0.328 18792 4056 1 6 . 1 1 8 8 SER N N 8 116.625 116.625 114.705 1.920 18792 4057 1 6 . 1 1 8 8 SER C C 8 176.457 176.457 176.088 0.369 18792 4058 1 6 . 1 1 8 8 SER CA C 8 59.650 59.650 61.758 -2.107 18792 4059 1 6 . 1 1 8 8 SER CB C 8 62.226 62.226 62.476 -0.250 18792 4060 1 6 . 1 1 8 8 SER H H 8 8.333 8.333 8.451 -0.118 18792 4061 1 6 . 1 1 9 9 ASN N N 9 121.307 121.307 120.600 0.707 18792 4062 1 6 . 1 1 9 9 ASN C C 9 177.419 177.419 177.843 -0.424 18792 4063 1 6 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.419 -0.932 18792 4064 1 6 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.611 -1.478 18792 4065 1 6 . 1 1 9 9 ASN H H 9 8.611 8.611 7.818 0.793 18792 4066 1 6 . 1 1 10 10 ARG N N 10 119.830 119.830 120.522 -0.692 18792 4067 1 6 . 1 1 10 10 ARG C C 10 177.615 177.615 178.644 -1.029 18792 4068 1 6 . 1 1 10 10 ARG CA C 10 59.258 59.258 60.051 -0.793 18792 4069 1 6 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.362 -2.163 18792 4070 1 6 . 1 1 10 10 ARG H H 10 7.996 7.996 8.786 -0.790 18792 4071 1 6 . 1 1 11 11 GLU N N 11 117.270 117.270 119.055 -1.785 18792 4072 1 6 . 1 1 11 11 GLU C C 11 179.649 179.649 179.028 0.621 18792 4073 1 6 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.044 -0.035 18792 4074 1 6 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.343 -1.222 18792 4075 1 6 . 1 1 11 11 GLU H H 11 7.885 7.885 8.306 -0.421 18792 4076 1 6 . 1 1 12 12 LEU N N 12 119.900 119.900 120.886 -0.986 18792 4077 1 6 . 1 1 12 12 LEU C C 12 178.473 178.473 178.912 -0.439 18792 4078 1 6 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.356 -0.663 18792 4079 1 6 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.889 -1.260 18792 4080 1 6 . 1 1 12 12 LEU H H 12 7.691 7.691 8.266 -0.575 18792 4081 1 6 . 1 1 13 13 VAL N N 13 117.320 117.320 118.505 -1.185 18792 4082 1 6 . 1 1 13 13 VAL C C 13 177.272 177.272 178.425 -1.153 18792 4083 1 6 . 1 1 13 13 VAL CA C 13 67.156 67.156 67.051 0.105 18792 4084 1 6 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.490 -0.261 18792 4085 1 6 . 1 1 13 13 VAL H H 13 7.629 7.629 7.858 -0.229 18792 4086 1 6 . 1 1 14 14 VAL N N 14 116.659 116.659 120.951 -4.292 18792 4087 1 6 . 1 1 14 14 VAL C C 14 178.718 178.718 177.965 0.753 18792 4088 1 6 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.682 -0.166 18792 4089 1 6 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.368 -0.994 18792 4090 1 6 . 1 1 14 14 VAL H H 14 8.210 8.210 7.971 0.239 18792 4091 1 6 . 1 1 15 15 ASP N N 15 120.374 120.374 121.299 -0.925 18792 4092 1 6 . 1 1 15 15 ASP C C 15 177.557 177.557 178.676 -1.119 18792 4093 1 6 . 1 1 15 15 ASP CA C 15 58.476 58.476 56.995 1.481 18792 4094 1 6 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.534 2.019 18792 4095 1 6 . 1 1 15 15 ASP H H 15 7.967 7.967 8.584 -0.617 18792 4096 1 6 . 1 1 16 16 PHE N N 16 119.864 119.864 121.159 -1.295 18792 4097 1 6 . 1 1 16 16 PHE C C 16 178.252 178.252 177.326 0.926 18792 4098 1 6 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.385 1.395 18792 4099 1 6 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.825 0.235 18792 4100 1 6 . 1 1 16 16 PHE H H 16 8.228 8.228 7.812 0.416 18792 4101 1 6 . 1 1 17 17 LEU N N 17 116.312 116.312 119.412 -3.100 18792 4102 1 6 . 1 1 17 17 LEU C C 17 179.649 179.649 178.757 0.892 18792 4103 1 6 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.515 -0.751 18792 4104 1 6 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.773 -1.688 18792 4105 1 6 . 1 1 17 17 LEU H H 17 8.766 8.766 8.147 0.619 18792 4106 1 6 . 1 1 18 18 SER N N 18 113.715 113.715 115.717 -2.002 18792 4107 1 6 . 1 1 18 18 SER C C 18 177.362 177.362 176.562 0.800 18792 4108 1 6 . 1 1 18 18 SER CA C 18 61.948 61.948 61.687 0.261 18792 4109 1 6 . 1 1 18 18 SER CB C 18 63.003 63.003 63.420 -0.417 18792 4110 1 6 . 1 1 18 18 SER H H 18 8.384 8.384 8.416 -0.032 18792 4111 1 6 . 1 1 19 19 TYR N N 19 124.570 124.570 122.705 1.865 18792 4112 1 6 . 1 1 19 19 TYR C C 19 178.415 178.415 178.010 0.405 18792 4113 1 6 . 1 1 19 19 TYR CA C 19 59.764 59.764 62.448 -2.684 18792 4114 1 6 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.325 -1.309 18792 4115 1 6 . 1 1 19 19 TYR H H 19 8.155 8.155 8.455 -0.300 18792 4116 1 6 . 1 1 20 20 LYS N N 20 119.739 119.739 120.219 -0.480 18792 4117 1 6 . 1 1 20 20 LYS C C 20 180.456 180.456 178.983 1.473 18792 4118 1 6 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.009 -2.521 18792 4119 1 6 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.009 -3.850 18792 4120 1 6 . 1 1 20 20 LYS H H 20 8.224 8.224 7.881 0.343 18792 4121 1 6 . 1 1 21 21 LEU N N 21 118.092 118.092 119.706 -1.614 18792 4122 1 6 . 1 1 21 21 LEU C C 21 179.989 179.989 178.393 1.596 18792 4123 1 6 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.523 -0.397 18792 4124 1 6 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.967 -2.359 18792 4125 1 6 . 1 1 21 21 LEU H H 21 8.586 8.586 7.938 0.648 18792 4126 1 6 . 1 1 22 22 SER N N 22 117.304 117.304 113.286 4.018 18792 4127 1 6 . 1 1 22 22 SER C C 22 180.152 180.152 176.667 3.485 18792 4128 1 6 . 1 1 22 22 SER CA C 22 61.287 61.287 61.035 0.252 18792 4129 1 6 . 1 1 22 22 SER H H 22 8.266 8.266 7.745 0.521 18792 4130 1 6 . 1 1 23 23 GLN N N 23 122.497 122.497 120.688 1.809 18792 4131 1 6 . 1 1 23 23 GLN C C 23 177.297 177.297 177.461 -0.164 18792 4132 1 6 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.306 -0.364 18792 4133 1 6 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.669 -0.858 18792 4134 1 6 . 1 1 23 23 GLN H H 23 7.571 7.571 8.040 -0.469 18792 4135 1 6 . 1 1 24 24 LYS N N 24 116.038 116.038 117.150 -1.112 18792 4136 1 6 . 1 1 24 24 LYS C C 24 175.704 175.704 176.684 -0.980 18792 4137 1 6 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.132 -2.637 18792 4138 1 6 . 1 1 24 24 LYS CB C 24 31.229 31.229 32.841 -1.612 18792 4139 1 6 . 1 1 24 24 LYS H H 24 7.134 7.134 7.311 -0.176 18792 4140 1 6 . 1 1 25 25 GLY N N 25 105.283 105.283 104.929 0.354 18792 4141 1 6 . 1 1 25 25 GLY C C 25 174.013 174.013 172.828 1.185 18792 4142 1 6 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.856 -0.077 18792 4143 1 6 . 1 1 25 25 GLY H H 25 7.483 7.483 7.679 -0.196 18792 4144 1 6 . 1 1 26 26 TYR N N 26 119.547 119.547 115.339 4.208 18792 4145 1 6 . 1 1 26 26 TYR C C 26 175.122 175.122 173.598 1.524 18792 4146 1 6 . 1 1 26 26 TYR CA C 26 55.132 55.132 55.664 -0.532 18792 4147 1 6 . 1 1 26 26 TYR CB C 26 40.080 40.080 38.787 1.293 18792 4148 1 6 . 1 1 26 26 TYR H H 26 7.788 7.788 7.143 0.645 18792 4149 1 6 . 1 1 27 27 SER N N 27 115.088 115.088 118.853 -3.765 18792 4150 1 6 . 1 1 27 27 SER C C 27 174.452 174.452 175.887 -1.435 18792 4151 1 6 . 1 1 27 27 SER CA C 27 56.306 56.306 55.530 0.776 18792 4152 1 6 . 1 1 27 27 SER CB C 27 63.921 63.921 64.465 -0.544 18792 4153 1 6 . 1 1 27 27 SER H H 27 8.473 8.473 8.484 -0.011 18792 4154 1 6 . 1 1 28 28 TRP N N 28 127.014 127.014 126.810 0.204 18792 4155 1 6 . 1 1 28 28 TRP C C 28 177.002 177.002 176.113 0.889 18792 4156 1 6 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.251 0.221 18792 4157 1 6 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.259 1.571 18792 4158 1 6 . 1 1 28 28 TRP H H 28 8.897 8.897 9.386 -0.489 18792 4159 1 6 . 1 1 29 29 SER N N 29 112.044 112.044 115.065 -3.021 18792 4160 1 6 . 1 1 29 29 SER C C 29 175.106 175.106 175.092 0.014 18792 4161 1 6 . 1 1 29 29 SER CA C 29 59.472 59.472 60.048 -0.576 18792 4162 1 6 . 1 1 29 29 SER CB C 29 62.226 62.226 62.797 -0.571 18792 4163 1 6 . 1 1 29 29 SER H H 29 8.129 8.129 7.232 0.897 18792 4164 1 6 . 1 1 30 30 GLN N N 30 119.160 119.160 117.445 1.715 18792 4165 1 6 . 1 1 30 30 GLN C C 30 176.218 176.218 176.239 -0.021 18792 4166 1 6 . 1 1 30 30 GLN CA C 30 56.412 56.412 56.241 0.171 18792 4167 1 6 . 1 1 30 30 GLN CB C 30 27.578 27.578 29.985 -2.407 18792 4168 1 6 . 1 1 30 30 GLN H H 30 7.370 7.370 7.515 -0.145 18792 4169 1 6 . 1 1 31 31 PHE N N 31 116.277 116.277 116.283 -0.006 18792 4170 1 6 . 1 1 31 31 PHE C C 31 175.217 175.217 174.719 0.498 18792 4171 1 6 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.475 -3.241 18792 4172 1 6 . 1 1 31 31 PHE CB C 31 39.066 39.066 37.950 1.116 18792 4173 1 6 . 1 1 31 31 PHE H H 31 7.248 7.248 8.177 -0.929 18792 4174 1 6 . 1 1 32 32 SER N N 32 113.683 113.683 112.376 1.307 18792 4175 1 6 . 1 1 32 32 SER C C 32 173.793 173.793 173.227 0.566 18792 4176 1 6 . 1 1 32 32 SER CA C 32 57.124 57.124 56.626 0.498 18792 4177 1 6 . 1 1 32 32 SER CB C 32 63.081 63.081 65.189 -2.108 18792 4178 1 6 . 1 1 32 32 SER H H 32 7.242 7.242 7.572 -0.330 18792 4179 1 6 . 1 1 33 33 ASP N N 33 122.195 122.195 118.881 3.314 18792 4180 1 6 . 1 1 33 33 ASP C C 33 176.394 176.394 176.495 -0.101 18792 4181 1 6 . 1 1 33 33 ASP CA C 33 53.748 53.748 54.452 -0.704 18792 4182 1 6 . 1 1 33 33 ASP CB C 33 40.398 40.398 41.092 -0.694 18792 4183 1 6 . 1 1 33 33 ASP H H 33 8.257 8.257 8.581 -0.324 18792 4184 1 6 . 1 1 34 34 VAL N N 34 118.913 118.913 118.805 0.108 18792 4185 1 6 . 1 1 34 34 VAL C C 34 176.328 176.328 175.789 0.539 18792 4186 1 6 . 1 1 34 34 VAL CA C 34 61.891 61.891 61.810 0.081 18792 4187 1 6 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.737 -0.722 18792 4188 1 6 . 1 1 34 34 VAL H H 34 7.852 7.852 7.755 0.097 18792 4189 1 6 . 1 1 35 35 GLU N N 35 124.205 124.205 121.042 3.163 18792 4190 1 6 . 1 1 35 35 GLU C C 35 176.586 176.586 175.464 1.122 18792 4191 1 6 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.455 -1.398 18792 4192 1 6 . 1 1 35 35 GLU CB C 35 28.898 28.898 30.132 -1.234 18792 4193 1 6 . 1 1 35 35 GLU H H 35 8.401 8.401 8.139 0.262 18792 4194 1 6 . 1 1 36 36 GLU N N 36 121.670 121.670 124.198 -2.528 18792 4195 1 6 . 1 1 36 36 GLU C C 36 176.218 176.218 174.560 1.658 18792 4196 1 6 . 1 1 36 36 GLU CA C 36 55.988 55.988 55.895 0.093 18792 4197 1 6 . 1 1 36 36 GLU CB C 36 29.442 29.442 29.682 -0.240 18792 4198 1 6 . 1 1 36 36 GLU H H 36 8.239 8.239 8.694 -0.455 18792 4199 1 6 . 1 1 37 37 ASN N N 37 119.252 119.252 120.581 -1.329 18792 4200 1 6 . 1 1 37 37 ASN C C 37 175.003 175.003 173.405 1.598 18792 4201 1 6 . 1 1 37 37 ASN CA C 37 52.655 52.655 52.705 -0.050 18792 4202 1 6 . 1 1 37 37 ASN CB C 37 38.212 38.212 40.419 -2.207 18792 4203 1 6 . 1 1 37 37 ASN H H 37 8.412 8.412 8.343 0.069 18792 4204 1 6 . 1 1 38 38 ARG N N 38 121.622 121.622 120.397 1.225 18792 4205 1 6 . 1 1 38 38 ARG C C 38 176.610 176.610 173.781 2.829 18792 4206 1 6 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.747 -1.383 18792 4207 1 6 . 1 1 38 38 ARG CB C 38 29.419 29.419 29.505 -0.086 18792 4208 1 6 . 1 1 38 38 ARG H H 38 8.227 8.227 8.607 -0.380 18792 4209 1 6 . 1 1 39 39 THR N N 39 115.681 115.681 113.031 2.650 18792 4210 1 6 . 1 1 39 39 THR C C 39 174.500 174.500 174.678 -0.178 18792 4211 1 6 . 1 1 39 39 THR CA C 39 61.606 61.606 61.450 0.156 18792 4212 1 6 . 1 1 39 39 THR CB C 39 69.163 69.163 69.603 -0.440 18792 4213 1 6 . 1 1 39 39 THR H H 39 8.173 8.173 8.205 -0.032 18792 4214 1 6 . 1 1 40 40 GLU N N 40 122.708 122.708 123.505 -0.797 18792 4215 1 6 . 1 1 40 40 GLU C C 40 175.728 175.728 176.676 -0.948 18792 4216 1 6 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.671 -0.899 18792 4217 1 6 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.734 -0.680 18792 4218 1 6 . 1 1 40 40 GLU H H 40 8.298 8.298 8.641 -0.343 18792 4219 1 6 . 1 1 41 41 ALA N N 41 125.922 125.922 123.476 2.446 18792 4220 1 6 . 1 1 41 41 ALA C C 41 175.557 175.557 176.365 -0.808 18792 4221 1 6 . 1 1 41 41 ALA CA C 41 49.973 49.973 52.097 -2.124 18792 4222 1 6 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.518 -0.273 18792 4223 1 6 . 1 1 41 41 ALA H H 41 8.212 8.212 8.078 0.134 18792 4224 1 6 . 1 1 43 43 GLU N N 43 120.783 120.783 117.900 2.883 18792 4225 1 6 . 1 1 43 43 GLU C C 43 177.174 177.174 175.833 1.341 18792 4226 1 6 . 1 1 43 43 GLU CA C 43 56.341 56.341 57.411 -1.071 18792 4227 1 6 . 1 1 43 43 GLU CB C 43 29.287 29.287 28.867 0.420 18792 4228 1 6 . 1 1 43 43 GLU H H 43 8.519 8.519 8.625 -0.106 18792 4229 1 6 . 1 1 44 44 GLY N N 44 110.022 110.022 106.712 3.310 18792 4230 1 6 . 1 1 44 44 GLY C C 44 174.773 174.773 173.693 1.080 18792 4231 1 6 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.907 -0.879 18792 4232 1 6 . 1 1 44 44 GLY H H 44 8.429 8.429 8.175 0.254 18792 4233 1 6 . 1 1 45 45 THR N N 45 112.790 112.790 111.189 1.601 18792 4234 1 6 . 1 1 45 45 THR C C 45 175.726 175.726 174.933 0.793 18792 4235 1 6 . 1 1 45 45 THR CA C 45 61.987 61.987 62.033 -0.046 18792 4236 1 6 . 1 1 45 45 THR CB C 45 69.304 69.304 69.948 -0.644 18792 4237 1 6 . 1 1 45 45 THR H H 45 8.125 8.125 7.816 0.309 18792 4238 1 6 . 1 1 46 46 GLU N N 46 122.752 122.752 122.663 0.089 18792 4239 1 6 . 1 1 46 46 GLU C C 46 177.419 177.419 176.840 0.579 18792 4240 1 6 . 1 1 46 46 GLU CA C 46 57.231 57.231 57.987 -0.756 18792 4241 1 6 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.884 -1.685 18792 4242 1 6 . 1 1 46 46 GLU H H 46 8.765 8.765 8.404 0.361 18792 4243 1 6 . 1 1 47 47 SER N N 47 114.895 114.895 109.617 5.278 18792 4244 1 6 . 1 1 47 47 SER C C 47 175.826 175.826 174.886 0.940 18792 4245 1 6 . 1 1 47 47 SER CA C 47 58.582 58.582 57.998 0.584 18792 4246 1 6 . 1 1 47 47 SER CB C 47 62.537 62.537 64.024 -1.487 18792 4247 1 6 . 1 1 47 47 SER H H 47 8.355 8.355 7.752 0.603 18792 4248 1 6 . 1 1 48 48 GLU N N 48 122.429 122.429 122.321 0.108 18792 4249 1 6 . 1 1 48 48 GLU C C 48 178.099 178.099 177.856 0.243 18792 4250 1 6 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.162 -0.544 18792 4251 1 6 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.712 -1.237 18792 4252 1 6 . 1 1 48 48 GLU H H 48 8.139 8.139 8.791 -0.652 18792 4253 1 6 . 1 1 49 49 ALA N N 49 120.374 120.374 122.159 -1.785 18792 4254 1 6 . 1 1 49 49 ALA C C 49 180.843 180.843 178.917 1.926 18792 4255 1 6 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.995 -0.512 18792 4256 1 6 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.022 -0.587 18792 4257 1 6 . 1 1 49 49 ALA H H 49 8.079 8.079 8.109 -0.030 18792 4258 1 6 . 1 1 50 50 VAL N N 50 118.599 118.599 118.808 -0.209 18792 4259 1 6 . 1 1 50 50 VAL C C 50 176.921 176.921 177.408 -0.487 18792 4260 1 6 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.040 -0.480 18792 4261 1 6 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.103 -0.806 18792 4262 1 6 . 1 1 50 50 VAL H H 50 7.419 7.419 7.820 -0.401 18792 4263 1 6 . 1 1 51 51 LYS N N 51 117.469 117.469 120.414 -2.945 18792 4264 1 6 . 1 1 51 51 LYS C C 51 179.061 179.061 178.547 0.514 18792 4265 1 6 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.749 -0.526 18792 4266 1 6 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.986 -0.990 18792 4267 1 6 . 1 1 51 51 LYS H H 51 7.359 7.359 7.578 -0.219 18792 4268 1 6 . 1 1 52 52 GLN N N 52 115.930 115.930 117.847 -1.917 18792 4269 1 6 . 1 1 52 52 GLN C C 52 177.713 177.713 178.237 -0.524 18792 4270 1 6 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.266 0.211 18792 4271 1 6 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.021 -1.454 18792 4272 1 6 . 1 1 52 52 GLN H H 52 8.025 8.025 7.816 0.209 18792 4273 1 6 . 1 1 53 53 ALA N N 53 119.782 119.782 123.104 -3.322 18792 4274 1 6 . 1 1 53 53 ALA C C 53 180.008 180.008 179.538 0.470 18792 4275 1 6 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.762 -0.377 18792 4276 1 6 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.712 -1.197 18792 4277 1 6 . 1 1 53 53 ALA H H 53 7.655 7.655 7.659 -0.004 18792 4278 1 6 . 1 1 54 54 LEU N N 54 120.443 120.443 119.852 0.591 18792 4279 1 6 . 1 1 54 54 LEU C C 54 179.330 179.330 178.607 0.723 18792 4280 1 6 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.115 0.898 18792 4281 1 6 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.451 -0.589 18792 4282 1 6 . 1 1 54 54 LEU H H 54 8.419 8.419 8.073 0.346 18792 4283 1 6 . 1 1 55 55 ARG N N 55 118.423 118.423 119.936 -1.513 18792 4284 1 6 . 1 1 55 55 ARG C C 55 178.767 178.767 178.470 0.297 18792 4285 1 6 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.207 1.190 18792 4286 1 6 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.692 -0.949 18792 4287 1 6 . 1 1 55 55 ARG H H 55 8.062 8.062 8.190 -0.128 18792 4288 1 6 . 1 1 56 56 GLU N N 56 115.988 115.988 119.318 -3.330 18792 4289 1 6 . 1 1 56 56 GLU C C 56 180.090 180.090 178.907 1.183 18792 4290 1 6 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.338 -0.578 18792 4291 1 6 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.718 -1.364 18792 4292 1 6 . 1 1 56 56 GLU H H 56 7.772 7.772 8.547 -0.775 18792 4293 1 6 . 1 1 57 57 ALA N N 57 122.837 122.837 121.595 1.242 18792 4294 1 6 . 1 1 57 57 ALA C C 57 181.861 181.861 179.999 1.862 18792 4295 1 6 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.834 -0.200 18792 4296 1 6 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.570 -0.097 18792 4297 1 6 . 1 1 57 57 ALA H H 57 8.774 8.774 8.012 0.762 18792 4298 1 6 . 1 1 58 58 GLY N N 58 108.409 108.409 106.836 1.573 18792 4299 1 6 . 1 1 58 58 GLY C C 58 175.331 175.331 175.936 -0.605 18792 4300 1 6 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.953 -0.285 18792 4301 1 6 . 1 1 58 58 GLY H H 58 9.073 9.073 8.429 0.644 18792 4302 1 6 . 1 1 59 59 ASP N N 59 122.074 122.074 122.941 -0.867 18792 4303 1 6 . 1 1 59 59 ASP C C 59 179.023 179.023 177.815 1.208 18792 4304 1 6 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.893 -0.591 18792 4305 1 6 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.050 -2.208 18792 4306 1 6 . 1 1 59 59 ASP H H 59 8.049 8.049 8.389 -0.340 18792 4307 1 6 . 1 1 60 60 GLU N N 60 120.131 120.131 119.952 0.179 18792 4308 1 6 . 1 1 60 60 GLU C C 60 178.522 178.522 179.621 -1.099 18792 4309 1 6 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.455 -0.446 18792 4310 1 6 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.925 -1.726 18792 4311 1 6 . 1 1 60 60 GLU H H 60 8.136 8.136 8.159 -0.023 18792 4312 1 6 . 1 1 61 61 PHE N N 61 121.309 121.309 119.145 2.164 18792 4313 1 6 . 1 1 61 61 PHE C C 61 176.904 176.904 178.112 -1.208 18792 4314 1 6 . 1 1 61 61 PHE CA C 61 61.322 61.322 60.787 0.535 18792 4315 1 6 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.316 -0.707 18792 4316 1 6 . 1 1 61 61 PHE H H 61 8.523 8.523 8.267 0.256 18792 4317 1 6 . 1 1 62 62 GLU N N 62 115.971 115.971 120.852 -4.881 18792 4318 1 6 . 1 1 62 62 GLU C C 62 177.713 177.713 179.043 -1.330 18792 4319 1 6 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.599 -1.409 18792 4320 1 6 . 1 1 62 62 GLU CB C 62 28.277 28.277 30.108 -1.831 18792 4321 1 6 . 1 1 62 62 GLU H H 62 7.969 7.969 8.466 -0.497 18792 4322 1 6 . 1 1 63 63 LEU N N 63 116.703 116.703 119.225 -2.522 18792 4323 1 6 . 1 1 63 63 LEU C C 63 178.963 178.963 178.689 0.274 18792 4324 1 6 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.366 -0.954 18792 4325 1 6 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.547 -1.141 18792 4326 1 6 . 1 1 63 63 LEU H H 63 7.347 7.347 8.476 -1.129 18792 4327 1 6 . 1 1 64 64 ARG N N 64 117.453 117.453 115.247 2.206 18792 4328 1 6 . 1 1 64 64 ARG C C 64 177.297 177.297 175.929 1.368 18792 4329 1 6 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.933 0.404 18792 4330 1 6 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.371 -1.774 18792 4331 1 6 . 1 1 64 64 ARG H H 64 7.995 7.995 7.681 0.314 18792 4332 1 6 . 1 1 65 65 TYR N N 65 118.956 118.956 118.617 0.339 18792 4333 1 6 . 1 1 65 65 TYR C C 65 175.278 175.278 174.129 1.149 18792 4334 1 6 . 1 1 65 65 TYR CA C 65 55.701 55.701 56.367 -0.666 18792 4335 1 6 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.269 -3.283 18792 4336 1 6 . 1 1 65 65 TYR H H 65 7.909 7.909 7.806 0.103 18792 4337 1 6 . 1 1 66 66 ARG N N 66 119.438 119.438 120.698 -1.260 18792 4338 1 6 . 1 1 66 66 ARG C C 66 178.424 178.424 177.324 1.100 18792 4339 1 6 . 1 1 66 66 ARG CA C 66 58.476 58.476 57.408 1.068 18792 4340 1 6 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.184 -1.363 18792 4341 1 6 . 1 1 66 66 ARG H H 66 7.244 7.244 8.240 -0.996 18792 4342 1 6 . 1 1 67 67 ARG N N 67 118.936 118.936 120.330 -1.394 18792 4343 1 6 . 1 1 67 67 ARG C C 67 177.542 177.542 177.395 0.147 18792 4344 1 6 . 1 1 67 67 ARG CA C 67 57.444 57.444 58.285 -0.841 18792 4345 1 6 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.201 -1.080 18792 4346 1 6 . 1 1 67 67 ARG H H 67 8.417 8.417 7.950 0.467 18792 4347 1 6 . 1 1 68 68 ALA N N 68 121.797 121.797 120.748 1.049 18792 4348 1 6 . 1 1 68 68 ALA C C 68 180.337 180.337 179.961 0.376 18792 4349 1 6 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.631 -0.495 18792 4350 1 6 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.874 -0.407 18792 4351 1 6 . 1 1 68 68 ALA H H 68 7.827 7.827 8.259 -0.432 18792 4352 1 6 . 1 1 69 69 PHE N N 69 115.986 115.986 114.370 1.616 18792 4353 1 6 . 1 1 69 69 PHE C C 69 177.468 177.468 177.487 -0.019 18792 4354 1 6 . 1 1 69 69 PHE CA C 69 58.049 58.049 57.667 0.382 18792 4355 1 6 . 1 1 69 69 PHE CB C 69 37.599 37.599 37.712 -0.112 18792 4356 1 6 . 1 1 69 69 PHE H H 69 8.517 8.517 7.664 0.853 18792 4357 1 6 . 1 1 70 70 SER N N 70 116.526 116.526 117.696 -1.170 18792 4358 1 6 . 1 1 70 70 SER C C 70 177.640 177.640 176.661 0.979 18792 4359 1 6 . 1 1 70 70 SER CA C 70 61.073 61.073 61.707 -0.634 18792 4360 1 6 . 1 1 70 70 SER CB C 70 61.993 61.993 62.732 -0.739 18792 4361 1 6 . 1 1 70 70 SER H H 70 8.152 8.152 7.979 0.173 18792 4362 1 6 . 1 1 71 71 ASP N N 71 121.181 121.181 121.646 -0.465 18792 4363 1 6 . 1 1 71 71 ASP C C 71 178.546 178.546 178.383 0.163 18792 4364 1 6 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.926 -1.478 18792 4365 1 6 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.712 -1.481 18792 4366 1 6 . 1 1 71 71 ASP H H 71 8.356 8.356 7.683 0.673 18792 4367 1 6 . 1 1 72 72 LEU N N 72 120.747 120.747 119.860 0.887 18792 4368 1 6 . 1 1 72 72 LEU C C 72 178.963 178.963 178.958 0.005 18792 4369 1 6 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.131 -0.687 18792 4370 1 6 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.096 -1.079 18792 4371 1 6 . 1 1 72 72 LEU H H 72 7.738 7.738 7.487 0.251 18792 4372 1 6 . 1 1 73 73 THR N N 73 109.432 109.432 109.995 -0.563 18792 4373 1 6 . 1 1 73 73 THR C C 73 177.481 177.481 176.424 1.057 18792 4374 1 6 . 1 1 73 73 THR CA C 73 65.128 65.128 65.290 -0.162 18792 4375 1 6 . 1 1 73 73 THR CB C 73 67.720 67.720 68.821 -1.101 18792 4376 1 6 . 1 1 73 73 THR H H 73 8.296 8.296 8.736 -0.440 18792 4377 1 6 . 1 1 74 74 SER N N 74 115.862 115.862 116.568 -0.706 18792 4378 1 6 . 1 1 74 74 SER C C 74 175.361 175.361 175.863 -0.502 18792 4379 1 6 . 1 1 74 74 SER CA C 74 60.112 60.112 60.999 -0.887 18792 4380 1 6 . 1 1 74 74 SER CB C 74 62.537 62.537 63.385 -0.848 18792 4381 1 6 . 1 1 74 74 SER H H 74 7.629 7.629 7.844 -0.215 18792 4382 1 6 . 1 1 75 75 GLN N N 75 118.551 118.551 119.204 -0.653 18792 4383 1 6 . 1 1 75 75 GLN C C 75 176.316 176.316 176.021 0.295 18792 4384 1 6 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.263 0.541 18792 4385 1 6 . 1 1 75 75 GLN CB C 75 28.277 28.277 28.766 -0.489 18792 4386 1 6 . 1 1 75 75 GLN H H 75 7.640 7.640 7.574 0.066 18792 4387 1 6 . 1 1 76 76 LEU N N 76 118.313 118.313 113.908 4.405 18792 4388 1 6 . 1 1 76 76 LEU C C 76 174.160 174.160 176.137 -1.977 18792 4389 1 6 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.696 -0.956 18792 4390 1 6 . 1 1 76 76 LEU CB C 76 42.727 42.727 39.273 3.454 18792 4391 1 6 . 1 1 76 76 LEU H H 76 7.411 7.411 7.221 0.190 18792 4392 1 6 . 1 1 77 77 HIS N N 77 120.104 120.104 118.438 1.666 18792 4393 1 6 . 1 1 77 77 HIS C C 77 174.528 174.528 173.868 0.660 18792 4394 1 6 . 1 1 77 77 HIS CA C 77 54.207 54.207 57.186 -2.979 18792 4395 1 6 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.127 -0.161 18792 4396 1 6 . 1 1 77 77 HIS H H 77 8.117 8.117 8.266 -0.149 18792 4397 1 6 . 1 1 78 78 ILE N N 78 122.298 122.298 121.426 0.872 18792 4398 1 6 . 1 1 78 78 ILE C C 78 174.240 174.240 175.068 -0.828 18792 4399 1 6 . 1 1 78 78 ILE CA C 78 61.402 61.402 59.865 1.537 18792 4400 1 6 . 1 1 78 78 ILE CB C 78 37.591 37.591 39.262 -1.671 18792 4401 1 6 . 1 1 78 78 ILE H H 78 8.655 8.655 8.133 0.522 18792 4402 1 6 . 1 1 79 79 THR N N 79 116.442 116.442 115.784 0.658 18792 4403 1 6 . 1 1 79 79 THR C C 79 174.291 174.291 173.982 0.309 18792 4404 1 6 . 1 1 79 79 THR CA C 79 61.632 61.632 60.970 0.662 18792 4405 1 6 . 1 1 79 79 THR CB C 79 68.704 68.704 68.389 0.315 18792 4406 1 6 . 1 1 79 79 THR H H 79 8.245 8.245 7.771 0.474 18792 4407 1 6 . 1 1 84 84 TYR N N 84 120.888 120.888 119.746 1.142 18792 4408 1 6 . 1 1 84 84 TYR C C 84 176.708 176.708 177.499 -0.791 18792 4409 1 6 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.481 -1.049 18792 4410 1 6 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.404 -1.659 18792 4411 1 6 . 1 1 84 84 TYR H H 84 8.733 8.733 8.208 0.525 18792 4412 1 6 . 1 1 85 85 GLN N N 85 114.530 114.530 118.597 -4.067 18792 4413 1 6 . 1 1 85 85 GLN C C 85 178.473 178.473 178.224 0.249 18792 4414 1 6 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.117 0.177 18792 4415 1 6 . 1 1 85 85 GLN CB C 85 26.801 26.801 29.020 -2.219 18792 4416 1 6 . 1 1 85 85 GLN H H 85 8.413 8.413 8.194 0.219 18792 4417 1 6 . 1 1 86 86 SER N N 86 114.032 114.032 116.790 -2.758 18792 4418 1 6 . 1 1 86 86 SER C C 86 178.473 178.473 176.872 1.601 18792 4419 1 6 . 1 1 86 86 SER CA C 86 62.175 62.175 61.332 0.843 18792 4420 1 6 . 1 1 86 86 SER CB C 86 63.252 63.252 62.930 0.322 18792 4421 1 6 . 1 1 86 86 SER H H 86 7.258 7.258 7.463 -0.205 18792 4422 1 6 . 1 1 88 88 GLU N N 88 119.386 119.386 120.044 -0.658 18792 4423 1 6 . 1 1 88 88 GLU C C 88 177.199 177.199 178.544 -1.345 18792 4424 1 6 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.645 -1.063 18792 4425 1 6 . 1 1 88 88 GLU CB C 88 28.976 28.976 28.846 0.130 18792 4426 1 6 . 1 1 88 88 GLU H H 88 8.534 8.534 7.845 0.689 18792 4427 1 6 . 1 1 89 89 GLN N N 89 114.678 114.678 119.846 -5.168 18792 4428 1 6 . 1 1 89 89 GLN C C 89 178.669 178.669 178.428 0.241 18792 4429 1 6 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.033 -0.451 18792 4430 1 6 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.534 -1.112 18792 4431 1 6 . 1 1 89 89 GLN H H 89 7.500 7.500 7.673 -0.173 18792 4432 1 6 . 1 1 90 90 VAL N N 90 118.174 118.174 119.136 -0.962 18792 4433 1 6 . 1 1 90 90 VAL C C 90 178.081 178.081 177.219 0.862 18792 4434 1 6 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.743 -0.188 18792 4435 1 6 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.717 -1.110 18792 4436 1 6 . 1 1 90 90 VAL H H 90 7.017 7.017 7.636 -0.619 18792 4437 1 6 . 1 1 91 91 VAL N N 91 119.489 119.489 120.732 -1.243 18792 4438 1 6 . 1 1 91 91 VAL C C 91 177.914 177.914 178.069 -0.155 18792 4439 1 6 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.397 -0.628 18792 4440 1 6 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.963 -0.672 18792 4441 1 6 . 1 1 91 91 VAL H H 91 7.833 7.833 7.856 -0.023 18792 4442 1 6 . 1 1 92 92 ASN N N 92 117.180 117.180 118.254 -1.074 18792 4443 1 6 . 1 1 92 92 ASN C C 92 179.110 179.110 177.374 1.736 18792 4444 1 6 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.261 -1.343 18792 4445 1 6 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.550 -2.582 18792 4446 1 6 . 1 1 92 92 ASN H H 92 8.368 8.368 8.556 -0.188 18792 4447 1 6 . 1 1 93 93 GLU N N 93 118.476 118.476 118.861 -0.385 18792 4448 1 6 . 1 1 93 93 GLU C C 93 179.355 179.355 179.188 0.167 18792 4449 1 6 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.992 -0.587 18792 4450 1 6 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.973 -2.240 18792 4451 1 6 . 1 1 93 93 GLU H H 93 7.213 7.213 7.943 -0.730 18792 4452 1 6 . 1 1 94 94 LEU N N 94 120.889 120.889 121.762 -0.873 18792 4453 1 6 . 1 1 94 94 LEU C C 94 178.473 178.473 178.376 0.097 18792 4454 1 6 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.309 -0.292 18792 4455 1 6 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.044 -2.114 18792 4456 1 6 . 1 1 94 94 LEU H H 94 7.446 7.446 7.863 -0.417 18792 4457 1 6 . 1 1 95 95 PHE N N 95 112.902 112.902 118.564 -5.662 18792 4458 1 6 . 1 1 95 95 PHE C C 95 176.586 176.586 176.435 0.151 18792 4459 1 6 . 1 1 95 95 PHE CA C 95 57.159 57.159 58.510 -1.351 18792 4460 1 6 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.740 -0.519 18792 4461 1 6 . 1 1 95 95 PHE H H 95 6.916 6.916 8.390 -1.474 18792 4462 1 6 . 1 1 96 96 ARG N N 96 123.729 123.729 117.883 5.846 18792 4463 1 6 . 1 1 96 96 ARG C C 96 177.272 177.272 176.700 0.572 18792 4464 1 6 . 1 1 96 96 ARG CA C 96 59.223 59.223 57.852 1.371 18792 4465 1 6 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.331 -1.899 18792 4466 1 6 . 1 1 96 96 ARG H H 96 7.126 7.126 7.413 -0.287 18792 4467 1 6 . 1 1 97 97 ASP N N 97 116.576 116.576 115.581 0.995 18792 4468 1 6 . 1 1 97 97 ASP C C 97 175.687 175.687 174.471 1.216 18792 4469 1 6 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.025 -0.352 18792 4470 1 6 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.029 -2.985 18792 4471 1 6 . 1 1 97 97 ASP H H 97 8.644 8.644 7.755 0.889 18792 4472 1 6 . 1 1 98 98 GLY N N 98 108.551 108.551 107.154 1.397 18792 4473 1 6 . 1 1 98 98 GLY C C 98 172.690 172.690 172.746 -0.056 18792 4474 1 6 . 1 1 98 98 GLY CA C 98 43.250 43.250 44.912 -1.662 18792 4475 1 6 . 1 1 98 98 GLY H H 98 7.463 7.463 7.493 -0.030 18792 4476 1 6 . 1 1 99 99 VAL N N 99 120.630 120.630 122.344 -1.714 18792 4477 1 6 . 1 1 99 99 VAL C C 99 174.503 174.503 174.231 0.272 18792 4478 1 6 . 1 1 99 99 VAL CA C 99 62.318 62.318 62.663 -0.345 18792 4479 1 6 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.318 -1.555 18792 4480 1 6 . 1 1 99 99 VAL H H 99 8.184 8.184 8.290 -0.106 18792 4481 1 6 . 1 1 100 100 ASN N N 100 115.485 115.485 116.053 -0.568 18792 4482 1 6 . 1 1 100 100 ASN C C 100 175.239 175.239 176.094 -0.855 18792 4483 1 6 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.317 -2.956 18792 4484 1 6 . 1 1 100 100 ASN CB C 100 38.920 38.920 39.385 -0.465 18792 4485 1 6 . 1 1 100 100 ASN H H 100 6.241 6.241 7.777 -1.536 18792 4486 1 6 . 1 1 101 101 TRP N N 101 118.266 118.266 119.108 -0.842 18792 4487 1 6 . 1 1 101 101 TRP C C 101 178.301 178.301 175.747 2.554 18792 4488 1 6 . 1 1 101 101 TRP CA C 101 60.539 60.539 58.492 2.047 18792 4489 1 6 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.690 1.140 18792 4490 1 6 . 1 1 101 101 TRP H H 101 8.409 8.409 8.501 -0.092 18792 4491 1 6 . 1 1 102 102 GLY N N 102 106.147 106.147 107.253 -1.106 18792 4492 1 6 . 1 1 102 102 GLY C C 102 177.640 177.640 174.712 2.928 18792 4493 1 6 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.750 2.164 18792 4494 1 6 . 1 1 102 102 GLY H H 102 8.504 8.504 7.354 1.150 18792 4495 1 6 . 1 1 103 103 ARG N N 103 121.347 121.347 121.901 -0.554 18792 4496 1 6 . 1 1 103 103 ARG C C 103 177.738 177.738 178.189 -0.451 18792 4497 1 6 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.129 -0.187 18792 4498 1 6 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.851 0.368 18792 4499 1 6 . 1 1 103 103 ARG H H 103 8.099 8.099 8.160 -0.061 18792 4500 1 6 . 1 1 104 104 ILE N N 104 120.930 120.930 119.916 1.014 18792 4501 1 6 . 1 1 104 104 ILE C C 104 178.197 178.197 177.475 0.722 18792 4502 1 6 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.841 1.694 18792 4503 1 6 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.990 -1.945 18792 4504 1 6 . 1 1 104 104 ILE H H 104 7.690 7.690 8.114 -0.424 18792 4505 1 6 . 1 1 105 105 VAL N N 105 120.938 120.938 119.338 1.600 18792 4506 1 6 . 1 1 105 105 VAL C C 105 177.854 177.854 177.655 0.199 18792 4507 1 6 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.368 1.090 18792 4508 1 6 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.890 -0.516 18792 4509 1 6 . 1 1 105 105 VAL H H 105 8.245 8.245 7.530 0.715 18792 4510 1 6 . 1 1 106 106 ALA N N 106 121.165 121.165 121.735 -0.570 18792 4511 1 6 . 1 1 106 106 ALA C C 106 178.284 178.284 178.778 -0.494 18792 4512 1 6 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.410 0.188 18792 4513 1 6 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.572 -1.057 18792 4514 1 6 . 1 1 106 106 ALA H H 106 7.529 7.529 7.897 -0.368 18792 4515 1 6 . 1 1 107 107 PHE N N 107 119.242 119.242 121.245 -2.003 18792 4516 1 6 . 1 1 107 107 PHE C C 107 176.390 176.390 176.774 -0.384 18792 4517 1 6 . 1 1 107 107 PHE CA C 107 60.173 60.173 61.604 -1.431 18792 4518 1 6 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.020 -1.933 18792 4519 1 6 . 1 1 107 107 PHE H H 107 7.974 7.974 7.762 0.212 18792 4520 1 6 . 1 1 108 108 PHE N N 108 120.009 120.009 116.502 3.507 18792 4521 1 6 . 1 1 108 108 PHE C C 108 177.640 177.640 176.886 0.754 18792 4522 1 6 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.176 2.248 18792 4523 1 6 . 1 1 108 108 PHE CB C 108 35.346 35.346 37.224 -1.878 18792 4524 1 6 . 1 1 108 108 PHE H H 108 7.946 7.946 7.861 0.085 18792 4525 1 6 . 1 1 109 109 SER N N 109 114.631 114.631 115.171 -0.540 18792 4526 1 6 . 1 1 109 109 SER C C 109 177.770 177.770 176.300 1.470 18792 4527 1 6 . 1 1 109 109 SER CA C 109 63.349 63.349 61.554 1.795 18792 4528 1 6 . 1 1 109 109 SER H H 109 8.424 8.424 7.238 1.186 18792 4529 1 6 . 1 1 110 110 PHE N N 110 124.230 124.230 123.452 0.778 18792 4530 1 6 . 1 1 110 110 PHE C C 110 176.708 176.708 176.871 -0.163 18792 4531 1 6 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.237 0.377 18792 4532 1 6 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.961 -1.516 18792 4533 1 6 . 1 1 110 110 PHE H H 110 9.052 9.052 8.628 0.424 18792 4534 1 6 . 1 1 111 111 GLY N N 111 105.893 105.893 106.081 -0.188 18792 4535 1 6 . 1 1 111 111 GLY C C 111 176.795 176.795 175.716 1.079 18792 4536 1 6 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.516 0.860 18792 4537 1 6 . 1 1 111 111 GLY H H 111 7.926 7.926 8.274 -0.348 18792 4538 1 6 . 1 1 112 112 GLY N N 112 107.410 107.410 109.022 -1.612 18792 4539 1 6 . 1 1 112 112 GLY C C 112 174.650 174.650 175.383 -0.733 18792 4540 1 6 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.129 1.176 18792 4541 1 6 . 1 1 112 112 GLY H H 112 8.799 8.799 7.567 1.232 18792 4542 1 6 . 1 1 113 113 ALA N N 113 124.313 124.313 125.294 -0.981 18792 4543 1 6 . 1 1 113 113 ALA C C 113 181.300 181.300 179.448 1.852 18792 4544 1 6 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.919 -0.392 18792 4545 1 6 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.275 -0.792 18792 4546 1 6 . 1 1 113 113 ALA H H 113 8.212 8.212 7.631 0.581 18792 4547 1 6 . 1 1 114 114 LEU N N 114 118.878 118.878 118.674 0.204 18792 4548 1 6 . 1 1 114 114 LEU C C 114 180.286 180.286 179.058 1.228 18792 4549 1 6 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.819 -0.837 18792 4550 1 6 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.336 -0.319 18792 4551 1 6 . 1 1 114 114 LEU H H 114 8.161 8.161 7.859 0.302 18792 4552 1 6 . 1 1 115 115 CYS N N 115 119.002 119.002 118.296 0.706 18792 4553 1 6 . 1 1 115 115 CYS C C 115 176.087 176.087 177.260 -1.173 18792 4554 1 6 . 1 1 115 115 CYS CA C 115 63.944 63.944 64.183 -0.239 18792 4555 1 6 . 1 1 115 115 CYS CB C 115 25.635 25.635 26.562 -0.927 18792 4556 1 6 . 1 1 115 115 CYS H H 115 8.070 8.070 7.700 0.370 18792 4557 1 6 . 1 1 116 116 VAL N N 116 118.737 118.737 120.747 -2.010 18792 4558 1 6 . 1 1 116 116 VAL C C 116 177.494 177.494 178.497 -1.003 18792 4559 1 6 . 1 1 116 116 VAL CA C 116 66.762 66.762 67.187 -0.425 18792 4560 1 6 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.844 -1.081 18792 4561 1 6 . 1 1 116 116 VAL H H 116 7.995 7.995 8.475 -0.480 18792 4562 1 6 . 1 1 117 117 GLU N N 117 118.886 118.886 119.389 -0.503 18792 4563 1 6 . 1 1 117 117 GLU C C 117 178.424 178.424 178.776 -0.352 18792 4564 1 6 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.529 -0.769 18792 4565 1 6 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.413 -1.359 18792 4566 1 6 . 1 1 117 117 GLU H H 117 8.059 8.059 8.408 -0.349 18792 4567 1 6 . 1 1 118 118 SER N N 118 113.417 113.417 114.998 -1.581 18792 4568 1 6 . 1 1 118 118 SER C C 118 175.607 175.607 176.854 -1.247 18792 4569 1 6 . 1 1 118 118 SER CA C 118 62.638 62.638 61.191 1.447 18792 4570 1 6 . 1 1 118 118 SER CB C 118 61.061 61.061 63.156 -2.095 18792 4571 1 6 . 1 1 118 118 SER H H 118 7.626 7.626 7.622 0.004 18792 4572 1 6 . 1 1 119 119 VAL N N 119 120.612 120.612 121.552 -0.940 18792 4573 1 6 . 1 1 119 119 VAL C C 119 179.713 179.713 178.147 1.566 18792 4574 1 6 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.768 0.457 18792 4575 1 6 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.167 -1.088 18792 4576 1 6 . 1 1 119 119 VAL H H 119 7.297 7.297 7.804 -0.507 18792 4577 1 6 . 1 1 120 120 ASP N N 120 122.546 122.546 120.647 1.899 18792 4578 1 6 . 1 1 120 120 ASP C C 120 178.057 178.057 177.191 0.866 18792 4579 1 6 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.528 0.461 18792 4580 1 6 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.831 -0.908 18792 4581 1 6 . 1 1 120 120 ASP H H 120 8.264 8.264 8.051 0.213 18792 4582 1 6 . 1 1 121 121 LYS N N 121 115.636 115.636 117.050 -1.414 18792 4583 1 6 . 1 1 121 121 LYS C C 121 175.159 175.159 176.593 -1.434 18792 4584 1 6 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.243 -0.983 18792 4585 1 6 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.234 -2.459 18792 4586 1 6 . 1 1 121 121 LYS H H 121 7.558 7.558 7.442 0.116 18792 4587 1 6 . 1 1 122 122 GLU N N 122 113.915 113.915 116.107 -2.192 18792 4588 1 6 . 1 1 122 122 GLU C C 122 176.109 176.109 176.105 0.004 18792 4589 1 6 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.020 -0.713 18792 4590 1 6 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.631 -2.299 18792 4591 1 6 . 1 1 122 122 GLU H H 122 7.826 7.826 7.849 -0.023 18792 4592 1 6 . 1 1 124 124 GLN N N 124 119.233 119.233 119.827 -0.594 18792 4593 1 6 . 1 1 124 124 GLN C C 124 177.640 177.640 176.825 0.815 18792 4594 1 6 . 1 1 124 124 GLN CA C 124 59.472 59.472 56.680 2.792 18792 4595 1 6 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.909 -2.419 18792 4596 1 6 . 1 1 124 124 GLN H H 124 8.626 8.626 8.309 0.317 18792 4597 1 6 . 1 1 125 125 VAL N N 125 117.011 117.011 112.287 4.724 18792 4598 1 6 . 1 1 125 125 VAL C C 125 175.826 175.826 175.831 -0.005 18792 4599 1 6 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.439 -0.303 18792 4600 1 6 . 1 1 125 125 VAL CB C 125 30.297 30.297 29.252 1.045 18792 4601 1 6 . 1 1 125 125 VAL H H 125 7.870 7.870 8.538 -0.668 18792 4602 1 6 . 1 1 126 126 LEU N N 126 117.058 117.058 113.846 3.212 18792 4603 1 6 . 1 1 126 126 LEU C C 126 178.096 178.096 177.746 0.350 18792 4604 1 6 . 1 1 126 126 LEU CA C 126 55.085 55.085 55.804 -0.719 18792 4605 1 6 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.381 -2.108 18792 4606 1 6 . 1 1 126 126 LEU H H 126 7.747 7.747 7.592 0.155 18792 4607 1 6 . 1 1 127 127 VAL N N 127 119.457 119.457 122.453 -2.996 18792 4608 1 6 . 1 1 127 127 VAL C C 127 177.150 177.150 177.844 -0.694 18792 4609 1 6 . 1 1 127 127 VAL CA C 127 67.156 67.156 67.109 0.047 18792 4610 1 6 . 1 1 127 127 VAL CB C 127 29.753 29.753 31.177 -1.423 18792 4611 1 6 . 1 1 127 127 VAL H H 127 7.306 7.306 7.927 -0.621 18792 4612 1 6 . 1 1 128 128 SER N N 128 110.647 110.647 111.934 -1.287 18792 4613 1 6 . 1 1 128 128 SER C C 128 177.222 177.222 176.373 0.849 18792 4614 1 6 . 1 1 128 128 SER CA C 128 60.752 60.752 61.116 -0.364 18792 4615 1 6 . 1 1 128 128 SER CB C 128 61.605 61.605 62.825 -1.220 18792 4616 1 6 . 1 1 128 128 SER H H 128 8.237 8.237 8.527 -0.290 18792 4617 1 6 . 1 1 129 129 ARG N N 129 123.100 123.100 122.059 1.041 18792 4618 1 6 . 1 1 129 129 ARG C C 129 175.802 175.802 178.763 -2.961 18792 4619 1 6 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.489 -0.262 18792 4620 1 6 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.073 -1.874 18792 4621 1 6 . 1 1 129 129 ARG H H 129 6.564 6.564 7.707 -1.143 18792 4622 1 6 . 1 1 130 130 ILE N N 130 118.182 118.182 117.950 0.232 18792 4623 1 6 . 1 1 130 130 ILE C C 130 178.156 178.156 177.857 0.299 18792 4624 1 6 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.108 -0.762 18792 4625 1 6 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.480 -0.798 18792 4626 1 6 . 1 1 130 130 ILE H H 130 7.955 7.955 8.657 -0.702 18792 4627 1 6 . 1 1 131 131 ALA N N 131 119.029 119.029 121.977 -2.948 18792 4628 1 6 . 1 1 131 131 ALA C C 131 179.593 179.593 179.295 0.298 18792 4629 1 6 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.068 -0.470 18792 4630 1 6 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.060 -0.672 18792 4631 1 6 . 1 1 131 131 ALA H H 131 7.582 7.582 8.509 -0.927 18792 4632 1 6 . 1 1 132 132 ALA N N 132 120.336 120.336 122.134 -1.798 18792 4633 1 6 . 1 1 132 132 ALA C C 132 181.095 181.095 179.755 1.340 18792 4634 1 6 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.744 -0.146 18792 4635 1 6 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.467 -1.766 18792 4636 1 6 . 1 1 132 132 ALA H H 132 7.224 7.224 7.803 -0.579 18792 4637 1 6 . 1 1 133 133 TRP N N 133 121.194 121.194 121.155 0.039 18792 4638 1 6 . 1 1 133 133 TRP C C 133 179.698 179.698 178.677 1.021 18792 4639 1 6 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.339 -3.037 18792 4640 1 6 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.963 -2.308 18792 4641 1 6 . 1 1 133 133 TRP H H 133 8.925 8.925 8.793 0.132 18792 4642 1 6 . 1 1 134 134 MET N N 134 116.987 116.987 118.179 -1.192 18792 4643 1 6 . 1 1 134 134 MET C C 134 178.277 178.277 178.441 -0.164 18792 4644 1 6 . 1 1 134 134 MET CA C 134 59.578 59.578 57.817 1.761 18792 4645 1 6 . 1 1 134 134 MET CB C 134 33.559 33.559 32.031 1.528 18792 4646 1 6 . 1 1 134 134 MET H H 134 8.863 8.863 8.391 0.472 18792 4647 1 6 . 1 1 135 135 ALA N N 135 120.523 120.523 121.379 -0.856 18792 4648 1 6 . 1 1 135 135 ALA C C 135 179.298 179.298 179.624 -0.326 18792 4649 1 6 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.483 -0.050 18792 4650 1 6 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.369 -1.732 18792 4651 1 6 . 1 1 135 135 ALA H H 135 8.152 8.152 8.446 -0.294 18792 4652 1 6 . 1 1 136 136 THR N N 136 116.715 116.715 114.241 2.474 18792 4653 1 6 . 1 1 136 136 THR C C 136 175.106 175.106 176.423 -1.317 18792 4654 1 6 . 1 1 136 136 THR CA C 136 66.729 66.729 66.290 0.439 18792 4655 1 6 . 1 1 136 136 THR CB C 136 68.441 68.441 68.717 -0.276 18792 4656 1 6 . 1 1 136 136 THR H H 136 8.532 8.532 8.254 0.278 18792 4657 1 6 . 1 1 137 137 TYR N N 137 123.204 123.204 122.215 0.989 18792 4658 1 6 . 1 1 137 137 TYR C C 137 179.592 179.592 178.380 1.212 18792 4659 1 6 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.828 1.237 18792 4660 1 6 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.858 0.130 18792 4661 1 6 . 1 1 137 137 TYR H H 137 8.809 8.809 7.688 1.121 18792 4662 1 6 . 1 1 138 138 LEU N N 138 119.247 119.247 120.683 -1.436 18792 4663 1 6 . 1 1 138 138 LEU C C 138 178.385 178.385 178.146 0.239 18792 4664 1 6 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.078 0.860 18792 4665 1 6 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.934 -0.226 18792 4666 1 6 . 1 1 138 138 LEU H H 138 8.742 8.742 8.393 0.349 18792 4667 1 6 . 1 1 139 139 ASN N N 139 117.122 117.122 115.617 1.505 18792 4668 1 6 . 1 1 139 139 ASN C C 139 176.417 176.417 176.691 -0.274 18792 4669 1 6 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.192 1.256 18792 4670 1 6 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.697 -0.045 18792 4671 1 6 . 1 1 139 139 ASN H H 139 8.307 8.307 7.908 0.399 18792 4672 1 6 . 1 1 140 140 ASP N N 140 115.394 115.394 119.149 -3.755 18792 4673 1 6 . 1 1 140 140 ASP C C 140 177.919 177.919 177.119 0.800 18792 4674 1 6 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.678 -0.725 18792 4675 1 6 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.128 -1.742 18792 4676 1 6 . 1 1 140 140 ASP H H 140 8.439 8.439 8.228 0.211 18792 4677 1 6 . 1 1 141 141 HIS N N 141 111.695 111.695 113.350 -1.655 18792 4678 1 6 . 1 1 141 141 HIS C C 141 175.949 175.949 176.262 -0.313 18792 4679 1 6 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.905 -0.848 18792 4680 1 6 . 1 1 141 141 HIS CB C 141 29.908 29.908 33.196 -3.288 18792 4681 1 6 . 1 1 141 141 HIS H H 141 8.043 8.043 7.631 0.412 18792 4682 1 6 . 1 1 142 142 LEU N N 142 117.054 117.054 122.268 -5.214 18792 4683 1 6 . 1 1 142 142 LEU C C 142 176.530 176.530 177.975 -1.445 18792 4684 1 6 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.148 -2.839 18792 4685 1 6 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.952 0.386 18792 4686 1 6 . 1 1 142 142 LEU H H 142 7.198 7.198 8.230 -1.032 18792 4687 1 6 . 1 1 143 143 GLU N N 143 121.335 121.335 120.289 1.046 18792 4688 1 6 . 1 1 143 143 GLU C C 143 173.964 173.964 175.486 -1.522 18792 4689 1 6 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.430 -0.176 18792 4690 1 6 . 1 1 143 143 GLU CB C 143 26.257 26.257 27.516 -1.259 18792 4691 1 6 . 1 1 143 143 GLU H H 143 8.565 8.565 7.974 0.591 18792 4692 1 6 . 1 1 145 145 TRP N N 145 117.973 117.973 120.035 -2.062 18792 4693 1 6 . 1 1 145 145 TRP C C 145 179.526 179.526 177.465 2.061 18792 4694 1 6 . 1 1 145 145 TRP CA C 145 61.606 61.606 59.405 2.201 18792 4695 1 6 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.874 -1.986 18792 4696 1 6 . 1 1 145 145 TRP H H 145 7.078 7.078 8.138 -1.060 18792 4697 1 6 . 1 1 146 146 ILE N N 146 122.101 122.101 111.546 10.555 18792 4698 1 6 . 1 1 146 146 ILE C C 146 179.110 179.110 177.359 1.751 18792 4699 1 6 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.257 4.077 18792 4700 1 6 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.593 -0.771 18792 4701 1 6 . 1 1 146 146 ILE H H 146 8.389 8.389 7.581 0.808 18792 4702 1 6 . 1 1 147 147 GLN N N 147 116.344 116.344 121.636 -5.292 18792 4703 1 6 . 1 1 147 147 GLN C C 147 179.526 179.526 177.535 1.991 18792 4704 1 6 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.377 -0.364 18792 4705 1 6 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.695 -0.972 18792 4706 1 6 . 1 1 147 147 GLN H H 147 8.376 8.376 8.160 0.216 18792 4707 1 6 . 1 1 148 148 GLU N N 148 118.913 118.913 120.299 -1.386 18792 4708 1 6 . 1 1 148 148 GLU C C 148 176.880 176.880 178.526 -1.646 18792 4709 1 6 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.026 -2.653 18792 4710 1 6 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.457 -1.025 18792 4711 1 6 . 1 1 148 148 GLU H H 148 7.504 7.504 7.841 -0.337 18792 4712 1 6 . 1 1 149 149 ASN N N 149 116.616 116.616 114.025 2.591 18792 4713 1 6 . 1 1 149 149 ASN C C 149 173.964 173.964 176.843 -2.879 18792 4714 1 6 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.629 -0.383 18792 4715 1 6 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.768 -2.635 18792 4716 1 6 . 1 1 149 149 ASN H H 149 7.070 7.070 8.084 -1.014 18792 4717 1 6 . 1 1 150 150 GLY N N 150 104.750 104.750 106.229 -1.479 18792 4718 1 6 . 1 1 150 150 GLY C C 150 176.022 176.022 174.172 1.850 18792 4719 1 6 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.572 -0.330 18792 4720 1 6 . 1 1 150 150 GLY H H 150 7.313 7.313 8.070 -0.757 18792 4721 1 6 . 1 1 151 151 GLY N N 151 108.385 108.385 107.198 1.187 18792 4722 1 6 . 1 1 151 151 GLY C C 151 173.449 173.449 175.696 -2.247 18792 4723 1 6 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.377 -1.345 18792 4724 1 6 . 1 1 151 151 GLY H H 151 8.452 8.452 7.455 0.997 18792 4725 1 6 . 1 1 152 152 TRP N N 152 118.092 118.092 121.872 -3.780 18792 4726 1 6 . 1 1 152 152 TRP C C 152 178.571 178.571 178.405 0.166 18792 4727 1 6 . 1 1 152 152 TRP CA C 152 60.077 60.077 60.539 -0.462 18792 4728 1 6 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.423 -0.835 18792 4729 1 6 . 1 1 152 152 TRP H H 152 8.644 8.644 9.252 -0.608 18792 4730 1 6 . 1 1 153 153 ASP N N 153 117.758 117.758 118.422 -0.664 18792 4731 1 6 . 1 1 153 153 ASP C C 153 179.796 179.796 178.721 1.075 18792 4732 1 6 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.922 -0.620 18792 4733 1 6 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.129 -1.898 18792 4734 1 6 . 1 1 153 153 ASP H H 153 8.827 8.827 8.396 0.431 18792 4735 1 6 . 1 1 154 154 THR N N 154 116.817 116.817 117.316 -0.499 18792 4736 1 6 . 1 1 154 154 THR C C 154 175.352 175.352 176.218 -0.866 18792 4737 1 6 . 1 1 154 154 THR CA C 154 65.910 65.910 66.481 -0.571 18792 4738 1 6 . 1 1 154 154 THR CB C 154 67.712 67.712 68.877 -1.165 18792 4739 1 6 . 1 1 154 154 THR H H 154 7.494 7.494 7.497 -0.003 18792 4740 1 6 . 1 1 155 155 PHE N N 155 122.196 122.196 121.782 0.414 18792 4741 1 6 . 1 1 155 155 PHE C C 155 176.831 176.831 177.549 -0.718 18792 4742 1 6 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.448 -0.162 18792 4743 1 6 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.445 -1.778 18792 4744 1 6 . 1 1 155 155 PHE H H 155 6.477 6.477 8.715 -2.238 18792 4745 1 6 . 1 1 156 156 VAL N N 156 117.387 117.387 118.799 -1.412 18792 4746 1 6 . 1 1 156 156 VAL C C 156 178.497 178.497 178.349 0.148 18792 4747 1 6 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.710 -0.479 18792 4748 1 6 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.096 -0.411 18792 4749 1 6 . 1 1 156 156 VAL H H 156 7.788 7.788 8.214 -0.426 18792 4750 1 6 . 1 1 157 157 GLU N N 157 119.876 119.876 120.385 -0.509 18792 4751 1 6 . 1 1 157 157 GLU C C 157 178.399 178.399 177.806 0.593 18792 4752 1 6 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.416 -0.656 18792 4753 1 6 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.707 -1.430 18792 4754 1 6 . 1 1 157 157 GLU H H 157 7.409 7.409 8.026 -0.617 18792 4755 1 6 . 1 1 158 158 LEU N N 158 117.194 117.194 119.263 -2.069 18792 4756 1 6 . 1 1 158 158 LEU C C 158 178.595 178.595 179.211 -0.616 18792 4757 1 6 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.653 -1.276 18792 4758 1 6 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.440 0.132 18792 4759 1 6 . 1 1 158 158 LEU H H 158 7.584 7.584 7.755 -0.171 18792 4760 1 6 . 1 1 159 159 TYR N N 159 115.549 115.549 120.436 -4.887 18792 4761 1 6 . 1 1 159 159 TYR C C 159 177.032 177.032 177.232 -0.200 18792 4762 1 6 . 1 1 159 159 TYR CA C 159 59.116 59.116 60.012 -0.896 18792 4763 1 6 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.727 -1.128 18792 4764 1 6 . 1 1 159 159 TYR H H 159 8.099 8.099 8.705 -0.606 18792 4765 1 6 . 1 1 160 160 GLY N N 160 108.334 108.334 105.539 2.795 18792 4766 1 6 . 1 1 160 160 GLY C C 160 173.973 173.973 173.734 0.239 18792 4767 1 6 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.573 0.491 18792 4768 1 6 . 1 1 160 160 GLY H H 160 8.020 8.020 8.004 0.016 18792 4769 1 6 . 1 1 161 161 ASN N N 161 118.189 118.189 118.370 -0.181 18792 4770 1 6 . 1 1 161 161 ASN C C 161 175.513 175.513 173.227 2.286 18792 4771 1 6 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.240 -1.136 18792 4772 1 6 . 1 1 161 161 ASN CB C 161 38.203 38.203 38.611 -0.408 18792 4773 1 6 . 1 1 161 161 ASN H H 161 8.327 8.327 7.743 0.584 18792 4774 1 6 . 1 1 162 162 ASN N N 162 119.022 119.022 117.488 1.534 18792 4775 1 6 . 1 1 162 162 ASN C C 162 175.690 175.690 174.390 1.300 18792 4776 1 6 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.312 0.112 18792 4777 1 6 . 1 1 162 162 ASN CB C 162 38.203 38.203 40.371 -2.168 18792 4778 1 6 . 1 1 162 162 ASN H H 162 8.363 8.363 8.348 0.015 18792 4779 1 6 . 1 1 163 163 ALA N N 163 123.275 123.275 126.457 -3.182 18792 4780 1 6 . 1 1 163 163 ALA C C 163 178.598 178.598 178.527 0.071 18792 4781 1 6 . 1 1 163 163 ALA CA C 163 53.238 53.238 54.455 -1.217 18792 4782 1 6 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.342 -1.731 18792 4783 1 6 . 1 1 163 163 ALA H H 163 8.103 8.103 8.651 -0.548 18792 4784 1 6 . 1 1 164 164 ALA N N 164 121.521 121.521 119.679 1.842 18792 4785 1 6 . 1 1 164 164 ALA C C 164 178.642 178.642 178.076 0.566 18792 4786 1 6 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.033 -1.449 18792 4787 1 6 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.523 -0.704 18792 4788 1 6 . 1 1 164 164 ALA H H 164 8.053 8.053 8.506 -0.453 18792 4789 1 6 . 1 1 165 165 ALA N N 165 122.101 122.101 119.253 2.848 18792 4790 1 6 . 1 1 165 165 ALA C C 165 179.124 179.124 179.408 -0.284 18792 4791 1 6 . 1 1 165 165 ALA CA C 165 53.139 53.139 52.930 0.209 18792 4792 1 6 . 1 1 165 165 ALA CB C 165 17.978 17.978 19.212 -1.234 18792 4793 1 6 . 1 1 165 165 ALA H H 165 7.949 7.949 7.867 0.082 18792 4794 1 6 . 1 1 166 166 GLU N N 166 118.381 118.381 119.351 -0.970 18792 4795 1 6 . 1 1 166 166 GLU C C 166 177.664 177.664 177.850 -0.186 18792 4796 1 6 . 1 1 166 166 GLU CA C 166 57.088 57.088 58.852 -1.764 18792 4797 1 6 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.164 -0.810 18792 4798 1 6 . 1 1 166 166 GLU H H 166 8.202 8.202 8.027 0.175 18792 4799 1 6 . 1 1 167 167 SER N N 167 115.193 115.193 115.558 -0.365 18792 4800 1 6 . 1 1 167 167 SER C C 167 175.312 175.312 174.981 0.331 18792 4801 1 6 . 1 1 167 167 SER CA C 167 58.831 58.831 60.587 -1.756 18792 4802 1 6 . 1 1 167 167 SER CB C 167 62.537 62.537 63.513 -0.976 18792 4803 1 6 . 1 1 167 167 SER H H 167 8.029 8.029 7.590 0.439 18792 4804 1 6 . 1 1 168 168 ARG N N 168 121.696 121.696 119.125 2.571 18792 4805 1 6 . 1 1 168 168 ARG C C 168 176.880 176.880 175.135 1.745 18792 4806 1 6 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.515 -0.352 18792 4807 1 6 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.698 -0.489 18792 4808 1 6 . 1 1 168 168 ARG H H 168 7.967 7.967 8.096 -0.129 18792 4809 1 6 . 1 1 169 169 LYS N N 169 120.917 120.917 115.558 5.359 18792 4810 1 6 . 1 1 169 169 LYS C C 169 177.640 177.640 175.341 2.299 18792 4811 1 6 . 1 1 169 169 LYS CA C 169 56.697 56.697 57.103 -0.406 18792 4812 1 6 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.565 -1.103 18792 4813 1 6 . 1 1 169 169 LYS H H 169 8.011 8.011 8.063 -0.052 18792 4814 1 6 . 1 1 170 170 GLY N N 170 109.155 109.155 109.048 0.107 18792 4815 1 6 . 1 1 170 170 GLY C C 170 174.479 174.479 172.821 1.658 18792 4816 1 6 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.318 -0.254 18792 4817 1 6 . 1 1 170 170 GLY H H 170 8.329 8.329 8.348 -0.019 18792 4818 1 6 . 1 1 171 171 GLN N N 171 119.292 119.292 122.433 -3.141 18792 4819 1 6 . 1 1 171 171 GLN C C 171 176.463 176.463 174.662 1.801 18792 4820 1 6 . 1 1 171 171 GLN CA C 171 55.666 55.666 54.983 0.683 18792 4821 1 6 . 1 1 171 171 GLN CB C 171 28.199 28.199 29.765 -1.566 18792 4822 1 6 . 1 1 171 171 GLN H H 171 8.035 8.035 8.226 -0.191 18792 4823 1 6 . 1 1 172 172 GLU N N 172 121.703 121.703 119.488 2.215 18792 4824 1 6 . 1 1 172 172 GLU C C 172 176.414 176.414 175.278 1.136 18792 4825 1 6 . 1 1 172 172 GLU CA C 172 56.341 56.341 56.591 -0.250 18792 4826 1 6 . 1 1 172 172 GLU CB C 172 28.821 28.821 29.980 -1.159 18792 4827 1 6 . 1 1 172 172 GLU H H 172 8.405 8.405 8.349 0.056 18792 4828 1 6 . 1 1 173 173 ARG N N 173 121.852 121.852 121.469 0.383 18792 4829 1 6 . 1 1 173 173 ARG C C 173 176.365 176.365 174.647 1.718 18792 4830 1 6 . 1 1 173 173 ARG CA C 173 56.199 56.199 56.206 -0.007 18792 4831 1 6 . 1 1 173 173 ARG CB C 173 29.131 29.131 30.992 -1.861 18792 4832 1 6 . 1 1 173 173 ARG H H 173 8.335 8.335 8.392 -0.057 18792 4833 1 6 . 1 1 174 174 LEU N N 174 122.640 122.640 118.965 3.675 18792 4834 1 6 . 1 1 174 174 LEU C C 174 176.523 176.523 176.372 0.151 18792 4835 1 6 . 1 1 174 174 LEU CA C 174 54.768 54.768 56.672 -1.904 18792 4836 1 6 . 1 1 174 174 LEU CB C 174 40.784 40.784 41.764 -0.980 18792 4837 1 6 . 1 1 174 174 LEU H H 174 8.082 8.082 8.217 -0.135 18792 4838 1 6 . 1 1 175 175 GLU N N 175 125.909 125.909 118.181 7.728 18792 4839 1 6 . 1 1 175 175 GLU C C 175 181.029 181.029 176.139 4.890 18792 4840 1 6 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.617 0.781 18792 4841 1 6 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.249 -1.199 18792 4842 1 6 . 1 1 175 175 GLU H H 175 7.785 7.785 8.754 -0.969 18792 4843 1 7 . 1 1 4 4 ALA N N 4 124.786 124.786 123.982 0.804 18792 4844 1 7 . 1 1 4 4 ALA C C 4 178.272 178.272 179.778 -1.506 18792 4845 1 7 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.497 -1.931 18792 4846 1 7 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.838 -0.604 18792 4847 1 7 . 1 1 4 4 ALA H H 4 8.414 8.414 8.714 -0.300 18792 4848 1 7 . 1 1 5 5 MET N N 5 119.681 119.681 118.161 1.520 18792 4849 1 7 . 1 1 5 5 MET C C 5 176.929 176.929 178.050 -1.121 18792 4850 1 7 . 1 1 5 5 MET CA C 5 55.594 55.594 58.004 -2.410 18792 4851 1 7 . 1 1 5 5 MET CB C 5 31.540 31.540 32.315 -0.775 18792 4852 1 7 . 1 1 5 5 MET H H 5 8.336 8.336 8.238 0.098 18792 4853 1 7 . 1 1 6 6 SER N N 6 116.162 116.162 115.141 1.021 18792 4854 1 7 . 1 1 6 6 SER C C 6 175.924 175.924 176.981 -1.057 18792 4855 1 7 . 1 1 6 6 SER CA C 6 59.009 59.009 62.261 -3.252 18792 4856 1 7 . 1 1 6 6 SER CB C 6 62.537 62.537 62.943 -0.406 18792 4857 1 7 . 1 1 6 6 SER H H 6 8.272 8.272 7.812 0.460 18792 4858 1 7 . 1 1 7 7 GLN N N 7 122.263 122.263 119.436 2.827 18792 4859 1 7 . 1 1 7 7 GLN C C 7 177.027 177.027 178.146 -1.119 18792 4860 1 7 . 1 1 7 7 GLN CA C 7 56.270 56.270 59.102 -2.832 18792 4861 1 7 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.426 -0.687 18792 4862 1 7 . 1 1 7 7 GLN H H 7 8.314 8.314 8.013 0.301 18792 4863 1 7 . 1 1 8 8 SER N N 8 116.625 116.625 116.427 0.198 18792 4864 1 7 . 1 1 8 8 SER C C 8 176.457 176.457 176.341 0.116 18792 4865 1 7 . 1 1 8 8 SER CA C 8 59.650 59.650 62.027 -2.377 18792 4866 1 7 . 1 1 8 8 SER CB C 8 62.226 62.226 62.562 -0.336 18792 4867 1 7 . 1 1 8 8 SER H H 8 8.333 8.333 7.708 0.625 18792 4868 1 7 . 1 1 9 9 ASN N N 9 121.307 121.307 120.502 0.805 18792 4869 1 7 . 1 1 9 9 ASN C C 9 177.419 177.419 177.324 0.095 18792 4870 1 7 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.282 -0.795 18792 4871 1 7 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.875 -1.742 18792 4872 1 7 . 1 1 9 9 ASN H H 9 8.611 8.611 8.214 0.397 18792 4873 1 7 . 1 1 10 10 ARG N N 10 119.830 119.830 120.525 -0.695 18792 4874 1 7 . 1 1 10 10 ARG C C 10 177.615 177.615 178.449 -0.834 18792 4875 1 7 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.609 -0.351 18792 4876 1 7 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.367 -2.168 18792 4877 1 7 . 1 1 10 10 ARG H H 10 7.996 7.996 7.989 0.007 18792 4878 1 7 . 1 1 11 11 GLU N N 11 117.270 117.270 119.357 -2.087 18792 4879 1 7 . 1 1 11 11 GLU C C 11 179.649 179.649 178.725 0.924 18792 4880 1 7 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.299 -0.290 18792 4881 1 7 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.292 -1.171 18792 4882 1 7 . 1 1 11 11 GLU H H 11 7.885 7.885 8.304 -0.419 18792 4883 1 7 . 1 1 12 12 LEU N N 12 119.900 119.900 120.563 -0.663 18792 4884 1 7 . 1 1 12 12 LEU C C 12 178.473 178.473 178.753 -0.280 18792 4885 1 7 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.501 -0.808 18792 4886 1 7 . 1 1 12 12 LEU CB C 12 40.629 40.629 42.053 -1.424 18792 4887 1 7 . 1 1 12 12 LEU H H 12 7.691 7.691 7.920 -0.229 18792 4888 1 7 . 1 1 13 13 VAL N N 13 117.320 117.320 118.916 -1.596 18792 4889 1 7 . 1 1 13 13 VAL C C 13 177.272 177.272 178.281 -1.009 18792 4890 1 7 . 1 1 13 13 VAL CA C 13 67.156 67.156 67.466 -0.310 18792 4891 1 7 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.740 -0.511 18792 4892 1 7 . 1 1 13 13 VAL H H 13 7.629 7.629 7.747 -0.118 18792 4893 1 7 . 1 1 14 14 VAL N N 14 116.659 116.659 119.609 -2.950 18792 4894 1 7 . 1 1 14 14 VAL C C 14 178.718 178.718 178.146 0.572 18792 4895 1 7 . 1 1 14 14 VAL CA C 14 66.516 66.516 65.950 0.566 18792 4896 1 7 . 1 1 14 14 VAL CB C 14 30.374 30.374 30.686 -0.312 18792 4897 1 7 . 1 1 14 14 VAL H H 14 8.210 8.210 7.641 0.569 18792 4898 1 7 . 1 1 15 15 ASP N N 15 120.374 120.374 121.991 -1.617 18792 4899 1 7 . 1 1 15 15 ASP C C 15 177.557 177.557 178.881 -1.324 18792 4900 1 7 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.616 0.860 18792 4901 1 7 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.386 2.167 18792 4902 1 7 . 1 1 15 15 ASP H H 15 7.967 7.967 8.546 -0.579 18792 4903 1 7 . 1 1 16 16 PHE N N 16 119.864 119.864 119.932 -0.068 18792 4904 1 7 . 1 1 16 16 PHE C C 16 178.252 178.252 178.160 0.092 18792 4905 1 7 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.475 1.305 18792 4906 1 7 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.844 0.216 18792 4907 1 7 . 1 1 16 16 PHE H H 16 8.228 8.228 8.273 -0.045 18792 4908 1 7 . 1 1 17 17 LEU N N 17 116.312 116.312 119.667 -3.355 18792 4909 1 7 . 1 1 17 17 LEU C C 17 179.649 179.649 178.979 0.670 18792 4910 1 7 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.363 -0.599 18792 4911 1 7 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.556 -1.472 18792 4912 1 7 . 1 1 17 17 LEU H H 17 8.766 8.766 8.628 0.138 18792 4913 1 7 . 1 1 18 18 SER N N 18 113.715 113.715 114.531 -0.816 18792 4914 1 7 . 1 1 18 18 SER C C 18 177.362 177.362 176.451 0.911 18792 4915 1 7 . 1 1 18 18 SER CA C 18 61.948 61.948 61.145 0.803 18792 4916 1 7 . 1 1 18 18 SER CB C 18 63.003 63.003 63.399 -0.396 18792 4917 1 7 . 1 1 18 18 SER H H 18 8.384 8.384 8.292 0.092 18792 4918 1 7 . 1 1 19 19 TYR N N 19 124.570 124.570 122.951 1.619 18792 4919 1 7 . 1 1 19 19 TYR C C 19 178.415 178.415 177.202 1.213 18792 4920 1 7 . 1 1 19 19 TYR CA C 19 59.764 59.764 59.793 -0.029 18792 4921 1 7 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.623 -1.607 18792 4922 1 7 . 1 1 19 19 TYR H H 19 8.155 8.155 8.824 -0.669 18792 4923 1 7 . 1 1 20 20 LYS N N 20 119.739 119.739 120.105 -0.366 18792 4924 1 7 . 1 1 20 20 LYS C C 20 180.456 180.456 178.733 1.723 18792 4925 1 7 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.618 -3.131 18792 4926 1 7 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.245 -4.086 18792 4927 1 7 . 1 1 20 20 LYS H H 20 8.224 8.224 8.209 0.015 18792 4928 1 7 . 1 1 21 21 LEU N N 21 118.092 118.092 119.850 -1.758 18792 4929 1 7 . 1 1 21 21 LEU C C 21 179.989 179.989 178.706 1.283 18792 4930 1 7 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.202 -0.076 18792 4931 1 7 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.543 -1.935 18792 4932 1 7 . 1 1 21 21 LEU H H 21 8.586 8.586 7.707 0.879 18792 4933 1 7 . 1 1 22 22 SER N N 22 117.304 117.304 113.634 3.670 18792 4934 1 7 . 1 1 22 22 SER C C 22 180.152 180.152 176.741 3.411 18792 4935 1 7 . 1 1 22 22 SER CA C 22 61.287 61.287 60.634 0.653 18792 4936 1 7 . 1 1 22 22 SER H H 22 8.266 8.266 7.616 0.650 18792 4937 1 7 . 1 1 23 23 GLN N N 23 122.497 122.497 121.472 1.025 18792 4938 1 7 . 1 1 23 23 GLN C C 23 177.297 177.297 177.826 -0.529 18792 4939 1 7 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.264 -0.322 18792 4940 1 7 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.395 -0.584 18792 4941 1 7 . 1 1 23 23 GLN H H 23 7.571 7.571 8.161 -0.590 18792 4942 1 7 . 1 1 24 24 LYS N N 24 116.038 116.038 117.728 -1.690 18792 4943 1 7 . 1 1 24 24 LYS C C 24 175.704 175.704 176.482 -0.778 18792 4944 1 7 . 1 1 24 24 LYS CA C 24 53.495 53.495 57.398 -3.903 18792 4945 1 7 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.673 -2.444 18792 4946 1 7 . 1 1 24 24 LYS H H 24 7.134 7.134 7.707 -0.573 18792 4947 1 7 . 1 1 25 25 GLY N N 25 105.283 105.283 104.424 0.859 18792 4948 1 7 . 1 1 25 25 GLY C C 25 174.013 174.013 173.698 0.315 18792 4949 1 7 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.521 0.258 18792 4950 1 7 . 1 1 25 25 GLY H H 25 7.483 7.483 8.078 -0.595 18792 4951 1 7 . 1 1 26 26 TYR N N 26 119.547 119.547 120.269 -0.722 18792 4952 1 7 . 1 1 26 26 TYR C C 26 175.122 175.122 174.104 1.018 18792 4953 1 7 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.040 -0.908 18792 4954 1 7 . 1 1 26 26 TYR CB C 26 40.080 40.080 38.489 1.591 18792 4955 1 7 . 1 1 26 26 TYR H H 26 7.788 7.788 7.686 0.102 18792 4956 1 7 . 1 1 27 27 SER N N 27 115.088 115.088 116.360 -1.272 18792 4957 1 7 . 1 1 27 27 SER C C 27 174.452 174.452 175.083 -0.631 18792 4958 1 7 . 1 1 27 27 SER CA C 27 56.306 56.306 54.990 1.316 18792 4959 1 7 . 1 1 27 27 SER CB C 27 63.921 63.921 65.052 -1.131 18792 4960 1 7 . 1 1 27 27 SER H H 27 8.473 8.473 8.256 0.217 18792 4961 1 7 . 1 1 28 28 TRP N N 28 127.014 127.014 125.337 1.677 18792 4962 1 7 . 1 1 28 28 TRP C C 28 177.002 177.002 177.016 -0.014 18792 4963 1 7 . 1 1 28 28 TRP CA C 28 59.472 59.472 58.575 0.897 18792 4964 1 7 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.851 0.979 18792 4965 1 7 . 1 1 28 28 TRP H H 28 8.897 8.897 8.532 0.365 18792 4966 1 7 . 1 1 29 29 SER N N 29 112.044 112.044 115.244 -3.200 18792 4967 1 7 . 1 1 29 29 SER C C 29 175.106 175.106 175.370 -0.264 18792 4968 1 7 . 1 1 29 29 SER CA C 29 59.472 59.472 60.687 -1.215 18792 4969 1 7 . 1 1 29 29 SER CB C 29 62.226 62.226 63.503 -1.277 18792 4970 1 7 . 1 1 29 29 SER H H 29 8.129 8.129 8.137 -0.008 18792 4971 1 7 . 1 1 30 30 GLN N N 30 119.160 119.160 118.342 0.818 18792 4972 1 7 . 1 1 30 30 GLN C C 30 176.218 176.218 175.900 0.318 18792 4973 1 7 . 1 1 30 30 GLN CA C 30 56.412 56.412 55.777 0.635 18792 4974 1 7 . 1 1 30 30 GLN CB C 30 27.578 27.578 30.481 -2.903 18792 4975 1 7 . 1 1 30 30 GLN H H 30 7.370 7.370 7.651 -0.281 18792 4976 1 7 . 1 1 31 31 PHE N N 31 116.277 116.277 117.396 -1.119 18792 4977 1 7 . 1 1 31 31 PHE C C 31 175.217 175.217 173.491 1.726 18792 4978 1 7 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.154 -2.920 18792 4979 1 7 . 1 1 31 31 PHE CB C 31 39.066 39.066 37.991 1.075 18792 4980 1 7 . 1 1 31 31 PHE H H 31 7.248 7.248 7.884 -0.636 18792 4981 1 7 . 1 1 32 32 SER N N 32 113.683 113.683 113.698 -0.015 18792 4982 1 7 . 1 1 32 32 SER C C 32 173.793 173.793 173.064 0.729 18792 4983 1 7 . 1 1 32 32 SER CA C 32 57.124 57.124 57.063 0.061 18792 4984 1 7 . 1 1 32 32 SER CB C 32 63.081 63.081 64.795 -1.714 18792 4985 1 7 . 1 1 32 32 SER H H 32 7.242 7.242 7.512 -0.270 18792 4986 1 7 . 1 1 33 33 ASP N N 33 122.195 122.195 122.574 -0.379 18792 4987 1 7 . 1 1 33 33 ASP C C 33 176.394 176.394 175.569 0.825 18792 4988 1 7 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.050 -1.302 18792 4989 1 7 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.133 0.265 18792 4990 1 7 . 1 1 33 33 ASP H H 33 8.257 8.257 8.938 -0.681 18792 4991 1 7 . 1 1 34 34 VAL N N 34 118.913 118.913 110.446 8.467 18792 4992 1 7 . 1 1 34 34 VAL C C 34 176.328 176.328 175.007 1.321 18792 4993 1 7 . 1 1 34 34 VAL CA C 34 61.891 61.891 63.068 -1.177 18792 4994 1 7 . 1 1 34 34 VAL CB C 34 32.015 32.015 29.868 2.147 18792 4995 1 7 . 1 1 34 34 VAL H H 34 7.852 7.852 8.169 -0.317 18792 4996 1 7 . 1 1 35 35 GLU N N 35 124.205 124.205 121.788 2.417 18792 4997 1 7 . 1 1 35 35 GLU C C 35 176.586 176.586 176.890 -0.304 18792 4998 1 7 . 1 1 35 35 GLU CA C 35 56.057 56.057 58.071 -2.014 18792 4999 1 7 . 1 1 35 35 GLU CB C 35 28.898 28.898 30.370 -1.472 18792 5000 1 7 . 1 1 35 35 GLU H H 35 8.401 8.401 7.777 0.624 18792 5001 1 7 . 1 1 36 36 GLU N N 36 121.670 121.670 118.575 3.095 18792 5002 1 7 . 1 1 36 36 GLU C C 36 176.218 176.218 175.518 0.700 18792 5003 1 7 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.509 -0.521 18792 5004 1 7 . 1 1 36 36 GLU CB C 36 29.442 29.442 28.324 1.118 18792 5005 1 7 . 1 1 36 36 GLU H H 36 8.239 8.239 8.557 -0.318 18792 5006 1 7 . 1 1 37 37 ASN N N 37 119.252 119.252 120.111 -0.859 18792 5007 1 7 . 1 1 37 37 ASN C C 37 175.003 175.003 175.858 -0.855 18792 5008 1 7 . 1 1 37 37 ASN CA C 37 52.655 52.655 55.358 -2.703 18792 5009 1 7 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.001 -0.789 18792 5010 1 7 . 1 1 37 37 ASN H H 37 8.412 8.412 8.480 -0.068 18792 5011 1 7 . 1 1 38 38 ARG N N 38 121.622 121.622 115.245 6.377 18792 5012 1 7 . 1 1 38 38 ARG C C 38 176.610 176.610 174.816 1.794 18792 5013 1 7 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.059 -0.695 18792 5014 1 7 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.098 -1.679 18792 5015 1 7 . 1 1 38 38 ARG H H 38 8.227 8.227 8.126 0.101 18792 5016 1 7 . 1 1 39 39 THR N N 39 115.681 115.681 111.686 3.995 18792 5017 1 7 . 1 1 39 39 THR C C 39 174.500 174.500 174.771 -0.271 18792 5018 1 7 . 1 1 39 39 THR CA C 39 61.606 61.606 61.968 -0.362 18792 5019 1 7 . 1 1 39 39 THR CB C 39 69.163 69.163 70.447 -1.284 18792 5020 1 7 . 1 1 39 39 THR H H 39 8.173 8.173 8.308 -0.135 18792 5021 1 7 . 1 1 40 40 GLU N N 40 122.708 122.708 121.314 1.394 18792 5022 1 7 . 1 1 40 40 GLU C C 40 175.728 175.728 174.643 1.085 18792 5023 1 7 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.221 -0.450 18792 5024 1 7 . 1 1 40 40 GLU CB C 40 29.054 29.054 31.128 -2.074 18792 5025 1 7 . 1 1 40 40 GLU H H 40 8.298 8.298 8.455 -0.157 18792 5026 1 7 . 1 1 41 41 ALA N N 41 125.922 125.922 123.136 2.786 18792 5027 1 7 . 1 1 41 41 ALA C C 41 175.557 175.557 175.664 -0.107 18792 5028 1 7 . 1 1 41 41 ALA CA C 41 49.973 49.973 52.528 -2.555 18792 5029 1 7 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.093 0.152 18792 5030 1 7 . 1 1 41 41 ALA H H 41 8.212 8.212 7.967 0.245 18792 5031 1 7 . 1 1 43 43 GLU N N 43 120.783 120.783 118.918 1.865 18792 5032 1 7 . 1 1 43 43 GLU C C 43 177.174 177.174 175.398 1.776 18792 5033 1 7 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.536 -0.195 18792 5034 1 7 . 1 1 43 43 GLU CB C 43 29.287 29.287 28.176 1.111 18792 5035 1 7 . 1 1 43 43 GLU H H 43 8.519 8.519 8.679 -0.160 18792 5036 1 7 . 1 1 44 44 GLY N N 44 110.022 110.022 106.939 3.083 18792 5037 1 7 . 1 1 44 44 GLY C C 44 174.773 174.773 174.913 -0.140 18792 5038 1 7 . 1 1 44 44 GLY CA C 44 45.028 45.028 44.738 0.290 18792 5039 1 7 . 1 1 44 44 GLY H H 44 8.429 8.429 7.771 0.658 18792 5040 1 7 . 1 1 45 45 THR N N 45 112.790 112.790 114.544 -1.754 18792 5041 1 7 . 1 1 45 45 THR C C 45 175.726 175.726 175.800 -0.074 18792 5042 1 7 . 1 1 45 45 THR CA C 45 61.987 61.987 63.751 -1.764 18792 5043 1 7 . 1 1 45 45 THR CB C 45 69.304 69.304 69.119 0.185 18792 5044 1 7 . 1 1 45 45 THR H H 45 8.125 8.125 8.275 -0.150 18792 5045 1 7 . 1 1 46 46 GLU N N 46 122.752 122.752 120.687 2.065 18792 5046 1 7 . 1 1 46 46 GLU C C 46 177.419 177.419 176.786 0.633 18792 5047 1 7 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.340 0.891 18792 5048 1 7 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.047 -0.848 18792 5049 1 7 . 1 1 46 46 GLU H H 46 8.765 8.765 8.585 0.180 18792 5050 1 7 . 1 1 47 47 SER N N 47 114.895 114.895 113.222 1.673 18792 5051 1 7 . 1 1 47 47 SER C C 47 175.826 175.826 175.783 0.043 18792 5052 1 7 . 1 1 47 47 SER CA C 47 58.582 58.582 58.992 -0.410 18792 5053 1 7 . 1 1 47 47 SER CB C 47 62.537 62.537 64.934 -2.397 18792 5054 1 7 . 1 1 47 47 SER H H 47 8.355 8.355 7.818 0.537 18792 5055 1 7 . 1 1 48 48 GLU N N 48 122.429 122.429 122.152 0.277 18792 5056 1 7 . 1 1 48 48 GLU C C 48 178.099 178.099 177.576 0.523 18792 5057 1 7 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.560 -0.942 18792 5058 1 7 . 1 1 48 48 GLU CB C 48 28.475 28.475 28.783 -0.308 18792 5059 1 7 . 1 1 48 48 GLU H H 48 8.139 8.139 7.805 0.334 18792 5060 1 7 . 1 1 49 49 ALA N N 49 120.374 120.374 121.967 -1.593 18792 5061 1 7 . 1 1 49 49 ALA C C 49 180.843 180.843 179.438 1.405 18792 5062 1 7 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.980 -0.497 18792 5063 1 7 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.381 -0.946 18792 5064 1 7 . 1 1 49 49 ALA H H 49 8.079 8.079 8.441 -0.362 18792 5065 1 7 . 1 1 50 50 VAL N N 50 118.599 118.599 119.299 -0.700 18792 5066 1 7 . 1 1 50 50 VAL C C 50 176.921 176.921 177.939 -1.018 18792 5067 1 7 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.668 -0.108 18792 5068 1 7 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.288 -0.991 18792 5069 1 7 . 1 1 50 50 VAL H H 50 7.419 7.419 7.675 -0.256 18792 5070 1 7 . 1 1 51 51 LYS N N 51 117.469 117.469 120.799 -3.330 18792 5071 1 7 . 1 1 51 51 LYS C C 51 179.061 179.061 178.864 0.197 18792 5072 1 7 . 1 1 51 51 LYS CA C 51 59.223 59.223 60.089 -0.866 18792 5073 1 7 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.390 -1.394 18792 5074 1 7 . 1 1 51 51 LYS H H 51 7.359 7.359 8.628 -1.269 18792 5075 1 7 . 1 1 52 52 GLN N N 52 115.930 115.930 118.279 -2.349 18792 5076 1 7 . 1 1 52 52 GLN C C 52 177.713 177.713 178.397 -0.684 18792 5077 1 7 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.631 -0.155 18792 5078 1 7 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.743 -2.175 18792 5079 1 7 . 1 1 52 52 GLN H H 52 8.025 8.025 8.494 -0.469 18792 5080 1 7 . 1 1 53 53 ALA N N 53 119.782 119.782 122.056 -2.274 18792 5081 1 7 . 1 1 53 53 ALA C C 53 180.008 180.008 179.132 0.876 18792 5082 1 7 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.324 0.061 18792 5083 1 7 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.827 -1.312 18792 5084 1 7 . 1 1 53 53 ALA H H 53 7.655 7.655 8.262 -0.607 18792 5085 1 7 . 1 1 54 54 LEU N N 54 120.443 120.443 119.781 0.662 18792 5086 1 7 . 1 1 54 54 LEU C C 54 179.330 179.330 177.938 1.392 18792 5087 1 7 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.934 1.079 18792 5088 1 7 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.791 -0.929 18792 5089 1 7 . 1 1 54 54 LEU H H 54 8.419 8.419 8.206 0.213 18792 5090 1 7 . 1 1 55 55 ARG N N 55 118.423 118.423 119.634 -1.211 18792 5091 1 7 . 1 1 55 55 ARG C C 55 178.767 178.767 178.309 0.458 18792 5092 1 7 . 1 1 55 55 ARG CA C 55 60.397 60.397 58.672 1.726 18792 5093 1 7 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.103 -0.360 18792 5094 1 7 . 1 1 55 55 ARG H H 55 8.062 8.062 8.248 -0.186 18792 5095 1 7 . 1 1 56 56 GLU N N 56 115.988 115.988 119.748 -3.760 18792 5096 1 7 . 1 1 56 56 GLU C C 56 180.090 180.090 177.800 2.290 18792 5097 1 7 . 1 1 56 56 GLU CA C 56 58.760 58.760 58.885 -0.125 18792 5098 1 7 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.677 -1.323 18792 5099 1 7 . 1 1 56 56 GLU H H 56 7.772 7.772 8.134 -0.362 18792 5100 1 7 . 1 1 57 57 ALA N N 57 122.837 122.837 121.347 1.490 18792 5101 1 7 . 1 1 57 57 ALA C C 57 181.861 181.861 179.747 2.114 18792 5102 1 7 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.787 -0.153 18792 5103 1 7 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.535 -0.062 18792 5104 1 7 . 1 1 57 57 ALA H H 57 8.774 8.774 7.441 1.333 18792 5105 1 7 . 1 1 58 58 GLY N N 58 108.409 108.409 106.470 1.939 18792 5106 1 7 . 1 1 58 58 GLY C C 58 175.331 175.331 175.941 -0.610 18792 5107 1 7 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.851 -0.183 18792 5108 1 7 . 1 1 58 58 GLY H H 58 9.073 9.073 8.185 0.888 18792 5109 1 7 . 1 1 59 59 ASP N N 59 122.074 122.074 121.885 0.189 18792 5110 1 7 . 1 1 59 59 ASP C C 59 179.023 179.023 178.429 0.594 18792 5111 1 7 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.255 0.047 18792 5112 1 7 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.130 -2.288 18792 5113 1 7 . 1 1 59 59 ASP H H 59 8.049 8.049 8.084 -0.035 18792 5114 1 7 . 1 1 60 60 GLU N N 60 120.131 120.131 119.268 0.863 18792 5115 1 7 . 1 1 60 60 GLU C C 60 178.522 178.522 178.724 -0.202 18792 5116 1 7 . 1 1 60 60 GLU CA C 60 59.009 59.009 58.969 0.040 18792 5117 1 7 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.727 -1.528 18792 5118 1 7 . 1 1 60 60 GLU H H 60 8.136 8.136 8.615 -0.479 18792 5119 1 7 . 1 1 61 61 PHE N N 61 121.309 121.309 120.300 1.009 18792 5120 1 7 . 1 1 61 61 PHE C C 61 176.904 176.904 177.566 -0.662 18792 5121 1 7 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.453 -0.132 18792 5122 1 7 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.458 -0.849 18792 5123 1 7 . 1 1 61 61 PHE H H 61 8.523 8.523 8.296 0.227 18792 5124 1 7 . 1 1 62 62 GLU N N 62 115.971 115.971 119.622 -3.651 18792 5125 1 7 . 1 1 62 62 GLU C C 62 177.713 177.713 177.897 -0.184 18792 5126 1 7 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.903 -0.712 18792 5127 1 7 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.142 -0.865 18792 5128 1 7 . 1 1 62 62 GLU H H 62 7.969 7.969 8.515 -0.546 18792 5129 1 7 . 1 1 63 63 LEU N N 63 116.703 116.703 120.347 -3.644 18792 5130 1 7 . 1 1 63 63 LEU C C 63 178.963 178.963 179.270 -0.307 18792 5131 1 7 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.176 -0.764 18792 5132 1 7 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.160 -0.754 18792 5133 1 7 . 1 1 63 63 LEU H H 63 7.347 7.347 8.132 -0.785 18792 5134 1 7 . 1 1 64 64 ARG N N 64 117.453 117.453 119.399 -1.946 18792 5135 1 7 . 1 1 64 64 ARG C C 64 177.297 177.297 177.474 -0.177 18792 5136 1 7 . 1 1 64 64 ARG CA C 64 57.337 57.337 58.203 -0.866 18792 5137 1 7 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.539 -0.942 18792 5138 1 7 . 1 1 64 64 ARG H H 64 7.995 7.995 8.266 -0.271 18792 5139 1 7 . 1 1 65 65 TYR N N 65 118.956 118.956 118.298 0.658 18792 5140 1 7 . 1 1 65 65 TYR C C 65 175.278 175.278 175.468 -0.190 18792 5141 1 7 . 1 1 65 65 TYR CA C 65 55.701 55.701 55.959 -0.258 18792 5142 1 7 . 1 1 65 65 TYR CB C 65 35.986 35.986 37.517 -1.531 18792 5143 1 7 . 1 1 65 65 TYR H H 65 7.909 7.909 7.667 0.242 18792 5144 1 7 . 1 1 66 66 ARG N N 66 119.438 119.438 121.541 -2.103 18792 5145 1 7 . 1 1 66 66 ARG C C 66 178.424 178.424 178.076 0.348 18792 5146 1 7 . 1 1 66 66 ARG CA C 66 58.476 58.476 59.179 -0.703 18792 5147 1 7 . 1 1 66 66 ARG CB C 66 28.821 28.821 29.610 -0.789 18792 5148 1 7 . 1 1 66 66 ARG H H 66 7.244 7.244 7.479 -0.235 18792 5149 1 7 . 1 1 67 67 ARG N N 67 118.936 118.936 119.801 -0.865 18792 5150 1 7 . 1 1 67 67 ARG C C 67 177.542 177.542 177.819 -0.277 18792 5151 1 7 . 1 1 67 67 ARG CA C 67 57.444 57.444 58.944 -1.500 18792 5152 1 7 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.622 -1.501 18792 5153 1 7 . 1 1 67 67 ARG H H 67 8.417 8.417 8.166 0.251 18792 5154 1 7 . 1 1 68 68 ALA N N 68 121.797 121.797 120.303 1.494 18792 5155 1 7 . 1 1 68 68 ALA C C 68 180.337 180.337 179.048 1.289 18792 5156 1 7 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.658 -0.522 18792 5157 1 7 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.753 -1.286 18792 5158 1 7 . 1 1 68 68 ALA H H 68 7.827 7.827 7.909 -0.082 18792 5159 1 7 . 1 1 69 69 PHE N N 69 115.986 115.986 118.187 -2.201 18792 5160 1 7 . 1 1 69 69 PHE C C 69 177.468 177.468 176.796 0.672 18792 5161 1 7 . 1 1 69 69 PHE CA C 69 58.049 58.049 58.170 -0.121 18792 5162 1 7 . 1 1 69 69 PHE CB C 69 37.599 37.599 39.400 -1.801 18792 5163 1 7 . 1 1 69 69 PHE H H 69 8.517 8.517 7.792 0.725 18792 5164 1 7 . 1 1 70 70 SER N N 70 116.526 116.526 116.209 0.317 18792 5165 1 7 . 1 1 70 70 SER C C 70 177.640 177.640 176.186 1.454 18792 5166 1 7 . 1 1 70 70 SER CA C 70 61.073 61.073 61.928 -0.855 18792 5167 1 7 . 1 1 70 70 SER CB C 70 61.993 61.993 62.731 -0.738 18792 5168 1 7 . 1 1 70 70 SER H H 70 8.152 8.152 7.830 0.322 18792 5169 1 7 . 1 1 71 71 ASP N N 71 121.181 121.181 121.009 0.172 18792 5170 1 7 . 1 1 71 71 ASP C C 71 178.546 178.546 178.586 -0.040 18792 5171 1 7 . 1 1 71 71 ASP CA C 71 56.448 56.448 56.958 -0.510 18792 5172 1 7 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.477 -1.246 18792 5173 1 7 . 1 1 71 71 ASP H H 71 8.356 8.356 7.697 0.659 18792 5174 1 7 . 1 1 72 72 LEU N N 72 120.747 120.747 120.188 0.559 18792 5175 1 7 . 1 1 72 72 LEU C C 72 178.963 178.963 179.115 -0.152 18792 5176 1 7 . 1 1 72 72 LEU CA C 72 57.444 57.444 57.817 -0.373 18792 5177 1 7 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.148 -1.131 18792 5178 1 7 . 1 1 72 72 LEU H H 72 7.738 7.738 7.209 0.529 18792 5179 1 7 . 1 1 73 73 THR N N 73 109.432 109.432 112.472 -3.040 18792 5180 1 7 . 1 1 73 73 THR C C 73 177.481 177.481 176.151 1.330 18792 5181 1 7 . 1 1 73 73 THR CA C 73 65.128 65.128 65.075 0.053 18792 5182 1 7 . 1 1 73 73 THR CB C 73 67.720 67.720 68.506 -0.786 18792 5183 1 7 . 1 1 73 73 THR H H 73 8.296 8.296 8.238 0.058 18792 5184 1 7 . 1 1 74 74 SER N N 74 115.862 115.862 116.038 -0.176 18792 5185 1 7 . 1 1 74 74 SER C C 74 175.361 175.361 175.453 -0.092 18792 5186 1 7 . 1 1 74 74 SER CA C 74 60.112 60.112 60.924 -0.812 18792 5187 1 7 . 1 1 74 74 SER CB C 74 62.537 62.537 63.453 -0.916 18792 5188 1 7 . 1 1 74 74 SER H H 74 7.629 7.629 7.664 -0.035 18792 5189 1 7 . 1 1 75 75 GLN N N 75 118.551 118.551 120.288 -1.737 18792 5190 1 7 . 1 1 75 75 GLN C C 75 176.316 176.316 176.470 -0.154 18792 5191 1 7 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.715 0.089 18792 5192 1 7 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.148 -0.871 18792 5193 1 7 . 1 1 75 75 GLN H H 75 7.640 7.640 7.406 0.234 18792 5194 1 7 . 1 1 76 76 LEU N N 76 118.313 118.313 116.275 2.038 18792 5195 1 7 . 1 1 76 76 LEU C C 76 174.160 174.160 176.004 -1.844 18792 5196 1 7 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.700 -0.960 18792 5197 1 7 . 1 1 76 76 LEU CB C 76 42.727 42.727 39.958 2.769 18792 5198 1 7 . 1 1 76 76 LEU H H 76 7.411 7.411 7.653 -0.242 18792 5199 1 7 . 1 1 77 77 HIS N N 77 120.104 120.104 118.663 1.441 18792 5200 1 7 . 1 1 77 77 HIS C C 77 174.528 174.528 173.898 0.630 18792 5201 1 7 . 1 1 77 77 HIS CA C 77 54.207 54.207 57.134 -2.927 18792 5202 1 7 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.474 -0.508 18792 5203 1 7 . 1 1 77 77 HIS H H 77 8.117 8.117 8.475 -0.358 18792 5204 1 7 . 1 1 78 78 ILE N N 78 122.298 122.298 123.158 -0.860 18792 5205 1 7 . 1 1 78 78 ILE C C 78 174.240 174.240 175.371 -1.131 18792 5206 1 7 . 1 1 78 78 ILE CA C 78 61.402 61.402 61.807 -0.405 18792 5207 1 7 . 1 1 78 78 ILE CB C 78 37.591 37.591 39.897 -2.306 18792 5208 1 7 . 1 1 78 78 ILE H H 78 8.655 8.655 8.526 0.129 18792 5209 1 7 . 1 1 79 79 THR N N 79 116.442 116.442 116.138 0.304 18792 5210 1 7 . 1 1 79 79 THR C C 79 174.291 174.291 174.566 -0.275 18792 5211 1 7 . 1 1 79 79 THR CA C 79 61.632 61.632 65.167 -3.535 18792 5212 1 7 . 1 1 79 79 THR CB C 79 68.704 68.704 67.643 1.061 18792 5213 1 7 . 1 1 79 79 THR H H 79 8.245 8.245 7.994 0.251 18792 5214 1 7 . 1 1 84 84 TYR N N 84 120.888 120.888 119.224 1.664 18792 5215 1 7 . 1 1 84 84 TYR C C 84 176.708 176.708 178.218 -1.510 18792 5216 1 7 . 1 1 84 84 TYR CA C 84 60.432 60.432 62.208 -1.776 18792 5217 1 7 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.262 -1.517 18792 5218 1 7 . 1 1 84 84 TYR H H 84 8.733 8.733 8.870 -0.137 18792 5219 1 7 . 1 1 85 85 GLN N N 85 114.530 114.530 119.028 -4.498 18792 5220 1 7 . 1 1 85 85 GLN C C 85 178.473 178.473 178.664 -0.191 18792 5221 1 7 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.439 -0.145 18792 5222 1 7 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.437 -1.636 18792 5223 1 7 . 1 1 85 85 GLN H H 85 8.413 8.413 8.764 -0.351 18792 5224 1 7 . 1 1 86 86 SER N N 86 114.032 114.032 115.556 -1.524 18792 5225 1 7 . 1 1 86 86 SER C C 86 178.473 178.473 176.267 2.206 18792 5226 1 7 . 1 1 86 86 SER CA C 86 62.175 62.175 61.236 0.939 18792 5227 1 7 . 1 1 86 86 SER CB C 86 63.252 63.252 62.614 0.638 18792 5228 1 7 . 1 1 86 86 SER H H 86 7.258 7.258 7.751 -0.493 18792 5229 1 7 . 1 1 88 88 GLU N N 88 119.386 119.386 118.586 0.800 18792 5230 1 7 . 1 1 88 88 GLU C C 88 177.199 177.199 178.918 -1.719 18792 5231 1 7 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.657 -1.075 18792 5232 1 7 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.254 -0.278 18792 5233 1 7 . 1 1 88 88 GLU H H 88 8.534 8.534 8.808 -0.274 18792 5234 1 7 . 1 1 89 89 GLN N N 89 114.678 114.678 119.401 -4.723 18792 5235 1 7 . 1 1 89 89 GLN C C 89 178.669 178.669 178.420 0.249 18792 5236 1 7 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.871 -0.289 18792 5237 1 7 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.732 -1.310 18792 5238 1 7 . 1 1 89 89 GLN H H 89 7.500 7.500 7.461 0.039 18792 5239 1 7 . 1 1 90 90 VAL N N 90 118.174 118.174 119.537 -1.363 18792 5240 1 7 . 1 1 90 90 VAL C C 90 178.081 178.081 178.421 -0.340 18792 5241 1 7 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.916 -0.361 18792 5242 1 7 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.602 0.005 18792 5243 1 7 . 1 1 90 90 VAL H H 90 7.017 7.017 7.823 -0.806 18792 5244 1 7 . 1 1 91 91 VAL N N 91 119.489 119.489 120.294 -0.805 18792 5245 1 7 . 1 1 91 91 VAL C C 91 177.914 177.914 177.673 0.241 18792 5246 1 7 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.638 -0.869 18792 5247 1 7 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.862 -0.571 18792 5248 1 7 . 1 1 91 91 VAL H H 91 7.833 7.833 8.157 -0.324 18792 5249 1 7 . 1 1 92 92 ASN N N 92 117.180 117.180 118.189 -1.009 18792 5250 1 7 . 1 1 92 92 ASN C C 92 179.110 179.110 177.021 2.089 18792 5251 1 7 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.539 -1.621 18792 5252 1 7 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.654 -2.686 18792 5253 1 7 . 1 1 92 92 ASN H H 92 8.368 8.368 8.277 0.091 18792 5254 1 7 . 1 1 93 93 GLU N N 93 118.476 118.476 118.480 -0.004 18792 5255 1 7 . 1 1 93 93 GLU C C 93 179.355 179.355 179.318 0.037 18792 5256 1 7 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.576 -0.171 18792 5257 1 7 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.961 -2.228 18792 5258 1 7 . 1 1 93 93 GLU H H 93 7.213 7.213 7.941 -0.728 18792 5259 1 7 . 1 1 94 94 LEU N N 94 120.889 120.889 120.960 -0.071 18792 5260 1 7 . 1 1 94 94 LEU C C 94 178.473 178.473 178.657 -0.184 18792 5261 1 7 . 1 1 94 94 LEU CA C 94 57.017 57.017 56.832 0.185 18792 5262 1 7 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.609 -1.679 18792 5263 1 7 . 1 1 94 94 LEU H H 94 7.446 7.446 7.986 -0.540 18792 5264 1 7 . 1 1 95 95 PHE N N 95 112.902 112.902 117.406 -4.504 18792 5265 1 7 . 1 1 95 95 PHE C C 95 176.586 176.586 177.108 -0.522 18792 5266 1 7 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.386 -2.227 18792 5267 1 7 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.877 -0.656 18792 5268 1 7 . 1 1 95 95 PHE H H 95 6.916 6.916 8.072 -1.156 18792 5269 1 7 . 1 1 96 96 ARG N N 96 123.729 123.729 118.864 4.865 18792 5270 1 7 . 1 1 96 96 ARG C C 96 177.272 177.272 176.867 0.405 18792 5271 1 7 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.128 1.095 18792 5272 1 7 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.127 -1.695 18792 5273 1 7 . 1 1 96 96 ARG H H 96 7.126 7.126 7.659 -0.533 18792 5274 1 7 . 1 1 97 97 ASP N N 97 116.576 116.576 116.811 -0.235 18792 5275 1 7 . 1 1 97 97 ASP C C 97 175.687 175.687 174.310 1.377 18792 5276 1 7 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.295 -0.623 18792 5277 1 7 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.111 -3.066 18792 5278 1 7 . 1 1 97 97 ASP H H 97 8.644 8.644 7.722 0.922 18792 5279 1 7 . 1 1 98 98 GLY N N 98 108.551 108.551 106.249 2.302 18792 5280 1 7 . 1 1 98 98 GLY C C 98 172.690 172.690 172.258 0.432 18792 5281 1 7 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.277 -2.027 18792 5282 1 7 . 1 1 98 98 GLY H H 98 7.463 7.463 7.469 -0.006 18792 5283 1 7 . 1 1 99 99 VAL N N 99 120.630 120.630 122.709 -2.079 18792 5284 1 7 . 1 1 99 99 VAL C C 99 174.503 174.503 174.019 0.484 18792 5285 1 7 . 1 1 99 99 VAL CA C 99 62.318 62.318 61.636 0.681 18792 5286 1 7 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.081 -1.318 18792 5287 1 7 . 1 1 99 99 VAL H H 99 8.184 8.184 8.015 0.169 18792 5288 1 7 . 1 1 100 100 ASN N N 100 115.485 115.485 116.282 -0.797 18792 5289 1 7 . 1 1 100 100 ASN C C 100 175.239 175.239 175.983 -0.744 18792 5290 1 7 . 1 1 100 100 ASN CA C 100 51.361 51.361 53.789 -2.428 18792 5291 1 7 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.791 0.129 18792 5292 1 7 . 1 1 100 100 ASN H H 100 6.241 6.241 7.249 -1.008 18792 5293 1 7 . 1 1 101 101 TRP N N 101 118.266 118.266 119.845 -1.579 18792 5294 1 7 . 1 1 101 101 TRP C C 101 178.301 178.301 176.173 2.128 18792 5295 1 7 . 1 1 101 101 TRP CA C 101 60.539 60.539 58.957 1.582 18792 5296 1 7 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.620 1.210 18792 5297 1 7 . 1 1 101 101 TRP H H 101 8.409 8.409 7.704 0.705 18792 5298 1 7 . 1 1 102 102 GLY N N 102 106.147 106.147 107.906 -1.759 18792 5299 1 7 . 1 1 102 102 GLY C C 102 177.640 177.640 175.995 1.645 18792 5300 1 7 . 1 1 102 102 GLY CA C 102 46.914 46.914 45.241 1.673 18792 5301 1 7 . 1 1 102 102 GLY H H 102 8.504 8.504 7.845 0.659 18792 5302 1 7 . 1 1 103 103 ARG N N 103 121.347 121.347 121.881 -0.534 18792 5303 1 7 . 1 1 103 103 ARG C C 103 177.738 177.738 178.422 -0.684 18792 5304 1 7 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.035 -0.093 18792 5305 1 7 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.952 0.267 18792 5306 1 7 . 1 1 103 103 ARG H H 103 8.099 8.099 8.219 -0.120 18792 5307 1 7 . 1 1 104 104 ILE N N 104 120.930 120.930 119.678 1.252 18792 5308 1 7 . 1 1 104 104 ILE C C 104 178.197 178.197 177.502 0.695 18792 5309 1 7 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.733 1.802 18792 5310 1 7 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.852 -1.807 18792 5311 1 7 . 1 1 104 104 ILE H H 104 7.690 7.690 8.103 -0.413 18792 5312 1 7 . 1 1 105 105 VAL N N 105 120.938 120.938 119.677 1.261 18792 5313 1 7 . 1 1 105 105 VAL C C 105 177.854 177.854 177.431 0.423 18792 5314 1 7 . 1 1 105 105 VAL CA C 105 67.458 67.458 67.113 0.345 18792 5315 1 7 . 1 1 105 105 VAL CB C 105 30.374 30.374 31.298 -0.924 18792 5316 1 7 . 1 1 105 105 VAL H H 105 8.245 8.245 7.490 0.755 18792 5317 1 7 . 1 1 106 106 ALA N N 106 121.165 121.165 121.495 -0.330 18792 5318 1 7 . 1 1 106 106 ALA C C 106 178.284 178.284 179.136 -0.852 18792 5319 1 7 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.526 0.072 18792 5320 1 7 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.043 -0.527 18792 5321 1 7 . 1 1 106 106 ALA H H 106 7.529 7.529 7.313 0.216 18792 5322 1 7 . 1 1 107 107 PHE N N 107 119.242 119.242 119.573 -0.331 18792 5323 1 7 . 1 1 107 107 PHE C C 107 176.390 176.390 177.263 -0.873 18792 5324 1 7 . 1 1 107 107 PHE CA C 107 60.173 60.173 61.769 -1.596 18792 5325 1 7 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.223 -2.136 18792 5326 1 7 . 1 1 107 107 PHE H H 107 7.974 7.974 7.492 0.482 18792 5327 1 7 . 1 1 108 108 PHE N N 108 120.009 120.009 119.526 0.483 18792 5328 1 7 . 1 1 108 108 PHE C C 108 177.640 177.640 177.441 0.199 18792 5329 1 7 . 1 1 108 108 PHE CA C 108 62.424 62.424 62.216 0.208 18792 5330 1 7 . 1 1 108 108 PHE CB C 108 35.346 35.346 39.239 -3.893 18792 5331 1 7 . 1 1 108 108 PHE H H 108 7.946 7.946 8.374 -0.428 18792 5332 1 7 . 1 1 109 109 SER N N 109 114.631 114.631 115.543 -0.912 18792 5333 1 7 . 1 1 109 109 SER C C 109 177.770 177.770 176.466 1.304 18792 5334 1 7 . 1 1 109 109 SER CA C 109 63.349 63.349 61.630 1.719 18792 5335 1 7 . 1 1 109 109 SER H H 109 8.424 8.424 7.754 0.670 18792 5336 1 7 . 1 1 110 110 PHE N N 110 124.230 124.230 122.892 1.338 18792 5337 1 7 . 1 1 110 110 PHE C C 110 176.708 176.708 177.119 -0.411 18792 5338 1 7 . 1 1 110 110 PHE CA C 110 59.614 59.614 60.128 -0.514 18792 5339 1 7 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.938 -1.494 18792 5340 1 7 . 1 1 110 110 PHE H H 110 9.052 9.052 8.148 0.904 18792 5341 1 7 . 1 1 111 111 GLY N N 111 105.893 105.893 106.412 -0.519 18792 5342 1 7 . 1 1 111 111 GLY C C 111 176.795 176.795 175.940 0.855 18792 5343 1 7 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.595 0.781 18792 5344 1 7 . 1 1 111 111 GLY H H 111 7.926 7.926 8.772 -0.846 18792 5345 1 7 . 1 1 112 112 GLY N N 112 107.410 107.410 108.898 -1.488 18792 5346 1 7 . 1 1 112 112 GLY C C 112 174.650 174.650 175.118 -0.468 18792 5347 1 7 . 1 1 112 112 GLY CA C 112 47.305 47.305 45.802 1.503 18792 5348 1 7 . 1 1 112 112 GLY H H 112 8.799 8.799 7.855 0.944 18792 5349 1 7 . 1 1 113 113 ALA N N 113 124.313 124.313 124.171 0.142 18792 5350 1 7 . 1 1 113 113 ALA C C 113 181.300 181.300 178.611 2.689 18792 5351 1 7 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.817 -0.290 18792 5352 1 7 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.156 -0.673 18792 5353 1 7 . 1 1 113 113 ALA H H 113 8.212 8.212 7.749 0.463 18792 5354 1 7 . 1 1 114 114 LEU N N 114 118.878 118.878 119.004 -0.126 18792 5355 1 7 . 1 1 114 114 LEU C C 114 180.286 180.286 178.779 1.507 18792 5356 1 7 . 1 1 114 114 LEU CA C 114 56.982 56.982 56.346 0.636 18792 5357 1 7 . 1 1 114 114 LEU CB C 114 41.017 41.017 40.459 0.557 18792 5358 1 7 . 1 1 114 114 LEU H H 114 8.161 8.161 7.750 0.411 18792 5359 1 7 . 1 1 115 115 CYS N N 115 119.002 119.002 119.270 -0.268 18792 5360 1 7 . 1 1 115 115 CYS C C 115 176.087 176.087 176.559 -0.472 18792 5361 1 7 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.642 0.302 18792 5362 1 7 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.249 -1.614 18792 5363 1 7 . 1 1 115 115 CYS H H 115 8.070 8.070 7.602 0.468 18792 5364 1 7 . 1 1 116 116 VAL N N 116 118.737 118.737 119.462 -0.725 18792 5365 1 7 . 1 1 116 116 VAL C C 116 177.494 177.494 177.124 0.370 18792 5366 1 7 . 1 1 116 116 VAL CA C 116 66.762 66.762 65.925 0.837 18792 5367 1 7 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.546 -0.783 18792 5368 1 7 . 1 1 116 116 VAL H H 116 7.995 7.995 7.558 0.437 18792 5369 1 7 . 1 1 117 117 GLU N N 117 118.886 118.886 119.400 -0.514 18792 5370 1 7 . 1 1 117 117 GLU C C 117 178.424 178.424 178.661 -0.237 18792 5371 1 7 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.409 -0.649 18792 5372 1 7 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.780 -1.726 18792 5373 1 7 . 1 1 117 117 GLU H H 117 8.059 8.059 7.855 0.204 18792 5374 1 7 . 1 1 118 118 SER N N 118 113.417 113.417 115.977 -2.560 18792 5375 1 7 . 1 1 118 118 SER C C 118 175.607 175.607 176.813 -1.206 18792 5376 1 7 . 1 1 118 118 SER CA C 118 62.638 62.638 61.423 1.214 18792 5377 1 7 . 1 1 118 118 SER CB C 118 61.061 61.061 63.486 -2.425 18792 5378 1 7 . 1 1 118 118 SER H H 118 7.626 7.626 8.117 -0.491 18792 5379 1 7 . 1 1 119 119 VAL N N 119 120.612 120.612 122.521 -1.909 18792 5380 1 7 . 1 1 119 119 VAL C C 119 179.713 179.713 177.876 1.837 18792 5381 1 7 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.881 0.344 18792 5382 1 7 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.455 -1.376 18792 5383 1 7 . 1 1 119 119 VAL H H 119 7.297 7.297 8.079 -0.782 18792 5384 1 7 . 1 1 120 120 ASP N N 120 122.546 122.546 119.644 2.902 18792 5385 1 7 . 1 1 120 120 ASP C C 120 178.057 178.057 177.208 0.849 18792 5386 1 7 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.763 0.226 18792 5387 1 7 . 1 1 120 120 ASP CB C 120 39.923 39.923 41.104 -1.181 18792 5388 1 7 . 1 1 120 120 ASP H H 120 8.264 8.264 7.887 0.377 18792 5389 1 7 . 1 1 121 121 LYS N N 121 115.636 115.636 118.797 -3.161 18792 5390 1 7 . 1 1 121 121 LYS C C 121 175.159 175.159 175.462 -0.303 18792 5391 1 7 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.246 -0.986 18792 5392 1 7 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.009 -2.234 18792 5393 1 7 . 1 1 121 121 LYS H H 121 7.558 7.558 7.390 0.168 18792 5394 1 7 . 1 1 122 122 GLU N N 122 113.915 113.915 114.266 -0.351 18792 5395 1 7 . 1 1 122 122 GLU C C 122 176.109 176.109 175.911 0.198 18792 5396 1 7 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.817 -0.510 18792 5397 1 7 . 1 1 122 122 GLU CB C 122 25.332 25.332 26.936 -1.604 18792 5398 1 7 . 1 1 122 122 GLU H H 122 7.826 7.826 7.929 -0.103 18792 5399 1 7 . 1 1 124 124 GLN N N 124 119.233 119.233 120.456 -1.223 18792 5400 1 7 . 1 1 124 124 GLN C C 124 177.640 177.640 176.963 0.677 18792 5401 1 7 . 1 1 124 124 GLN CA C 124 59.472 59.472 59.040 0.432 18792 5402 1 7 . 1 1 124 124 GLN CB C 124 26.490 26.490 27.586 -1.096 18792 5403 1 7 . 1 1 124 124 GLN H H 124 8.626 8.626 8.466 0.160 18792 5404 1 7 . 1 1 125 125 VAL N N 125 117.011 117.011 119.960 -2.949 18792 5405 1 7 . 1 1 125 125 VAL C C 125 175.826 175.826 177.109 -1.283 18792 5406 1 7 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.831 -1.694 18792 5407 1 7 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.091 -0.794 18792 5408 1 7 . 1 1 125 125 VAL H H 125 7.870 7.870 7.846 0.024 18792 5409 1 7 . 1 1 126 126 LEU N N 126 117.058 117.058 118.247 -1.189 18792 5410 1 7 . 1 1 126 126 LEU C C 126 178.096 178.096 178.198 -0.102 18792 5411 1 7 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.646 -2.561 18792 5412 1 7 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.450 -2.177 18792 5413 1 7 . 1 1 126 126 LEU H H 126 7.747 7.747 8.225 -0.478 18792 5414 1 7 . 1 1 127 127 VAL N N 127 119.457 119.457 120.723 -1.266 18792 5415 1 7 . 1 1 127 127 VAL C C 127 177.150 177.150 178.204 -1.054 18792 5416 1 7 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.666 0.490 18792 5417 1 7 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.784 -1.031 18792 5418 1 7 . 1 1 127 127 VAL H H 127 7.306 7.306 7.411 -0.105 18792 5419 1 7 . 1 1 128 128 SER N N 128 110.647 110.647 114.574 -3.927 18792 5420 1 7 . 1 1 128 128 SER C C 128 177.222 177.222 176.825 0.397 18792 5421 1 7 . 1 1 128 128 SER CA C 128 60.752 60.752 61.543 -0.791 18792 5422 1 7 . 1 1 128 128 SER CB C 128 61.605 61.605 62.939 -1.334 18792 5423 1 7 . 1 1 128 128 SER H H 128 8.237 8.237 7.838 0.399 18792 5424 1 7 . 1 1 129 129 ARG N N 129 123.100 123.100 121.893 1.207 18792 5425 1 7 . 1 1 129 129 ARG C C 129 175.802 175.802 178.690 -2.888 18792 5426 1 7 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.270 -1.043 18792 5427 1 7 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.282 -2.083 18792 5428 1 7 . 1 1 129 129 ARG H H 129 6.564 6.564 7.769 -1.205 18792 5429 1 7 . 1 1 130 130 ILE N N 130 118.182 118.182 117.409 0.773 18792 5430 1 7 . 1 1 130 130 ILE C C 130 178.156 178.156 177.936 0.220 18792 5431 1 7 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.062 -0.716 18792 5432 1 7 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.421 -0.739 18792 5433 1 7 . 1 1 130 130 ILE H H 130 7.955 7.955 8.584 -0.629 18792 5434 1 7 . 1 1 131 131 ALA N N 131 119.029 119.029 121.819 -2.790 18792 5435 1 7 . 1 1 131 131 ALA C C 131 179.593 179.593 179.408 0.185 18792 5436 1 7 . 1 1 131 131 ALA CA C 131 54.598 54.598 54.927 -0.329 18792 5437 1 7 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.184 -0.796 18792 5438 1 7 . 1 1 131 131 ALA H H 131 7.582 7.582 8.479 -0.897 18792 5439 1 7 . 1 1 132 132 ALA N N 132 120.336 120.336 122.242 -1.906 18792 5440 1 7 . 1 1 132 132 ALA C C 132 181.095 181.095 178.911 2.184 18792 5441 1 7 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.777 -0.179 18792 5442 1 7 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.831 -2.130 18792 5443 1 7 . 1 1 132 132 ALA H H 132 7.224 7.224 7.922 -0.698 18792 5444 1 7 . 1 1 133 133 TRP N N 133 121.194 121.194 120.988 0.206 18792 5445 1 7 . 1 1 133 133 TRP C C 133 179.698 179.698 178.555 1.143 18792 5446 1 7 . 1 1 133 133 TRP CA C 133 57.302 57.302 59.944 -2.642 18792 5447 1 7 . 1 1 133 133 TRP CB C 133 27.655 27.655 30.229 -2.574 18792 5448 1 7 . 1 1 133 133 TRP H H 133 8.925 8.925 8.671 0.254 18792 5449 1 7 . 1 1 134 134 MET N N 134 116.987 116.987 116.817 0.170 18792 5450 1 7 . 1 1 134 134 MET C C 134 178.277 178.277 177.728 0.549 18792 5451 1 7 . 1 1 134 134 MET CA C 134 59.578 59.578 58.469 1.109 18792 5452 1 7 . 1 1 134 134 MET CB C 134 33.559 33.559 32.120 1.439 18792 5453 1 7 . 1 1 134 134 MET H H 134 8.863 8.863 8.478 0.385 18792 5454 1 7 . 1 1 135 135 ALA N N 135 120.523 120.523 121.997 -1.474 18792 5455 1 7 . 1 1 135 135 ALA C C 135 179.298 179.298 179.638 -0.340 18792 5456 1 7 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.076 0.357 18792 5457 1 7 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.517 -1.880 18792 5458 1 7 . 1 1 135 135 ALA H H 135 8.152 8.152 8.029 0.123 18792 5459 1 7 . 1 1 136 136 THR N N 136 116.715 116.715 115.872 0.843 18792 5460 1 7 . 1 1 136 136 THR C C 136 175.106 175.106 176.248 -1.142 18792 5461 1 7 . 1 1 136 136 THR CA C 136 66.729 66.729 65.848 0.881 18792 5462 1 7 . 1 1 136 136 THR CB C 136 68.441 68.441 68.854 -0.413 18792 5463 1 7 . 1 1 136 136 THR H H 136 8.532 8.532 8.302 0.230 18792 5464 1 7 . 1 1 137 137 TYR N N 137 123.204 123.204 123.239 -0.035 18792 5465 1 7 . 1 1 137 137 TYR C C 137 179.592 179.592 177.850 1.742 18792 5466 1 7 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.786 1.279 18792 5467 1 7 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.045 -0.057 18792 5468 1 7 . 1 1 137 137 TYR H H 137 8.809 8.809 7.549 1.260 18792 5469 1 7 . 1 1 138 138 LEU N N 138 119.247 119.247 120.436 -1.189 18792 5470 1 7 . 1 1 138 138 LEU C C 138 178.385 178.385 178.181 0.204 18792 5471 1 7 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.251 0.688 18792 5472 1 7 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.152 -0.444 18792 5473 1 7 . 1 1 138 138 LEU H H 138 8.742 8.742 7.946 0.796 18792 5474 1 7 . 1 1 139 139 ASN N N 139 117.122 117.122 115.781 1.341 18792 5475 1 7 . 1 1 139 139 ASN C C 139 176.417 176.417 177.185 -0.768 18792 5476 1 7 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.519 0.929 18792 5477 1 7 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.017 0.635 18792 5478 1 7 . 1 1 139 139 ASN H H 139 8.307 8.307 8.036 0.271 18792 5479 1 7 . 1 1 140 140 ASP N N 140 115.394 115.394 120.511 -5.117 18792 5480 1 7 . 1 1 140 140 ASP C C 140 177.919 177.919 176.109 1.810 18792 5481 1 7 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.907 -0.954 18792 5482 1 7 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.639 -1.253 18792 5483 1 7 . 1 1 140 140 ASP H H 140 8.439 8.439 8.053 0.386 18792 5484 1 7 . 1 1 141 141 HIS N N 141 111.695 111.695 113.194 -1.499 18792 5485 1 7 . 1 1 141 141 HIS C C 141 175.949 175.949 176.305 -0.356 18792 5486 1 7 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.028 0.029 18792 5487 1 7 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.499 -2.591 18792 5488 1 7 . 1 1 141 141 HIS H H 141 8.043 8.043 7.385 0.658 18792 5489 1 7 . 1 1 142 142 LEU N N 142 117.054 117.054 122.309 -5.255 18792 5490 1 7 . 1 1 142 142 LEU C C 142 176.530 176.530 177.803 -1.273 18792 5491 1 7 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.002 -2.693 18792 5492 1 7 . 1 1 142 142 LEU CB C 142 42.338 42.338 42.251 0.087 18792 5493 1 7 . 1 1 142 142 LEU H H 142 7.198 7.198 8.233 -1.035 18792 5494 1 7 . 1 1 143 143 GLU N N 143 121.335 121.335 120.520 0.815 18792 5495 1 7 . 1 1 143 143 GLU C C 143 173.964 173.964 175.784 -1.820 18792 5496 1 7 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.298 -0.044 18792 5497 1 7 . 1 1 143 143 GLU CB C 143 26.257 26.257 27.536 -1.279 18792 5498 1 7 . 1 1 143 143 GLU H H 143 8.565 8.565 7.979 0.586 18792 5499 1 7 . 1 1 145 145 TRP N N 145 117.973 117.973 120.147 -2.174 18792 5500 1 7 . 1 1 145 145 TRP C C 145 179.526 179.526 177.462 2.064 18792 5501 1 7 . 1 1 145 145 TRP CA C 145 61.606 61.606 59.527 2.079 18792 5502 1 7 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.855 -1.967 18792 5503 1 7 . 1 1 145 145 TRP H H 145 7.078 7.078 7.978 -0.900 18792 5504 1 7 . 1 1 146 146 ILE N N 146 122.101 122.101 111.580 10.521 18792 5505 1 7 . 1 1 146 146 ILE C C 146 179.110 179.110 177.110 2.000 18792 5506 1 7 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.184 4.150 18792 5507 1 7 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.609 -0.788 18792 5508 1 7 . 1 1 146 146 ILE H H 146 8.389 8.389 7.566 0.823 18792 5509 1 7 . 1 1 147 147 GLN N N 147 116.344 116.344 121.475 -5.131 18792 5510 1 7 . 1 1 147 147 GLN C C 147 179.526 179.526 177.468 2.058 18792 5511 1 7 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.174 -0.161 18792 5512 1 7 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.717 -0.994 18792 5513 1 7 . 1 1 147 147 GLN H H 147 8.376 8.376 8.013 0.363 18792 5514 1 7 . 1 1 148 148 GLU N N 148 118.913 118.913 120.737 -1.824 18792 5515 1 7 . 1 1 148 148 GLU C C 148 176.880 176.880 178.526 -1.646 18792 5516 1 7 . 1 1 148 148 GLU CA C 148 57.373 57.373 59.861 -2.488 18792 5517 1 7 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.327 -0.895 18792 5518 1 7 . 1 1 148 148 GLU H H 148 7.504 7.504 7.945 -0.441 18792 5519 1 7 . 1 1 149 149 ASN N N 149 116.616 116.616 114.742 1.874 18792 5520 1 7 . 1 1 149 149 ASN C C 149 173.964 173.964 177.160 -3.196 18792 5521 1 7 . 1 1 149 149 ASN CA C 149 53.246 53.246 54.075 -0.829 18792 5522 1 7 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.724 -2.591 18792 5523 1 7 . 1 1 149 149 ASN H H 149 7.070 7.070 8.346 -1.276 18792 5524 1 7 . 1 1 150 150 GLY N N 150 104.750 104.750 106.760 -2.010 18792 5525 1 7 . 1 1 150 150 GLY C C 150 176.022 176.022 173.950 2.072 18792 5526 1 7 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.791 -0.549 18792 5527 1 7 . 1 1 150 150 GLY H H 150 7.313 7.313 8.035 -0.722 18792 5528 1 7 . 1 1 151 151 GLY N N 151 108.385 108.385 108.420 -0.035 18792 5529 1 7 . 1 1 151 151 GLY C C 151 173.449 173.449 174.526 -1.077 18792 5530 1 7 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.392 -0.360 18792 5531 1 7 . 1 1 151 151 GLY H H 151 8.452 8.452 7.364 1.088 18792 5532 1 7 . 1 1 152 152 TRP N N 152 118.092 118.092 121.999 -3.907 18792 5533 1 7 . 1 1 152 152 TRP C C 152 178.571 178.571 178.219 0.352 18792 5534 1 7 . 1 1 152 152 TRP CA C 152 60.077 60.077 60.307 -0.230 18792 5535 1 7 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.852 -1.264 18792 5536 1 7 . 1 1 152 152 TRP H H 152 8.644 8.644 8.330 0.314 18792 5537 1 7 . 1 1 153 153 ASP N N 153 117.758 117.758 118.854 -1.096 18792 5538 1 7 . 1 1 153 153 ASP C C 153 179.796 179.796 178.724 1.072 18792 5539 1 7 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.874 -0.572 18792 5540 1 7 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.947 -1.716 18792 5541 1 7 . 1 1 153 153 ASP H H 153 8.827 8.827 8.068 0.759 18792 5542 1 7 . 1 1 154 154 THR N N 154 116.817 116.817 116.999 -0.182 18792 5543 1 7 . 1 1 154 154 THR C C 154 175.352 175.352 177.049 -1.697 18792 5544 1 7 . 1 1 154 154 THR CA C 154 65.910 65.910 66.635 -0.724 18792 5545 1 7 . 1 1 154 154 THR CB C 154 67.712 67.712 69.054 -1.342 18792 5546 1 7 . 1 1 154 154 THR H H 154 7.494 7.494 7.713 -0.219 18792 5547 1 7 . 1 1 155 155 PHE N N 155 122.196 122.196 121.790 0.406 18792 5548 1 7 . 1 1 155 155 PHE C C 155 176.831 176.831 177.762 -0.931 18792 5549 1 7 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.417 0.869 18792 5550 1 7 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.441 -1.774 18792 5551 1 7 . 1 1 155 155 PHE H H 155 6.477 6.477 8.607 -2.130 18792 5552 1 7 . 1 1 156 156 VAL N N 156 117.387 117.387 118.493 -1.106 18792 5553 1 7 . 1 1 156 156 VAL C C 156 178.497 178.497 177.572 0.925 18792 5554 1 7 . 1 1 156 156 VAL CA C 156 66.231 66.231 65.912 0.319 18792 5555 1 7 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.311 -0.626 18792 5556 1 7 . 1 1 156 156 VAL H H 156 7.788 7.788 8.696 -0.908 18792 5557 1 7 . 1 1 157 157 GLU N N 157 119.876 119.876 119.698 0.178 18792 5558 1 7 . 1 1 157 157 GLU C C 157 178.399 178.399 177.755 0.644 18792 5559 1 7 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.499 0.261 18792 5560 1 7 . 1 1 157 157 GLU CB C 157 28.277 28.277 30.200 -1.923 18792 5561 1 7 . 1 1 157 157 GLU H H 157 7.409 7.409 7.954 -0.545 18792 5562 1 7 . 1 1 158 158 LEU N N 158 117.194 117.194 118.750 -1.556 18792 5563 1 7 . 1 1 158 158 LEU C C 158 178.595 178.595 176.296 2.299 18792 5564 1 7 . 1 1 158 158 LEU CA C 158 56.377 56.377 55.248 1.129 18792 5565 1 7 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.388 0.183 18792 5566 1 7 . 1 1 158 158 LEU H H 158 7.584 7.584 7.883 -0.299 18792 5567 1 7 . 1 1 159 159 TYR N N 159 115.549 115.549 114.201 1.348 18792 5568 1 7 . 1 1 159 159 TYR C C 159 177.032 177.032 176.078 0.954 18792 5569 1 7 . 1 1 159 159 TYR CA C 159 59.116 59.116 58.171 0.945 18792 5570 1 7 . 1 1 159 159 TYR CB C 159 37.599 37.599 34.891 2.708 18792 5571 1 7 . 1 1 159 159 TYR H H 159 8.099 8.099 7.102 0.997 18792 5572 1 7 . 1 1 160 160 GLY N N 160 108.334 108.334 105.883 2.451 18792 5573 1 7 . 1 1 160 160 GLY C C 160 173.973 173.973 174.274 -0.301 18792 5574 1 7 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.751 0.313 18792 5575 1 7 . 1 1 160 160 GLY H H 160 8.020 8.020 7.908 0.112 18792 5576 1 7 . 1 1 161 161 ASN N N 161 118.189 118.189 118.523 -0.334 18792 5577 1 7 . 1 1 161 161 ASN C C 161 175.513 175.513 174.729 0.784 18792 5578 1 7 . 1 1 161 161 ASN CA C 161 53.104 53.104 53.679 -0.575 18792 5579 1 7 . 1 1 161 161 ASN CB C 161 38.203 38.203 39.667 -1.464 18792 5580 1 7 . 1 1 161 161 ASN H H 161 8.327 8.327 7.656 0.671 18792 5581 1 7 . 1 1 162 162 ASN N N 162 119.022 119.022 122.934 -3.912 18792 5582 1 7 . 1 1 162 162 ASN C C 162 175.690 175.690 174.015 1.675 18792 5583 1 7 . 1 1 162 162 ASN CA C 162 53.424 53.424 52.997 0.427 18792 5584 1 7 . 1 1 162 162 ASN CB C 162 38.203 38.203 39.576 -1.373 18792 5585 1 7 . 1 1 162 162 ASN H H 162 8.363 8.363 8.443 -0.080 18792 5586 1 7 . 1 1 163 163 ALA N N 163 123.275 123.275 125.329 -2.054 18792 5587 1 7 . 1 1 163 163 ALA C C 163 178.598 178.598 178.058 0.540 18792 5588 1 7 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.883 0.355 18792 5589 1 7 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.364 -1.753 18792 5590 1 7 . 1 1 163 163 ALA H H 163 8.103 8.103 8.464 -0.361 18792 5591 1 7 . 1 1 164 164 ALA N N 164 121.521 121.521 121.983 -0.462 18792 5592 1 7 . 1 1 164 164 ALA C C 164 178.642 178.642 179.253 -0.611 18792 5593 1 7 . 1 1 164 164 ALA CA C 164 52.584 52.584 53.997 -1.413 18792 5594 1 7 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.392 -0.573 18792 5595 1 7 . 1 1 164 164 ALA H H 164 8.053 8.053 8.261 -0.208 18792 5596 1 7 . 1 1 165 165 ALA N N 165 122.101 122.101 119.325 2.776 18792 5597 1 7 . 1 1 165 165 ALA C C 165 179.124 179.124 178.327 0.797 18792 5598 1 7 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.098 -0.959 18792 5599 1 7 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.450 -0.472 18792 5600 1 7 . 1 1 165 165 ALA H H 165 7.949 7.949 8.389 -0.440 18792 5601 1 7 . 1 1 166 166 GLU N N 166 118.381 118.381 115.335 3.046 18792 5602 1 7 . 1 1 166 166 GLU C C 166 177.664 177.664 176.438 1.226 18792 5603 1 7 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.387 0.701 18792 5604 1 7 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.645 -1.291 18792 5605 1 7 . 1 1 166 166 GLU H H 166 8.202 8.202 8.086 0.116 18792 5606 1 7 . 1 1 167 167 SER N N 167 115.193 115.193 113.982 1.211 18792 5607 1 7 . 1 1 167 167 SER C C 167 175.312 175.312 175.090 0.222 18792 5608 1 7 . 1 1 167 167 SER CA C 167 58.831 58.831 59.452 -0.620 18792 5609 1 7 . 1 1 167 167 SER CB C 167 62.537 62.537 63.201 -0.664 18792 5610 1 7 . 1 1 167 167 SER H H 167 8.029 8.029 7.723 0.306 18792 5611 1 7 . 1 1 168 168 ARG N N 168 121.696 121.696 120.389 1.307 18792 5612 1 7 . 1 1 168 168 ARG C C 168 176.880 176.880 175.893 0.987 18792 5613 1 7 . 1 1 168 168 ARG CA C 168 56.163 56.163 55.319 0.844 18792 5614 1 7 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.777 -0.568 18792 5615 1 7 . 1 1 168 168 ARG H H 168 7.967 7.967 7.605 0.362 18792 5616 1 7 . 1 1 169 169 LYS N N 169 120.917 120.917 119.434 1.483 18792 5617 1 7 . 1 1 169 169 LYS C C 169 177.640 177.640 175.283 2.357 18792 5618 1 7 . 1 1 169 169 LYS CA C 169 56.697 56.697 57.196 -0.499 18792 5619 1 7 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.528 -1.066 18792 5620 1 7 . 1 1 169 169 LYS H H 169 8.011 8.011 7.782 0.229 18792 5621 1 7 . 1 1 170 170 GLY N N 170 109.155 109.155 107.013 2.142 18792 5622 1 7 . 1 1 170 170 GLY C C 170 174.479 174.479 173.331 1.148 18792 5623 1 7 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.248 -0.184 18792 5624 1 7 . 1 1 170 170 GLY H H 170 8.329 8.329 8.140 0.189 18792 5625 1 7 . 1 1 171 171 GLN N N 171 119.292 119.292 119.796 -0.504 18792 5626 1 7 . 1 1 171 171 GLN C C 171 176.463 176.463 174.278 2.185 18792 5627 1 7 . 1 1 171 171 GLN CA C 171 55.666 55.666 56.841 -1.175 18792 5628 1 7 . 1 1 171 171 GLN CB C 171 28.199 28.199 27.830 0.369 18792 5629 1 7 . 1 1 171 171 GLN H H 171 8.035 8.035 8.315 -0.280 18792 5630 1 7 . 1 1 172 172 GLU N N 172 121.703 121.703 122.630 -0.927 18792 5631 1 7 . 1 1 172 172 GLU C C 172 176.414 176.414 175.368 1.046 18792 5632 1 7 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.334 1.007 18792 5633 1 7 . 1 1 172 172 GLU CB C 172 28.821 28.821 31.958 -3.137 18792 5634 1 7 . 1 1 172 172 GLU H H 172 8.405 8.405 8.394 0.011 18792 5635 1 7 . 1 1 173 173 ARG N N 173 121.852 121.852 121.031 0.821 18792 5636 1 7 . 1 1 173 173 ARG C C 173 176.365 176.365 175.130 1.235 18792 5637 1 7 . 1 1 173 173 ARG CA C 173 56.199 56.199 56.556 -0.357 18792 5638 1 7 . 1 1 173 173 ARG CB C 173 29.131 29.131 30.505 -1.374 18792 5639 1 7 . 1 1 173 173 ARG H H 173 8.335 8.335 8.637 -0.302 18792 5640 1 7 . 1 1 174 174 LEU N N 174 122.640 122.640 115.892 6.748 18792 5641 1 7 . 1 1 174 174 LEU C C 174 176.523 176.523 176.002 0.521 18792 5642 1 7 . 1 1 174 174 LEU CA C 174 54.768 54.768 53.815 0.953 18792 5643 1 7 . 1 1 174 174 LEU CB C 174 40.784 40.784 42.405 -1.621 18792 5644 1 7 . 1 1 174 174 LEU H H 174 8.082 8.082 8.080 0.002 18792 5645 1 7 . 1 1 175 175 GLU N N 175 125.909 125.909 119.617 6.292 18792 5646 1 7 . 1 1 175 175 GLU C C 175 181.029 181.029 174.737 6.292 18792 5647 1 7 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.250 1.148 18792 5648 1 7 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.731 -1.681 18792 5649 1 7 . 1 1 175 175 GLU H H 175 7.785 7.785 8.428 -0.643 18792 5650 1 8 . 1 1 4 4 ALA N N 4 124.786 124.786 123.257 1.529 18792 5651 1 8 . 1 1 4 4 ALA C C 4 178.272 178.272 177.665 0.607 18792 5652 1 8 . 1 1 4 4 ALA CA C 4 52.566 52.566 52.705 -0.138 18792 5653 1 8 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.640 -0.406 18792 5654 1 8 . 1 1 4 4 ALA H H 4 8.414 8.414 8.420 -0.006 18792 5655 1 8 . 1 1 5 5 MET N N 5 119.681 119.681 117.092 2.589 18792 5656 1 8 . 1 1 5 5 MET C C 5 176.929 176.929 176.858 0.071 18792 5657 1 8 . 1 1 5 5 MET CA C 5 55.594 55.594 55.540 0.054 18792 5658 1 8 . 1 1 5 5 MET CB C 5 31.540 31.540 31.750 -0.210 18792 5659 1 8 . 1 1 5 5 MET H H 5 8.336 8.336 7.789 0.547 18792 5660 1 8 . 1 1 6 6 SER N N 6 116.162 116.162 116.885 -0.723 18792 5661 1 8 . 1 1 6 6 SER C C 6 175.924 175.924 176.401 -0.477 18792 5662 1 8 . 1 1 6 6 SER CA C 6 59.009 59.009 61.008 -1.999 18792 5663 1 8 . 1 1 6 6 SER CB C 6 62.537 62.537 62.633 -0.096 18792 5664 1 8 . 1 1 6 6 SER H H 6 8.272 8.272 8.255 0.017 18792 5665 1 8 . 1 1 7 7 GLN N N 7 122.263 122.263 120.333 1.930 18792 5666 1 8 . 1 1 7 7 GLN C C 7 177.027 177.027 177.881 -0.854 18792 5667 1 8 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.291 -2.021 18792 5668 1 8 . 1 1 7 7 GLN CB C 7 27.739 27.739 27.660 0.079 18792 5669 1 8 . 1 1 7 7 GLN H H 7 8.314 8.314 8.711 -0.397 18792 5670 1 8 . 1 1 8 8 SER N N 8 116.625 116.625 115.821 0.804 18792 5671 1 8 . 1 1 8 8 SER C C 8 176.457 176.457 176.470 -0.013 18792 5672 1 8 . 1 1 8 8 SER CA C 8 59.650 59.650 61.231 -1.581 18792 5673 1 8 . 1 1 8 8 SER CB C 8 62.226 62.226 62.823 -0.597 18792 5674 1 8 . 1 1 8 8 SER H H 8 8.333 8.333 7.717 0.616 18792 5675 1 8 . 1 1 9 9 ASN N N 9 121.307 121.307 119.706 1.601 18792 5676 1 8 . 1 1 9 9 ASN C C 9 177.419 177.419 177.575 -0.156 18792 5677 1 8 . 1 1 9 9 ASN CA C 9 55.487 55.487 55.800 -0.313 18792 5678 1 8 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.257 -1.123 18792 5679 1 8 . 1 1 9 9 ASN H H 9 8.611 8.611 7.979 0.632 18792 5680 1 8 . 1 1 10 10 ARG N N 10 119.830 119.830 121.228 -1.398 18792 5681 1 8 . 1 1 10 10 ARG C C 10 177.615 177.615 178.576 -0.961 18792 5682 1 8 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.531 -0.273 18792 5683 1 8 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.373 -2.174 18792 5684 1 8 . 1 1 10 10 ARG H H 10 7.996 7.996 8.554 -0.558 18792 5685 1 8 . 1 1 11 11 GLU N N 11 117.270 117.270 118.636 -1.366 18792 5686 1 8 . 1 1 11 11 GLU C C 11 179.649 179.649 178.840 0.809 18792 5687 1 8 . 1 1 11 11 GLU CA C 11 59.009 59.009 58.628 0.381 18792 5688 1 8 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.284 -1.163 18792 5689 1 8 . 1 1 11 11 GLU H H 11 7.885 7.885 8.357 -0.472 18792 5690 1 8 . 1 1 12 12 LEU N N 12 119.900 119.900 122.605 -2.705 18792 5691 1 8 . 1 1 12 12 LEU C C 12 178.473 178.473 178.317 0.156 18792 5692 1 8 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.518 -0.825 18792 5693 1 8 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.931 -1.302 18792 5694 1 8 . 1 1 12 12 LEU H H 12 7.691 7.691 8.050 -0.359 18792 5695 1 8 . 1 1 13 13 VAL N N 13 117.320 117.320 118.728 -1.408 18792 5696 1 8 . 1 1 13 13 VAL C C 13 177.272 177.272 177.669 -0.397 18792 5697 1 8 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.177 0.979 18792 5698 1 8 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.869 -0.640 18792 5699 1 8 . 1 1 13 13 VAL H H 13 7.629 7.629 7.624 0.005 18792 5700 1 8 . 1 1 14 14 VAL N N 14 116.659 116.659 120.181 -3.522 18792 5701 1 8 . 1 1 14 14 VAL C C 14 178.718 178.718 178.210 0.508 18792 5702 1 8 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.192 0.324 18792 5703 1 8 . 1 1 14 14 VAL CB C 14 30.374 30.374 30.899 -0.525 18792 5704 1 8 . 1 1 14 14 VAL H H 14 8.210 8.210 7.843 0.367 18792 5705 1 8 . 1 1 15 15 ASP N N 15 120.374 120.374 120.691 -0.317 18792 5706 1 8 . 1 1 15 15 ASP C C 15 177.557 177.557 178.571 -1.014 18792 5707 1 8 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.315 1.161 18792 5708 1 8 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.624 1.929 18792 5709 1 8 . 1 1 15 15 ASP H H 15 7.967 7.967 8.887 -0.920 18792 5710 1 8 . 1 1 16 16 PHE N N 16 119.864 119.864 121.501 -1.637 18792 5711 1 8 . 1 1 16 16 PHE C C 16 178.252 178.252 177.394 0.858 18792 5712 1 8 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.816 1.964 18792 5713 1 8 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.162 -0.102 18792 5714 1 8 . 1 1 16 16 PHE H H 16 8.228 8.228 8.017 0.211 18792 5715 1 8 . 1 1 17 17 LEU N N 17 116.312 116.312 118.640 -2.328 18792 5716 1 8 . 1 1 17 17 LEU C C 17 179.649 179.649 178.226 1.423 18792 5717 1 8 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.646 -0.882 18792 5718 1 8 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.296 -1.211 18792 5719 1 8 . 1 1 17 17 LEU H H 17 8.766 8.766 8.266 0.500 18792 5720 1 8 . 1 1 18 18 SER N N 18 113.715 113.715 115.275 -1.560 18792 5721 1 8 . 1 1 18 18 SER C C 18 177.362 177.362 176.247 1.115 18792 5722 1 8 . 1 1 18 18 SER CA C 18 61.948 61.948 61.285 0.663 18792 5723 1 8 . 1 1 18 18 SER CB C 18 63.003 63.003 63.336 -0.333 18792 5724 1 8 . 1 1 18 18 SER H H 18 8.384 8.384 7.903 0.481 18792 5725 1 8 . 1 1 19 19 TYR N N 19 124.570 124.570 123.861 0.709 18792 5726 1 8 . 1 1 19 19 TYR C C 19 178.415 178.415 177.367 1.048 18792 5727 1 8 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.161 -1.397 18792 5728 1 8 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.705 -1.689 18792 5729 1 8 . 1 1 19 19 TYR H H 19 8.155 8.155 8.787 -0.632 18792 5730 1 8 . 1 1 20 20 LYS N N 20 119.739 119.739 120.130 -0.391 18792 5731 1 8 . 1 1 20 20 LYS C C 20 180.456 180.456 178.700 1.756 18792 5732 1 8 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.736 -2.248 18792 5733 1 8 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.276 -4.117 18792 5734 1 8 . 1 1 20 20 LYS H H 20 8.224 8.224 7.734 0.490 18792 5735 1 8 . 1 1 21 21 LEU N N 21 118.092 118.092 119.948 -1.856 18792 5736 1 8 . 1 1 21 21 LEU C C 21 179.989 179.989 178.643 1.346 18792 5737 1 8 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.019 0.107 18792 5738 1 8 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.532 -1.924 18792 5739 1 8 . 1 1 21 21 LEU H H 21 8.586 8.586 7.956 0.630 18792 5740 1 8 . 1 1 22 22 SER N N 22 117.304 117.304 114.022 3.282 18792 5741 1 8 . 1 1 22 22 SER C C 22 180.152 180.152 176.286 3.866 18792 5742 1 8 . 1 1 22 22 SER CA C 22 61.287 61.287 60.684 0.603 18792 5743 1 8 . 1 1 22 22 SER H H 22 8.266 8.266 7.453 0.813 18792 5744 1 8 . 1 1 23 23 GLN N N 23 122.497 122.497 121.592 0.905 18792 5745 1 8 . 1 1 23 23 GLN C C 23 177.297 177.297 176.823 0.474 18792 5746 1 8 . 1 1 23 23 GLN CA C 23 57.942 57.942 57.961 -0.019 18792 5747 1 8 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.645 -0.834 18792 5748 1 8 . 1 1 23 23 GLN H H 23 7.571 7.571 7.506 0.065 18792 5749 1 8 . 1 1 24 24 LYS N N 24 116.038 116.038 115.828 0.210 18792 5750 1 8 . 1 1 24 24 LYS C C 24 175.704 175.704 174.915 0.789 18792 5751 1 8 . 1 1 24 24 LYS CA C 24 53.495 53.495 55.704 -2.209 18792 5752 1 8 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.638 -2.409 18792 5753 1 8 . 1 1 24 24 LYS H H 24 7.134 7.134 7.315 -0.181 18792 5754 1 8 . 1 1 25 25 GLY N N 25 105.283 105.283 106.719 -1.436 18792 5755 1 8 . 1 1 25 25 GLY C C 25 174.013 174.013 174.109 -0.096 18792 5756 1 8 . 1 1 25 25 GLY CA C 25 44.779 44.779 45.105 -0.326 18792 5757 1 8 . 1 1 25 25 GLY H H 25 7.483 7.483 7.338 0.145 18792 5758 1 8 . 1 1 26 26 TYR N N 26 119.547 119.547 120.890 -1.343 18792 5759 1 8 . 1 1 26 26 TYR C C 26 175.122 175.122 175.874 -0.752 18792 5760 1 8 . 1 1 26 26 TYR CA C 26 55.132 55.132 57.758 -2.626 18792 5761 1 8 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.004 1.076 18792 5762 1 8 . 1 1 26 26 TYR H H 26 7.788 7.788 7.353 0.435 18792 5763 1 8 . 1 1 27 27 SER N N 27 115.088 115.088 115.940 -0.852 18792 5764 1 8 . 1 1 27 27 SER C C 27 174.452 174.452 175.544 -1.092 18792 5765 1 8 . 1 1 27 27 SER CA C 27 56.306 56.306 59.545 -3.239 18792 5766 1 8 . 1 1 27 27 SER CB C 27 63.921 63.921 63.001 0.920 18792 5767 1 8 . 1 1 27 27 SER H H 27 8.473 8.473 8.780 -0.307 18792 5768 1 8 . 1 1 28 28 TRP N N 28 127.014 127.014 128.030 -1.016 18792 5769 1 8 . 1 1 28 28 TRP C C 28 177.002 177.002 177.176 -0.174 18792 5770 1 8 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.480 -0.008 18792 5771 1 8 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.271 0.559 18792 5772 1 8 . 1 1 28 28 TRP H H 28 8.897 8.897 8.929 -0.032 18792 5773 1 8 . 1 1 29 29 SER N N 29 112.044 112.044 113.787 -1.743 18792 5774 1 8 . 1 1 29 29 SER C C 29 175.106 175.106 175.545 -0.439 18792 5775 1 8 . 1 1 29 29 SER CA C 29 59.472 59.472 59.998 -0.526 18792 5776 1 8 . 1 1 29 29 SER CB C 29 62.226 62.226 63.164 -0.938 18792 5777 1 8 . 1 1 29 29 SER H H 29 8.129 8.129 8.043 0.086 18792 5778 1 8 . 1 1 30 30 GLN N N 30 119.160 119.160 119.876 -0.716 18792 5779 1 8 . 1 1 30 30 GLN C C 30 176.218 176.218 177.041 -0.823 18792 5780 1 8 . 1 1 30 30 GLN CA C 30 56.412 56.412 56.478 -0.066 18792 5781 1 8 . 1 1 30 30 GLN CB C 30 27.578 27.578 29.388 -1.810 18792 5782 1 8 . 1 1 30 30 GLN H H 30 7.370 7.370 7.720 -0.350 18792 5783 1 8 . 1 1 31 31 PHE N N 31 116.277 116.277 116.177 0.100 18792 5784 1 8 . 1 1 31 31 PHE C C 31 175.217 175.217 174.976 0.241 18792 5785 1 8 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.546 -3.312 18792 5786 1 8 . 1 1 31 31 PHE CB C 31 39.066 39.066 37.945 1.121 18792 5787 1 8 . 1 1 31 31 PHE H H 31 7.248 7.248 8.631 -1.383 18792 5788 1 8 . 1 1 32 32 SER N N 32 113.683 113.683 112.308 1.375 18792 5789 1 8 . 1 1 32 32 SER C C 32 173.793 173.793 172.243 1.550 18792 5790 1 8 . 1 1 32 32 SER CA C 32 57.124 57.124 56.668 0.456 18792 5791 1 8 . 1 1 32 32 SER CB C 32 63.081 63.081 64.935 -1.854 18792 5792 1 8 . 1 1 32 32 SER H H 32 7.242 7.242 7.656 -0.414 18792 5793 1 8 . 1 1 33 33 ASP N N 33 122.195 122.195 117.614 4.581 18792 5794 1 8 . 1 1 33 33 ASP C C 33 176.394 176.394 176.213 0.181 18792 5795 1 8 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.008 -1.260 18792 5796 1 8 . 1 1 33 33 ASP CB C 33 40.398 40.398 41.591 -1.193 18792 5797 1 8 . 1 1 33 33 ASP H H 33 8.257 8.257 8.502 -0.245 18792 5798 1 8 . 1 1 34 34 VAL N N 34 118.913 118.913 120.160 -1.247 18792 5799 1 8 . 1 1 34 34 VAL C C 34 176.328 176.328 177.947 -1.619 18792 5800 1 8 . 1 1 34 34 VAL CA C 34 61.891 61.891 63.945 -2.054 18792 5801 1 8 . 1 1 34 34 VAL CB C 34 32.015 32.015 31.758 0.257 18792 5802 1 8 . 1 1 34 34 VAL H H 34 7.852 7.852 7.969 -0.117 18792 5803 1 8 . 1 1 35 35 GLU N N 35 124.205 124.205 121.283 2.922 18792 5804 1 8 . 1 1 35 35 GLU C C 35 176.586 176.586 177.123 -0.537 18792 5805 1 8 . 1 1 35 35 GLU CA C 35 56.057 56.057 59.107 -3.050 18792 5806 1 8 . 1 1 35 35 GLU CB C 35 28.898 28.898 29.178 -0.280 18792 5807 1 8 . 1 1 35 35 GLU H H 35 8.401 8.401 8.850 -0.449 18792 5808 1 8 . 1 1 36 36 GLU N N 36 121.670 121.670 116.015 5.655 18792 5809 1 8 . 1 1 36 36 GLU C C 36 176.218 176.218 176.021 0.197 18792 5810 1 8 . 1 1 36 36 GLU CA C 36 55.988 55.988 55.110 0.878 18792 5811 1 8 . 1 1 36 36 GLU CB C 36 29.442 29.442 29.546 -0.104 18792 5812 1 8 . 1 1 36 36 GLU H H 36 8.239 8.239 7.989 0.250 18792 5813 1 8 . 1 1 37 37 ASN N N 37 119.252 119.252 118.697 0.555 18792 5814 1 8 . 1 1 37 37 ASN C C 37 175.003 175.003 173.532 1.471 18792 5815 1 8 . 1 1 37 37 ASN CA C 37 52.655 52.655 55.059 -2.404 18792 5816 1 8 . 1 1 37 37 ASN CB C 37 38.212 38.212 38.678 -0.466 18792 5817 1 8 . 1 1 37 37 ASN H H 37 8.412 8.412 7.727 0.685 18792 5818 1 8 . 1 1 38 38 ARG N N 38 121.622 121.622 118.275 3.347 18792 5819 1 8 . 1 1 38 38 ARG C C 38 176.610 176.610 175.606 1.004 18792 5820 1 8 . 1 1 38 38 ARG CA C 38 55.364 55.364 55.605 -0.241 18792 5821 1 8 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.919 -2.500 18792 5822 1 8 . 1 1 38 38 ARG H H 38 8.227 8.227 8.507 -0.280 18792 5823 1 8 . 1 1 39 39 THR N N 39 115.681 115.681 116.675 -0.994 18792 5824 1 8 . 1 1 39 39 THR C C 39 174.500 174.500 175.443 -0.943 18792 5825 1 8 . 1 1 39 39 THR CA C 39 61.606 61.606 62.850 -1.244 18792 5826 1 8 . 1 1 39 39 THR CB C 39 69.163 69.163 68.942 0.222 18792 5827 1 8 . 1 1 39 39 THR H H 39 8.173 8.173 8.586 -0.413 18792 5828 1 8 . 1 1 40 40 GLU N N 40 122.708 122.708 122.391 0.317 18792 5829 1 8 . 1 1 40 40 GLU C C 40 175.728 175.728 175.500 0.228 18792 5830 1 8 . 1 1 40 40 GLU CA C 40 55.772 55.772 55.946 -0.174 18792 5831 1 8 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.743 -0.689 18792 5832 1 8 . 1 1 40 40 GLU H H 40 8.298 8.298 8.732 -0.434 18792 5833 1 8 . 1 1 41 41 ALA N N 41 125.922 125.922 123.555 2.367 18792 5834 1 8 . 1 1 41 41 ALA C C 41 175.557 175.557 176.872 -1.315 18792 5835 1 8 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.041 -1.067 18792 5836 1 8 . 1 1 41 41 ALA CB C 41 17.245 17.245 18.774 -1.529 18792 5837 1 8 . 1 1 41 41 ALA H H 41 8.212 8.212 7.758 0.454 18792 5838 1 8 . 1 1 43 43 GLU N N 43 120.783 120.783 119.575 1.208 18792 5839 1 8 . 1 1 43 43 GLU C C 43 177.174 177.174 176.764 0.410 18792 5840 1 8 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.435 -0.094 18792 5841 1 8 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.663 -1.375 18792 5842 1 8 . 1 1 43 43 GLU H H 43 8.519 8.519 8.685 -0.166 18792 5843 1 8 . 1 1 44 44 GLY N N 44 110.022 110.022 110.390 -0.368 18792 5844 1 8 . 1 1 44 44 GLY C C 44 174.773 174.773 174.042 0.731 18792 5845 1 8 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.282 -0.254 18792 5846 1 8 . 1 1 44 44 GLY H H 44 8.429 8.429 8.379 0.050 18792 5847 1 8 . 1 1 45 45 THR N N 45 112.790 112.790 115.359 -2.569 18792 5848 1 8 . 1 1 45 45 THR C C 45 175.726 175.726 174.859 0.867 18792 5849 1 8 . 1 1 45 45 THR CA C 45 61.987 61.987 61.988 -0.001 18792 5850 1 8 . 1 1 45 45 THR CB C 45 69.304 69.304 69.188 0.116 18792 5851 1 8 . 1 1 45 45 THR H H 45 8.125 8.125 8.339 -0.214 18792 5852 1 8 . 1 1 46 46 GLU N N 46 122.752 122.752 121.570 1.182 18792 5853 1 8 . 1 1 46 46 GLU C C 46 177.419 177.419 175.901 1.518 18792 5854 1 8 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.059 1.173 18792 5855 1 8 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.561 -1.361 18792 5856 1 8 . 1 1 46 46 GLU H H 46 8.765 8.765 8.494 0.271 18792 5857 1 8 . 1 1 47 47 SER N N 47 114.895 114.895 112.633 2.262 18792 5858 1 8 . 1 1 47 47 SER C C 47 175.826 175.826 175.494 0.332 18792 5859 1 8 . 1 1 47 47 SER CA C 47 58.582 58.582 57.784 0.798 18792 5860 1 8 . 1 1 47 47 SER CB C 47 62.537 62.537 63.623 -1.086 18792 5861 1 8 . 1 1 47 47 SER H H 47 8.355 8.355 7.858 0.497 18792 5862 1 8 . 1 1 48 48 GLU N N 48 122.429 122.429 122.759 -0.330 18792 5863 1 8 . 1 1 48 48 GLU C C 48 178.099 178.099 177.657 0.442 18792 5864 1 8 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.545 0.073 18792 5865 1 8 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.080 -0.605 18792 5866 1 8 . 1 1 48 48 GLU H H 48 8.139 8.139 8.930 -0.791 18792 5867 1 8 . 1 1 49 49 ALA N N 49 120.374 120.374 122.509 -2.135 18792 5868 1 8 . 1 1 49 49 ALA C C 49 180.843 180.843 179.478 1.365 18792 5869 1 8 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.882 -0.399 18792 5870 1 8 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.306 -0.872 18792 5871 1 8 . 1 1 49 49 ALA H H 49 8.079 8.079 8.293 -0.214 18792 5872 1 8 . 1 1 50 50 VAL N N 50 118.599 118.599 118.994 -0.395 18792 5873 1 8 . 1 1 50 50 VAL C C 50 176.921 176.921 177.593 -0.672 18792 5874 1 8 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.764 -0.204 18792 5875 1 8 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.223 -0.926 18792 5876 1 8 . 1 1 50 50 VAL H H 50 7.419 7.419 8.093 -0.674 18792 5877 1 8 . 1 1 51 51 LYS N N 51 117.469 117.469 120.568 -3.099 18792 5878 1 8 . 1 1 51 51 LYS C C 51 179.061 179.061 178.526 0.535 18792 5879 1 8 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.937 -0.714 18792 5880 1 8 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.988 -0.992 18792 5881 1 8 . 1 1 51 51 LYS H H 51 7.359 7.359 7.712 -0.353 18792 5882 1 8 . 1 1 52 52 GLN N N 52 115.930 115.930 118.296 -2.366 18792 5883 1 8 . 1 1 52 52 GLN C C 52 177.713 177.713 178.092 -0.379 18792 5884 1 8 . 1 1 52 52 GLN CA C 52 58.476 58.476 59.037 -0.561 18792 5885 1 8 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.743 -2.175 18792 5886 1 8 . 1 1 52 52 GLN H H 52 8.025 8.025 7.978 0.047 18792 5887 1 8 . 1 1 53 53 ALA N N 53 119.782 119.782 122.429 -2.647 18792 5888 1 8 . 1 1 53 53 ALA C C 53 180.008 180.008 179.335 0.673 18792 5889 1 8 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.975 -0.590 18792 5890 1 8 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.645 -1.130 18792 5891 1 8 . 1 1 53 53 ALA H H 53 7.655 7.655 8.002 -0.347 18792 5892 1 8 . 1 1 54 54 LEU N N 54 120.443 120.443 119.262 1.181 18792 5893 1 8 . 1 1 54 54 LEU C C 54 179.330 179.330 178.072 1.258 18792 5894 1 8 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.690 1.323 18792 5895 1 8 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.215 -0.353 18792 5896 1 8 . 1 1 54 54 LEU H H 54 8.419 8.419 7.708 0.711 18792 5897 1 8 . 1 1 55 55 ARG N N 55 118.423 118.423 119.520 -1.097 18792 5898 1 8 . 1 1 55 55 ARG C C 55 178.767 178.767 178.405 0.362 18792 5899 1 8 . 1 1 55 55 ARG CA C 55 60.397 60.397 60.188 0.209 18792 5900 1 8 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.065 -1.322 18792 5901 1 8 . 1 1 55 55 ARG H H 55 8.062 8.062 7.856 0.206 18792 5902 1 8 . 1 1 56 56 GLU N N 56 115.988 115.988 118.258 -2.270 18792 5903 1 8 . 1 1 56 56 GLU C C 56 180.090 180.090 178.303 1.787 18792 5904 1 8 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.376 -0.616 18792 5905 1 8 . 1 1 56 56 GLU CB C 56 28.354 28.354 28.903 -0.549 18792 5906 1 8 . 1 1 56 56 GLU H H 56 7.772 7.772 8.043 -0.271 18792 5907 1 8 . 1 1 57 57 ALA N N 57 122.837 122.837 121.174 1.663 18792 5908 1 8 . 1 1 57 57 ALA C C 57 181.861 181.861 179.425 2.436 18792 5909 1 8 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.717 -0.083 18792 5910 1 8 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.566 -0.093 18792 5911 1 8 . 1 1 57 57 ALA H H 57 8.774 8.774 7.462 1.312 18792 5912 1 8 . 1 1 58 58 GLY N N 58 108.409 108.409 106.719 1.690 18792 5913 1 8 . 1 1 58 58 GLY C C 58 175.331 175.331 175.921 -0.590 18792 5914 1 8 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.882 -0.214 18792 5915 1 8 . 1 1 58 58 GLY H H 58 9.073 9.073 8.396 0.677 18792 5916 1 8 . 1 1 59 59 ASP N N 59 122.074 122.074 122.428 -0.354 18792 5917 1 8 . 1 1 59 59 ASP C C 59 179.023 179.023 178.601 0.422 18792 5918 1 8 . 1 1 59 59 ASP CA C 59 57.302 57.302 58.115 -0.813 18792 5919 1 8 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.911 -2.069 18792 5920 1 8 . 1 1 59 59 ASP H H 59 8.049 8.049 8.396 -0.347 18792 5921 1 8 . 1 1 60 60 GLU N N 60 120.131 120.131 120.298 -0.167 18792 5922 1 8 . 1 1 60 60 GLU C C 60 178.522 178.522 178.945 -0.423 18792 5923 1 8 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.273 -0.264 18792 5924 1 8 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.938 -1.738 18792 5925 1 8 . 1 1 60 60 GLU H H 60 8.136 8.136 7.921 0.215 18792 5926 1 8 . 1 1 61 61 PHE N N 61 121.309 121.309 120.518 0.791 18792 5927 1 8 . 1 1 61 61 PHE C C 61 176.904 176.904 176.957 -0.053 18792 5928 1 8 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.163 0.159 18792 5929 1 8 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.713 -1.104 18792 5930 1 8 . 1 1 61 61 PHE H H 61 8.523 8.523 8.013 0.510 18792 5931 1 8 . 1 1 62 62 GLU N N 62 115.971 115.971 119.448 -3.477 18792 5932 1 8 . 1 1 62 62 GLU C C 62 177.713 177.713 178.101 -0.388 18792 5933 1 8 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.844 -0.653 18792 5934 1 8 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.980 -1.702 18792 5935 1 8 . 1 1 62 62 GLU H H 62 7.969 7.969 8.372 -0.403 18792 5936 1 8 . 1 1 63 63 LEU N N 63 116.703 116.703 118.785 -2.082 18792 5937 1 8 . 1 1 63 63 LEU C C 63 178.963 178.963 179.222 -0.259 18792 5938 1 8 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.290 -0.878 18792 5939 1 8 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.179 -0.773 18792 5940 1 8 . 1 1 63 63 LEU H H 63 7.347 7.347 8.023 -0.676 18792 5941 1 8 . 1 1 64 64 ARG N N 64 117.453 117.453 117.489 -0.036 18792 5942 1 8 . 1 1 64 64 ARG C C 64 177.297 177.297 176.744 0.553 18792 5943 1 8 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.995 0.342 18792 5944 1 8 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.417 -0.820 18792 5945 1 8 . 1 1 64 64 ARG H H 64 7.995 7.995 7.702 0.293 18792 5946 1 8 . 1 1 65 65 TYR N N 65 118.956 118.956 118.212 0.744 18792 5947 1 8 . 1 1 65 65 TYR C C 65 175.278 175.278 174.562 0.716 18792 5948 1 8 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.588 -2.887 18792 5949 1 8 . 1 1 65 65 TYR CB C 65 35.986 35.986 36.399 -0.413 18792 5950 1 8 . 1 1 65 65 TYR H H 65 7.909 7.909 7.449 0.460 18792 5951 1 8 . 1 1 66 66 ARG N N 66 119.438 119.438 122.099 -2.661 18792 5952 1 8 . 1 1 66 66 ARG C C 66 178.424 178.424 177.548 0.876 18792 5953 1 8 . 1 1 66 66 ARG CA C 66 58.476 58.476 56.917 1.559 18792 5954 1 8 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.841 -2.020 18792 5955 1 8 . 1 1 66 66 ARG H H 66 7.244 7.244 7.044 0.200 18792 5956 1 8 . 1 1 67 67 ARG N N 67 118.936 118.936 127.084 -8.148 18792 5957 1 8 . 1 1 67 67 ARG C C 67 177.542 177.542 177.495 0.047 18792 5958 1 8 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.109 -1.665 18792 5959 1 8 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.234 -1.113 18792 5960 1 8 . 1 1 67 67 ARG H H 67 8.417 8.417 8.870 -0.453 18792 5961 1 8 . 1 1 68 68 ALA N N 68 121.797 121.797 121.167 0.630 18792 5962 1 8 . 1 1 68 68 ALA C C 68 180.337 180.337 179.440 0.897 18792 5963 1 8 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.693 -0.557 18792 5964 1 8 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.367 -0.900 18792 5965 1 8 . 1 1 68 68 ALA H H 68 7.827 7.827 8.247 -0.420 18792 5966 1 8 . 1 1 69 69 PHE N N 69 115.986 115.986 118.515 -2.529 18792 5967 1 8 . 1 1 69 69 PHE C C 69 177.468 177.468 176.929 0.539 18792 5968 1 8 . 1 1 69 69 PHE CA C 69 58.049 58.049 58.481 -0.432 18792 5969 1 8 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.911 -1.312 18792 5970 1 8 . 1 1 69 69 PHE H H 69 8.517 8.517 8.689 -0.172 18792 5971 1 8 . 1 1 70 70 SER N N 70 116.526 116.526 117.159 -0.633 18792 5972 1 8 . 1 1 70 70 SER C C 70 177.640 177.640 176.517 1.123 18792 5973 1 8 . 1 1 70 70 SER CA C 70 61.073 61.073 61.749 -0.676 18792 5974 1 8 . 1 1 70 70 SER CB C 70 61.993 61.993 62.873 -0.880 18792 5975 1 8 . 1 1 70 70 SER H H 70 8.152 8.152 7.598 0.554 18792 5976 1 8 . 1 1 71 71 ASP N N 71 121.181 121.181 120.689 0.492 18792 5977 1 8 . 1 1 71 71 ASP C C 71 178.546 178.546 178.543 0.003 18792 5978 1 8 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.031 -0.582 18792 5979 1 8 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.767 -1.536 18792 5980 1 8 . 1 1 71 71 ASP H H 71 8.356 8.356 7.624 0.732 18792 5981 1 8 . 1 1 72 72 LEU N N 72 120.747 120.747 120.330 0.417 18792 5982 1 8 . 1 1 72 72 LEU C C 72 178.963 178.963 178.981 -0.018 18792 5983 1 8 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.230 -0.786 18792 5984 1 8 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.102 -1.085 18792 5985 1 8 . 1 1 72 72 LEU H H 72 7.738 7.738 7.360 0.378 18792 5986 1 8 . 1 1 73 73 THR N N 73 109.432 109.432 111.743 -2.311 18792 5987 1 8 . 1 1 73 73 THR C C 73 177.481 177.481 176.055 1.426 18792 5988 1 8 . 1 1 73 73 THR CA C 73 65.128 65.128 64.887 0.241 18792 5989 1 8 . 1 1 73 73 THR CB C 73 67.720 67.720 68.074 -0.354 18792 5990 1 8 . 1 1 73 73 THR H H 73 8.296 8.296 8.176 0.120 18792 5991 1 8 . 1 1 74 74 SER N N 74 115.862 115.862 115.065 0.797 18792 5992 1 8 . 1 1 74 74 SER C C 74 175.361 175.361 176.033 -0.672 18792 5993 1 8 . 1 1 74 74 SER CA C 74 60.112 60.112 59.906 0.206 18792 5994 1 8 . 1 1 74 74 SER CB C 74 62.537 62.537 63.486 -0.949 18792 5995 1 8 . 1 1 74 74 SER H H 74 7.629 7.629 7.943 -0.314 18792 5996 1 8 . 1 1 75 75 GLN N N 75 118.551 118.551 119.442 -0.891 18792 5997 1 8 . 1 1 75 75 GLN C C 75 176.316 176.316 176.952 -0.636 18792 5998 1 8 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.305 0.499 18792 5999 1 8 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.538 -1.261 18792 6000 1 8 . 1 1 75 75 GLN H H 75 7.640 7.640 7.577 0.063 18792 6001 1 8 . 1 1 76 76 LEU N N 76 118.313 118.313 117.127 1.186 18792 6002 1 8 . 1 1 76 76 LEU C C 76 174.160 174.160 175.393 -1.233 18792 6003 1 8 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.715 -0.975 18792 6004 1 8 . 1 1 76 76 LEU CB C 76 42.727 42.727 41.328 1.399 18792 6005 1 8 . 1 1 76 76 LEU H H 76 7.411 7.411 7.685 -0.274 18792 6006 1 8 . 1 1 77 77 HIS N N 77 120.104 120.104 119.406 0.698 18792 6007 1 8 . 1 1 77 77 HIS C C 77 174.528 174.528 174.373 0.155 18792 6008 1 8 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.778 -1.571 18792 6009 1 8 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.486 -0.520 18792 6010 1 8 . 1 1 77 77 HIS H H 77 8.117 8.117 8.486 -0.369 18792 6011 1 8 . 1 1 78 78 ILE N N 78 122.298 122.298 121.604 0.694 18792 6012 1 8 . 1 1 78 78 ILE C C 78 174.240 174.240 175.561 -1.321 18792 6013 1 8 . 1 1 78 78 ILE CA C 78 61.402 61.402 62.490 -1.088 18792 6014 1 8 . 1 1 78 78 ILE CB C 78 37.591 37.591 38.746 -1.155 18792 6015 1 8 . 1 1 78 78 ILE H H 78 8.655 8.655 8.047 0.608 18792 6016 1 8 . 1 1 79 79 THR N N 79 116.442 116.442 114.538 1.904 18792 6017 1 8 . 1 1 79 79 THR C C 79 174.291 174.291 172.110 2.181 18792 6018 1 8 . 1 1 79 79 THR CA C 79 61.632 61.632 61.670 -0.038 18792 6019 1 8 . 1 1 79 79 THR CB C 79 68.704 68.704 67.656 1.048 18792 6020 1 8 . 1 1 79 79 THR H H 79 8.245 8.245 8.140 0.105 18792 6021 1 8 . 1 1 84 84 TYR N N 84 120.888 120.888 120.137 0.751 18792 6022 1 8 . 1 1 84 84 TYR C C 84 176.708 176.708 176.931 -0.223 18792 6023 1 8 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.221 -0.789 18792 6024 1 8 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.348 -1.603 18792 6025 1 8 . 1 1 84 84 TYR H H 84 8.733 8.733 8.414 0.319 18792 6026 1 8 . 1 1 85 85 GLN N N 85 114.530 114.530 118.961 -4.431 18792 6027 1 8 . 1 1 85 85 GLN C C 85 178.473 178.473 178.128 0.345 18792 6028 1 8 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.252 0.042 18792 6029 1 8 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.956 -1.155 18792 6030 1 8 . 1 1 85 85 GLN H H 85 8.413 8.413 8.623 -0.210 18792 6031 1 8 . 1 1 86 86 SER N N 86 114.032 114.032 114.471 -0.439 18792 6032 1 8 . 1 1 86 86 SER C C 86 178.473 178.473 176.219 2.254 18792 6033 1 8 . 1 1 86 86 SER CA C 86 62.175 62.175 61.854 0.321 18792 6034 1 8 . 1 1 86 86 SER CB C 86 63.252 63.252 62.955 0.297 18792 6035 1 8 . 1 1 86 86 SER H H 86 7.258 7.258 8.150 -0.892 18792 6036 1 8 . 1 1 88 88 GLU N N 88 119.386 119.386 118.990 0.396 18792 6037 1 8 . 1 1 88 88 GLU C C 88 177.199 177.199 178.752 -1.553 18792 6038 1 8 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.759 -1.177 18792 6039 1 8 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.206 -0.230 18792 6040 1 8 . 1 1 88 88 GLU H H 88 8.534 8.534 7.923 0.611 18792 6041 1 8 . 1 1 89 89 GLN N N 89 114.678 114.678 119.458 -4.780 18792 6042 1 8 . 1 1 89 89 GLN C C 89 178.669 178.669 178.572 0.097 18792 6043 1 8 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.185 -0.603 18792 6044 1 8 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.730 -1.308 18792 6045 1 8 . 1 1 89 89 GLN H H 89 7.500 7.500 7.666 -0.166 18792 6046 1 8 . 1 1 90 90 VAL N N 90 118.174 118.174 119.593 -1.419 18792 6047 1 8 . 1 1 90 90 VAL C C 90 178.081 178.081 177.763 0.318 18792 6048 1 8 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.958 -0.403 18792 6049 1 8 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.662 -0.055 18792 6050 1 8 . 1 1 90 90 VAL H H 90 7.017 7.017 8.223 -1.206 18792 6051 1 8 . 1 1 91 91 VAL N N 91 119.489 119.489 120.085 -0.596 18792 6052 1 8 . 1 1 91 91 VAL C C 91 177.914 177.914 177.744 0.170 18792 6053 1 8 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.338 -0.569 18792 6054 1 8 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.683 -0.393 18792 6055 1 8 . 1 1 91 91 VAL H H 91 7.833 7.833 8.348 -0.515 18792 6056 1 8 . 1 1 92 92 ASN N N 92 117.180 117.180 118.199 -1.019 18792 6057 1 8 . 1 1 92 92 ASN C C 92 179.110 179.110 177.072 2.038 18792 6058 1 8 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.798 -1.880 18792 6059 1 8 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.590 -2.622 18792 6060 1 8 . 1 1 92 92 ASN H H 92 8.368 8.368 8.246 0.122 18792 6061 1 8 . 1 1 93 93 GLU N N 93 118.476 118.476 119.612 -1.136 18792 6062 1 8 . 1 1 93 93 GLU C C 93 179.355 179.355 179.471 -0.116 18792 6063 1 8 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.899 -0.494 18792 6064 1 8 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.844 -2.111 18792 6065 1 8 . 1 1 93 93 GLU H H 93 7.213 7.213 7.735 -0.522 18792 6066 1 8 . 1 1 94 94 LEU N N 94 120.889 120.889 121.074 -0.185 18792 6067 1 8 . 1 1 94 94 LEU C C 94 178.473 178.473 178.906 -0.433 18792 6068 1 8 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.446 -0.429 18792 6069 1 8 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.467 -1.537 18792 6070 1 8 . 1 1 94 94 LEU H H 94 7.446 7.446 7.833 -0.387 18792 6071 1 8 . 1 1 95 95 PHE N N 95 112.902 112.902 119.060 -6.158 18792 6072 1 8 . 1 1 95 95 PHE C C 95 176.586 176.586 176.856 -0.270 18792 6073 1 8 . 1 1 95 95 PHE CA C 95 57.159 57.159 58.675 -1.516 18792 6074 1 8 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.888 -0.667 18792 6075 1 8 . 1 1 95 95 PHE H H 95 6.916 6.916 8.457 -1.541 18792 6076 1 8 . 1 1 96 96 ARG N N 96 123.729 123.729 118.629 5.100 18792 6077 1 8 . 1 1 96 96 ARG C C 96 177.272 177.272 176.760 0.512 18792 6078 1 8 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.236 0.987 18792 6079 1 8 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.407 -1.975 18792 6080 1 8 . 1 1 96 96 ARG H H 96 7.126 7.126 7.510 -0.384 18792 6081 1 8 . 1 1 97 97 ASP N N 97 116.576 116.576 114.636 1.940 18792 6082 1 8 . 1 1 97 97 ASP C C 97 175.687 175.687 174.300 1.387 18792 6083 1 8 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.047 -0.374 18792 6084 1 8 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.392 -3.347 18792 6085 1 8 . 1 1 97 97 ASP H H 97 8.644 8.644 7.806 0.838 18792 6086 1 8 . 1 1 98 98 GLY N N 98 108.551 108.551 107.497 1.054 18792 6087 1 8 . 1 1 98 98 GLY C C 98 172.690 172.690 173.298 -0.608 18792 6088 1 8 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.407 -2.157 18792 6089 1 8 . 1 1 98 98 GLY H H 98 7.463 7.463 7.490 -0.027 18792 6090 1 8 . 1 1 99 99 VAL N N 99 120.630 120.630 121.123 -0.493 18792 6091 1 8 . 1 1 99 99 VAL C C 99 174.503 174.503 174.611 -0.108 18792 6092 1 8 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.243 -0.925 18792 6093 1 8 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.748 -1.984 18792 6094 1 8 . 1 1 99 99 VAL H H 99 8.184 8.184 8.697 -0.513 18792 6095 1 8 . 1 1 100 100 ASN N N 100 115.485 115.485 114.454 1.031 18792 6096 1 8 . 1 1 100 100 ASN C C 100 175.239 175.239 176.926 -1.687 18792 6097 1 8 . 1 1 100 100 ASN CA C 100 51.361 51.361 53.823 -2.462 18792 6098 1 8 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.217 0.703 18792 6099 1 8 . 1 1 100 100 ASN H H 100 6.241 6.241 7.820 -1.579 18792 6100 1 8 . 1 1 101 101 TRP N N 101 118.266 118.266 120.680 -2.414 18792 6101 1 8 . 1 1 101 101 TRP C C 101 178.301 178.301 175.663 2.638 18792 6102 1 8 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.241 1.298 18792 6103 1 8 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.206 1.624 18792 6104 1 8 . 1 1 101 101 TRP H H 101 8.409 8.409 8.574 -0.165 18792 6105 1 8 . 1 1 102 102 GLY N N 102 106.147 106.147 106.727 -0.580 18792 6106 1 8 . 1 1 102 102 GLY C C 102 177.640 177.640 174.764 2.876 18792 6107 1 8 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.440 2.474 18792 6108 1 8 . 1 1 102 102 GLY H H 102 8.504 8.504 7.321 1.183 18792 6109 1 8 . 1 1 103 103 ARG N N 103 121.347 121.347 121.850 -0.503 18792 6110 1 8 . 1 1 103 103 ARG C C 103 177.738 177.738 178.064 -0.326 18792 6111 1 8 . 1 1 103 103 ARG CA C 103 57.942 57.942 59.218 -1.276 18792 6112 1 8 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.502 -0.283 18792 6113 1 8 . 1 1 103 103 ARG H H 103 8.099 8.099 8.226 -0.127 18792 6114 1 8 . 1 1 104 104 ILE N N 104 120.930 120.930 118.551 2.379 18792 6115 1 8 . 1 1 104 104 ILE C C 104 178.197 178.197 178.027 0.170 18792 6116 1 8 . 1 1 104 104 ILE CA C 104 66.535 66.535 62.609 3.926 18792 6117 1 8 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.316 -1.271 18792 6118 1 8 . 1 1 104 104 ILE H H 104 7.690 7.690 7.837 -0.147 18792 6119 1 8 . 1 1 105 105 VAL N N 105 120.938 120.938 120.791 0.147 18792 6120 1 8 . 1 1 105 105 VAL C C 105 177.854 177.854 177.363 0.491 18792 6121 1 8 . 1 1 105 105 VAL CA C 105 67.458 67.458 67.097 0.361 18792 6122 1 8 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.754 -0.380 18792 6123 1 8 . 1 1 105 105 VAL H H 105 8.245 8.245 7.456 0.789 18792 6124 1 8 . 1 1 106 106 ALA N N 106 121.165 121.165 120.633 0.532 18792 6125 1 8 . 1 1 106 106 ALA C C 106 178.284 178.284 178.924 -0.640 18792 6126 1 8 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.013 0.585 18792 6127 1 8 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.164 -0.649 18792 6128 1 8 . 1 1 106 106 ALA H H 106 7.529 7.529 7.600 -0.071 18792 6129 1 8 . 1 1 107 107 PHE N N 107 119.242 119.242 120.240 -0.998 18792 6130 1 8 . 1 1 107 107 PHE C C 107 176.390 176.390 177.039 -0.649 18792 6131 1 8 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.457 -0.284 18792 6132 1 8 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.893 -1.806 18792 6133 1 8 . 1 1 107 107 PHE H H 107 7.974 7.974 7.661 0.313 18792 6134 1 8 . 1 1 108 108 PHE N N 108 120.009 120.009 119.897 0.112 18792 6135 1 8 . 1 1 108 108 PHE C C 108 177.640 177.640 177.049 0.591 18792 6136 1 8 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.783 0.641 18792 6137 1 8 . 1 1 108 108 PHE CB C 108 35.346 35.346 39.048 -3.702 18792 6138 1 8 . 1 1 108 108 PHE H H 108 7.946 7.946 8.364 -0.418 18792 6139 1 8 . 1 1 109 109 SER N N 109 114.631 114.631 115.837 -1.206 18792 6140 1 8 . 1 1 109 109 SER C C 109 177.770 177.770 176.308 1.462 18792 6141 1 8 . 1 1 109 109 SER CA C 109 63.349 63.349 61.650 1.700 18792 6142 1 8 . 1 1 109 109 SER H H 109 8.424 8.424 7.487 0.937 18792 6143 1 8 . 1 1 110 110 PHE N N 110 124.230 124.230 124.037 0.193 18792 6144 1 8 . 1 1 110 110 PHE C C 110 176.708 176.708 177.247 -0.539 18792 6145 1 8 . 1 1 110 110 PHE CA C 110 59.614 59.614 60.420 -0.806 18792 6146 1 8 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.976 -1.532 18792 6147 1 8 . 1 1 110 110 PHE H H 110 9.052 9.052 8.496 0.556 18792 6148 1 8 . 1 1 111 111 GLY N N 111 105.893 105.893 106.559 -0.666 18792 6149 1 8 . 1 1 111 111 GLY C C 111 176.795 176.795 175.887 0.908 18792 6150 1 8 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.593 0.783 18792 6151 1 8 . 1 1 111 111 GLY H H 111 7.926 7.926 8.906 -0.980 18792 6152 1 8 . 1 1 112 112 GLY N N 112 107.410 107.410 109.186 -1.776 18792 6153 1 8 . 1 1 112 112 GLY C C 112 174.650 174.650 175.270 -0.620 18792 6154 1 8 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.029 1.276 18792 6155 1 8 . 1 1 112 112 GLY H H 112 8.799 8.799 7.946 0.853 18792 6156 1 8 . 1 1 113 113 ALA N N 113 124.313 124.313 124.855 -0.542 18792 6157 1 8 . 1 1 113 113 ALA C C 113 181.300 181.300 179.218 2.082 18792 6158 1 8 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.719 -0.192 18792 6159 1 8 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.530 -1.047 18792 6160 1 8 . 1 1 113 113 ALA H H 113 8.212 8.212 7.760 0.452 18792 6161 1 8 . 1 1 114 114 LEU N N 114 118.878 118.878 119.201 -0.323 18792 6162 1 8 . 1 1 114 114 LEU C C 114 180.286 180.286 178.440 1.846 18792 6163 1 8 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.992 -1.010 18792 6164 1 8 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.629 -0.612 18792 6165 1 8 . 1 1 114 114 LEU H H 114 8.161 8.161 7.779 0.382 18792 6166 1 8 . 1 1 115 115 CYS N N 115 119.002 119.002 116.765 2.237 18792 6167 1 8 . 1 1 115 115 CYS C C 115 176.087 176.087 176.597 -0.510 18792 6168 1 8 . 1 1 115 115 CYS CA C 115 63.944 63.944 64.498 -0.554 18792 6169 1 8 . 1 1 115 115 CYS CB C 115 25.635 25.635 26.819 -1.184 18792 6170 1 8 . 1 1 115 115 CYS H H 115 8.070 8.070 7.802 0.268 18792 6171 1 8 . 1 1 116 116 VAL N N 116 118.737 118.737 120.023 -1.286 18792 6172 1 8 . 1 1 116 116 VAL C C 116 177.494 177.494 178.240 -0.746 18792 6173 1 8 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.343 0.419 18792 6174 1 8 . 1 1 116 116 VAL CB C 116 30.763 30.763 30.883 -0.120 18792 6175 1 8 . 1 1 116 116 VAL H H 116 7.995 7.995 7.633 0.362 18792 6176 1 8 . 1 1 117 117 GLU N N 117 118.886 118.886 119.492 -0.606 18792 6177 1 8 . 1 1 117 117 GLU C C 117 178.424 178.424 179.275 -0.851 18792 6178 1 8 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.723 -0.963 18792 6179 1 8 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.121 -1.067 18792 6180 1 8 . 1 1 117 117 GLU H H 117 8.059 8.059 7.966 0.093 18792 6181 1 8 . 1 1 118 118 SER N N 118 113.417 113.417 115.893 -2.476 18792 6182 1 8 . 1 1 118 118 SER C C 118 175.607 175.607 176.626 -1.019 18792 6183 1 8 . 1 1 118 118 SER CA C 118 62.638 62.638 61.568 1.070 18792 6184 1 8 . 1 1 118 118 SER CB C 118 61.061 61.061 62.954 -1.893 18792 6185 1 8 . 1 1 118 118 SER H H 118 7.626 7.626 7.406 0.220 18792 6186 1 8 . 1 1 119 119 VAL N N 119 120.612 120.612 122.018 -1.406 18792 6187 1 8 . 1 1 119 119 VAL C C 119 179.713 179.713 178.282 1.431 18792 6188 1 8 . 1 1 119 119 VAL CA C 119 66.225 66.225 66.332 -0.107 18792 6189 1 8 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.238 -1.159 18792 6190 1 8 . 1 1 119 119 VAL H H 119 7.297 7.297 7.697 -0.400 18792 6191 1 8 . 1 1 120 120 ASP N N 120 122.546 122.546 119.536 3.010 18792 6192 1 8 . 1 1 120 120 ASP C C 120 178.057 178.057 177.434 0.623 18792 6193 1 8 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.079 0.910 18792 6194 1 8 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.374 -0.451 18792 6195 1 8 . 1 1 120 120 ASP H H 120 8.264 8.264 7.881 0.383 18792 6196 1 8 . 1 1 121 121 LYS N N 121 115.636 115.636 118.191 -2.555 18792 6197 1 8 . 1 1 121 121 LYS C C 121 175.159 175.159 175.589 -0.430 18792 6198 1 8 . 1 1 121 121 LYS CA C 121 55.260 55.260 55.819 -0.559 18792 6199 1 8 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.178 -1.403 18792 6200 1 8 . 1 1 121 121 LYS H H 121 7.558 7.558 7.320 0.238 18792 6201 1 8 . 1 1 122 122 GLU N N 122 113.915 113.915 113.332 0.583 18792 6202 1 8 . 1 1 122 122 GLU C C 122 176.109 176.109 176.348 -0.239 18792 6203 1 8 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.023 -0.716 18792 6204 1 8 . 1 1 122 122 GLU CB C 122 25.332 25.332 26.985 -1.653 18792 6205 1 8 . 1 1 122 122 GLU H H 122 7.826 7.826 7.838 -0.012 18792 6206 1 8 . 1 1 124 124 GLN N N 124 119.233 119.233 121.013 -1.780 18792 6207 1 8 . 1 1 124 124 GLN C C 124 177.640 177.640 176.972 0.668 18792 6208 1 8 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.930 0.542 18792 6209 1 8 . 1 1 124 124 GLN CB C 124 26.490 26.490 27.461 -0.971 18792 6210 1 8 . 1 1 124 124 GLN H H 124 8.626 8.626 8.513 0.113 18792 6211 1 8 . 1 1 125 125 VAL N N 125 117.011 117.011 119.863 -2.852 18792 6212 1 8 . 1 1 125 125 VAL C C 125 175.826 175.826 176.916 -1.090 18792 6213 1 8 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.866 -1.730 18792 6214 1 8 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.349 -1.052 18792 6215 1 8 . 1 1 125 125 VAL H H 125 7.870 7.870 7.936 -0.066 18792 6216 1 8 . 1 1 126 126 LEU N N 126 117.058 117.058 117.743 -0.685 18792 6217 1 8 . 1 1 126 126 LEU C C 126 178.096 178.096 178.453 -0.357 18792 6218 1 8 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.050 -1.965 18792 6219 1 8 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.574 -2.301 18792 6220 1 8 . 1 1 126 126 LEU H H 126 7.747 7.747 7.886 -0.139 18792 6221 1 8 . 1 1 127 127 VAL N N 127 119.457 119.457 121.632 -2.175 18792 6222 1 8 . 1 1 127 127 VAL C C 127 177.150 177.150 178.197 -1.047 18792 6223 1 8 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.147 1.009 18792 6224 1 8 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.427 -0.674 18792 6225 1 8 . 1 1 127 127 VAL H H 127 7.306 7.306 7.560 -0.254 18792 6226 1 8 . 1 1 128 128 SER N N 128 110.647 110.647 115.048 -4.401 18792 6227 1 8 . 1 1 128 128 SER C C 128 177.222 177.222 176.648 0.574 18792 6228 1 8 . 1 1 128 128 SER CA C 128 60.752 60.752 61.689 -0.937 18792 6229 1 8 . 1 1 128 128 SER CB C 128 61.605 61.605 62.849 -1.244 18792 6230 1 8 . 1 1 128 128 SER H H 128 8.237 8.237 7.835 0.402 18792 6231 1 8 . 1 1 129 129 ARG N N 129 123.100 123.100 122.522 0.578 18792 6232 1 8 . 1 1 129 129 ARG C C 129 175.802 175.802 178.715 -2.913 18792 6233 1 8 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.401 -1.175 18792 6234 1 8 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.148 -1.949 18792 6235 1 8 . 1 1 129 129 ARG H H 129 6.564 6.564 7.854 -1.290 18792 6236 1 8 . 1 1 130 130 ILE N N 130 118.182 118.182 119.758 -1.576 18792 6237 1 8 . 1 1 130 130 ILE C C 130 178.156 178.156 177.700 0.456 18792 6238 1 8 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.340 -0.994 18792 6239 1 8 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.824 -1.142 18792 6240 1 8 . 1 1 130 130 ILE H H 130 7.955 7.955 7.671 0.284 18792 6241 1 8 . 1 1 131 131 ALA N N 131 119.029 119.029 122.290 -3.261 18792 6242 1 8 . 1 1 131 131 ALA C C 131 179.593 179.593 179.082 0.511 18792 6243 1 8 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.040 -0.442 18792 6244 1 8 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.172 -0.784 18792 6245 1 8 . 1 1 131 131 ALA H H 131 7.582 7.582 8.461 -0.879 18792 6246 1 8 . 1 1 132 132 ALA N N 132 120.336 120.336 121.876 -1.540 18792 6247 1 8 . 1 1 132 132 ALA C C 132 181.095 181.095 178.875 2.220 18792 6248 1 8 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.796 -0.198 18792 6249 1 8 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.815 -2.114 18792 6250 1 8 . 1 1 132 132 ALA H H 132 7.224 7.224 8.190 -0.966 18792 6251 1 8 . 1 1 133 133 TRP N N 133 121.194 121.194 121.255 -0.061 18792 6252 1 8 . 1 1 133 133 TRP C C 133 179.698 179.698 177.753 1.945 18792 6253 1 8 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.002 -2.700 18792 6254 1 8 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.918 -2.263 18792 6255 1 8 . 1 1 133 133 TRP H H 133 8.925 8.925 8.489 0.436 18792 6256 1 8 . 1 1 134 134 MET N N 134 116.987 116.987 119.147 -2.160 18792 6257 1 8 . 1 1 134 134 MET C C 134 178.277 178.277 177.736 0.541 18792 6258 1 8 . 1 1 134 134 MET CA C 134 59.578 59.578 58.499 1.079 18792 6259 1 8 . 1 1 134 134 MET CB C 134 33.559 33.559 32.104 1.455 18792 6260 1 8 . 1 1 134 134 MET H H 134 8.863 8.863 8.299 0.564 18792 6261 1 8 . 1 1 135 135 ALA N N 135 120.523 120.523 120.801 -0.278 18792 6262 1 8 . 1 1 135 135 ALA C C 135 179.298 179.298 179.283 0.015 18792 6263 1 8 . 1 1 135 135 ALA CA C 135 55.433 55.433 54.941 0.492 18792 6264 1 8 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.287 -1.649 18792 6265 1 8 . 1 1 135 135 ALA H H 135 8.152 8.152 8.234 -0.082 18792 6266 1 8 . 1 1 136 136 THR N N 136 116.715 116.715 117.883 -1.168 18792 6267 1 8 . 1 1 136 136 THR C C 136 175.106 175.106 176.143 -1.037 18792 6268 1 8 . 1 1 136 136 THR CA C 136 66.729 66.729 67.091 -0.362 18792 6269 1 8 . 1 1 136 136 THR CB C 136 68.441 68.441 69.030 -0.589 18792 6270 1 8 . 1 1 136 136 THR H H 136 8.532 8.532 7.975 0.557 18792 6271 1 8 . 1 1 137 137 TYR N N 137 123.204 123.204 122.328 0.876 18792 6272 1 8 . 1 1 137 137 TYR C C 137 179.592 179.592 177.288 2.304 18792 6273 1 8 . 1 1 137 137 TYR CA C 137 63.065 63.065 60.943 2.122 18792 6274 1 8 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.678 0.309 18792 6275 1 8 . 1 1 137 137 TYR H H 137 8.809 8.809 7.486 1.323 18792 6276 1 8 . 1 1 138 138 LEU N N 138 119.247 119.247 120.464 -1.217 18792 6277 1 8 . 1 1 138 138 LEU C C 138 178.385 178.385 178.241 0.144 18792 6278 1 8 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.372 0.566 18792 6279 1 8 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.996 -0.288 18792 6280 1 8 . 1 1 138 138 LEU H H 138 8.742 8.742 8.155 0.587 18792 6281 1 8 . 1 1 139 139 ASN N N 139 117.122 117.122 116.190 0.932 18792 6282 1 8 . 1 1 139 139 ASN C C 139 176.417 176.417 176.979 -0.562 18792 6283 1 8 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.341 1.107 18792 6284 1 8 . 1 1 139 139 ASN CB C 139 38.652 38.652 37.642 1.010 18792 6285 1 8 . 1 1 139 139 ASN H H 139 8.307 8.307 8.004 0.303 18792 6286 1 8 . 1 1 140 140 ASP N N 140 115.394 115.394 120.765 -5.371 18792 6287 1 8 . 1 1 140 140 ASP C C 140 177.919 177.919 176.523 1.396 18792 6288 1 8 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.468 -0.515 18792 6289 1 8 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.676 -1.290 18792 6290 1 8 . 1 1 140 140 ASP H H 140 8.439 8.439 7.979 0.460 18792 6291 1 8 . 1 1 141 141 HIS N N 141 111.695 111.695 113.486 -1.791 18792 6292 1 8 . 1 1 141 141 HIS C C 141 175.949 175.949 176.125 -0.176 18792 6293 1 8 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.704 -0.647 18792 6294 1 8 . 1 1 141 141 HIS CB C 141 29.908 29.908 31.903 -1.995 18792 6295 1 8 . 1 1 141 141 HIS H H 141 8.043 8.043 7.125 0.918 18792 6296 1 8 . 1 1 142 142 LEU N N 142 117.054 117.054 121.736 -4.682 18792 6297 1 8 . 1 1 142 142 LEU C C 142 176.530 176.530 178.373 -1.843 18792 6298 1 8 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.432 -2.123 18792 6299 1 8 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.043 1.295 18792 6300 1 8 . 1 1 142 142 LEU H H 142 7.198 7.198 7.959 -0.761 18792 6301 1 8 . 1 1 143 143 GLU N N 143 121.335 121.335 119.480 1.855 18792 6302 1 8 . 1 1 143 143 GLU C C 143 173.964 173.964 175.540 -1.576 18792 6303 1 8 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.522 -0.267 18792 6304 1 8 . 1 1 143 143 GLU CB C 143 26.257 26.257 27.698 -1.441 18792 6305 1 8 . 1 1 143 143 GLU H H 143 8.565 8.565 7.736 0.829 18792 6306 1 8 . 1 1 145 145 TRP N N 145 117.973 117.973 120.100 -2.127 18792 6307 1 8 . 1 1 145 145 TRP C C 145 179.526 179.526 177.853 1.673 18792 6308 1 8 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.386 1.220 18792 6309 1 8 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.505 -1.617 18792 6310 1 8 . 1 1 145 145 TRP H H 145 7.078 7.078 8.356 -1.278 18792 6311 1 8 . 1 1 146 146 ILE N N 146 122.101 122.101 110.600 11.501 18792 6312 1 8 . 1 1 146 146 ILE C C 146 179.110 179.110 177.389 1.721 18792 6313 1 8 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.587 3.747 18792 6314 1 8 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.962 -1.141 18792 6315 1 8 . 1 1 146 146 ILE H H 146 8.389 8.389 7.489 0.900 18792 6316 1 8 . 1 1 147 147 GLN N N 147 116.344 116.344 120.939 -4.595 18792 6317 1 8 . 1 1 147 147 GLN C C 147 179.526 179.526 177.400 2.126 18792 6318 1 8 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.555 -0.542 18792 6319 1 8 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.841 -1.118 18792 6320 1 8 . 1 1 147 147 GLN H H 147 8.376 8.376 7.966 0.410 18792 6321 1 8 . 1 1 148 148 GLU N N 148 118.913 118.913 119.358 -0.445 18792 6322 1 8 . 1 1 148 148 GLU C C 148 176.880 176.880 177.632 -0.752 18792 6323 1 8 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.095 -2.722 18792 6324 1 8 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.388 -0.956 18792 6325 1 8 . 1 1 148 148 GLU H H 148 7.504 7.504 7.607 -0.103 18792 6326 1 8 . 1 1 149 149 ASN N N 149 116.616 116.616 113.554 3.062 18792 6327 1 8 . 1 1 149 149 ASN C C 149 173.964 173.964 176.406 -2.442 18792 6328 1 8 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.350 -0.104 18792 6329 1 8 . 1 1 149 149 ASN CB C 149 37.133 37.133 40.315 -3.182 18792 6330 1 8 . 1 1 149 149 ASN H H 149 7.070 7.070 7.917 -0.847 18792 6331 1 8 . 1 1 150 150 GLY N N 150 104.750 104.750 105.762 -1.012 18792 6332 1 8 . 1 1 150 150 GLY C C 150 176.022 176.022 174.519 1.503 18792 6333 1 8 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.237 0.005 18792 6334 1 8 . 1 1 150 150 GLY H H 150 7.313 7.313 7.961 -0.648 18792 6335 1 8 . 1 1 151 151 GLY N N 151 108.385 108.385 109.320 -0.935 18792 6336 1 8 . 1 1 151 151 GLY C C 151 173.449 173.449 175.084 -1.635 18792 6337 1 8 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.304 -1.272 18792 6338 1 8 . 1 1 151 151 GLY H H 151 8.452 8.452 7.407 1.045 18792 6339 1 8 . 1 1 152 152 TRP N N 152 118.092 118.092 122.202 -4.110 18792 6340 1 8 . 1 1 152 152 TRP C C 152 178.571 178.571 177.982 0.589 18792 6341 1 8 . 1 1 152 152 TRP CA C 152 60.077 60.077 59.817 0.260 18792 6342 1 8 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.124 -0.536 18792 6343 1 8 . 1 1 152 152 TRP H H 152 8.644 8.644 8.683 -0.039 18792 6344 1 8 . 1 1 153 153 ASP N N 153 117.758 117.758 118.304 -0.546 18792 6345 1 8 . 1 1 153 153 ASP C C 153 179.796 179.796 178.489 1.307 18792 6346 1 8 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.511 -0.209 18792 6347 1 8 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.830 -1.599 18792 6348 1 8 . 1 1 153 153 ASP H H 153 8.827 8.827 8.318 0.509 18792 6349 1 8 . 1 1 154 154 THR N N 154 116.817 116.817 117.381 -0.564 18792 6350 1 8 . 1 1 154 154 THR C C 154 175.352 175.352 176.509 -1.157 18792 6351 1 8 . 1 1 154 154 THR CA C 154 65.910 65.910 66.683 -0.773 18792 6352 1 8 . 1 1 154 154 THR CB C 154 67.712 67.712 68.718 -1.006 18792 6353 1 8 . 1 1 154 154 THR H H 154 7.494 7.494 7.576 -0.082 18792 6354 1 8 . 1 1 155 155 PHE N N 155 122.196 122.196 121.047 1.149 18792 6355 1 8 . 1 1 155 155 PHE C C 155 176.831 176.831 177.434 -0.603 18792 6356 1 8 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.188 0.098 18792 6357 1 8 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.322 -1.655 18792 6358 1 8 . 1 1 155 155 PHE H H 155 6.477 6.477 8.742 -2.265 18792 6359 1 8 . 1 1 156 156 VAL N N 156 117.387 117.387 119.363 -1.976 18792 6360 1 8 . 1 1 156 156 VAL C C 156 178.497 178.497 177.792 0.705 18792 6361 1 8 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.513 -0.282 18792 6362 1 8 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.221 -0.536 18792 6363 1 8 . 1 1 156 156 VAL H H 156 7.788 7.788 8.091 -0.303 18792 6364 1 8 . 1 1 157 157 GLU N N 157 119.876 119.876 119.110 0.766 18792 6365 1 8 . 1 1 157 157 GLU C C 157 178.399 178.399 178.369 0.030 18792 6366 1 8 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.950 -0.190 18792 6367 1 8 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.872 -1.595 18792 6368 1 8 . 1 1 157 157 GLU H H 157 7.409 7.409 8.304 -0.895 18792 6369 1 8 . 1 1 158 158 LEU N N 158 117.194 117.194 118.783 -1.589 18792 6370 1 8 . 1 1 158 158 LEU C C 158 178.595 178.595 177.782 0.813 18792 6371 1 8 . 1 1 158 158 LEU CA C 158 56.377 56.377 56.689 -0.312 18792 6372 1 8 . 1 1 158 158 LEU CB C 158 42.571 42.571 43.007 -0.436 18792 6373 1 8 . 1 1 158 158 LEU H H 158 7.584 7.584 7.638 -0.054 18792 6374 1 8 . 1 1 159 159 TYR N N 159 115.549 115.549 114.501 1.048 18792 6375 1 8 . 1 1 159 159 TYR C C 159 177.032 177.032 174.980 2.052 18792 6376 1 8 . 1 1 159 159 TYR CA C 159 59.116 59.116 57.523 1.593 18792 6377 1 8 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.400 -0.801 18792 6378 1 8 . 1 1 159 159 TYR H H 159 8.099 8.099 8.516 -0.417 18792 6379 1 8 . 1 1 160 160 GLY N N 160 108.334 108.334 107.815 0.519 18792 6380 1 8 . 1 1 160 160 GLY C C 160 173.973 173.973 174.282 -0.309 18792 6381 1 8 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.766 0.298 18792 6382 1 8 . 1 1 160 160 GLY H H 160 8.020 8.020 7.935 0.085 18792 6383 1 8 . 1 1 161 161 ASN N N 161 118.189 118.189 118.434 -0.245 18792 6384 1 8 . 1 1 161 161 ASN C C 161 175.513 175.513 173.329 2.184 18792 6385 1 8 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.886 -1.782 18792 6386 1 8 . 1 1 161 161 ASN CB C 161 38.203 38.203 38.907 -0.704 18792 6387 1 8 . 1 1 161 161 ASN H H 161 8.327 8.327 8.223 0.104 18792 6388 1 8 . 1 1 162 162 ASN N N 162 119.022 119.022 117.002 2.020 18792 6389 1 8 . 1 1 162 162 ASN C C 162 175.690 175.690 173.849 1.841 18792 6390 1 8 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.263 0.161 18792 6391 1 8 . 1 1 162 162 ASN CB C 162 38.203 38.203 39.576 -1.373 18792 6392 1 8 . 1 1 162 162 ASN H H 162 8.363 8.363 8.093 0.270 18792 6393 1 8 . 1 1 163 163 ALA N N 163 123.275 123.275 124.857 -1.582 18792 6394 1 8 . 1 1 163 163 ALA C C 163 178.598 178.598 178.414 0.184 18792 6395 1 8 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.358 -0.119 18792 6396 1 8 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.072 -1.461 18792 6397 1 8 . 1 1 163 163 ALA H H 163 8.103 8.103 8.345 -0.242 18792 6398 1 8 . 1 1 164 164 ALA N N 164 121.521 121.521 122.004 -0.483 18792 6399 1 8 . 1 1 164 164 ALA C C 164 178.642 178.642 179.773 -1.131 18792 6400 1 8 . 1 1 164 164 ALA CA C 164 52.584 52.584 53.722 -1.138 18792 6401 1 8 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.497 -0.678 18792 6402 1 8 . 1 1 164 164 ALA H H 164 8.053 8.053 8.163 -0.110 18792 6403 1 8 . 1 1 165 165 ALA N N 165 122.101 122.101 121.898 0.203 18792 6404 1 8 . 1 1 165 165 ALA C C 165 179.124 179.124 178.628 0.496 18792 6405 1 8 . 1 1 165 165 ALA CA C 165 53.139 53.139 53.927 -0.788 18792 6406 1 8 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.257 -0.279 18792 6407 1 8 . 1 1 165 165 ALA H H 165 7.949 7.949 8.186 -0.237 18792 6408 1 8 . 1 1 166 166 GLU N N 166 118.381 118.381 118.421 -0.040 18792 6409 1 8 . 1 1 166 166 GLU C C 166 177.664 177.664 177.747 -0.083 18792 6410 1 8 . 1 1 166 166 GLU CA C 166 57.088 57.088 58.378 -1.290 18792 6411 1 8 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.444 -1.089 18792 6412 1 8 . 1 1 166 166 GLU H H 166 8.202 8.202 8.576 -0.374 18792 6413 1 8 . 1 1 167 167 SER N N 167 115.193 115.193 115.001 0.192 18792 6414 1 8 . 1 1 167 167 SER C C 167 175.312 175.312 174.834 0.478 18792 6415 1 8 . 1 1 167 167 SER CA C 167 58.831 58.831 61.309 -2.478 18792 6416 1 8 . 1 1 167 167 SER CB C 167 62.537 62.537 63.378 -0.841 18792 6417 1 8 . 1 1 167 167 SER H H 167 8.029 8.029 7.651 0.378 18792 6418 1 8 . 1 1 168 168 ARG N N 168 121.696 121.696 118.822 2.874 18792 6419 1 8 . 1 1 168 168 ARG C C 168 176.880 176.880 175.176 1.704 18792 6420 1 8 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.607 -0.444 18792 6421 1 8 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.496 -0.287 18792 6422 1 8 . 1 1 168 168 ARG H H 168 7.967 7.967 8.458 -0.491 18792 6423 1 8 . 1 1 169 169 LYS N N 169 120.917 120.917 115.735 5.182 18792 6424 1 8 . 1 1 169 169 LYS C C 169 177.640 177.640 175.574 2.066 18792 6425 1 8 . 1 1 169 169 LYS CA C 169 56.697 56.697 57.376 -0.679 18792 6426 1 8 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.627 -1.165 18792 6427 1 8 . 1 1 169 169 LYS H H 169 8.011 8.011 8.115 -0.104 18792 6428 1 8 . 1 1 170 170 GLY N N 170 109.155 109.155 106.927 2.228 18792 6429 1 8 . 1 1 170 170 GLY C C 170 174.479 174.479 172.877 1.602 18792 6430 1 8 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.765 0.299 18792 6431 1 8 . 1 1 170 170 GLY H H 170 8.329 8.329 8.106 0.223 18792 6432 1 8 . 1 1 171 171 GLN N N 171 119.292 119.292 118.261 1.031 18792 6433 1 8 . 1 1 171 171 GLN C C 171 176.463 176.463 174.365 2.098 18792 6434 1 8 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.080 0.586 18792 6435 1 8 . 1 1 171 171 GLN CB C 171 28.199 28.199 31.796 -3.597 18792 6436 1 8 . 1 1 171 171 GLN H H 171 8.035 8.035 8.704 -0.669 18792 6437 1 8 . 1 1 172 172 GLU N N 172 121.703 121.703 119.051 2.652 18792 6438 1 8 . 1 1 172 172 GLU C C 172 176.414 176.414 174.777 1.637 18792 6439 1 8 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.878 0.463 18792 6440 1 8 . 1 1 172 172 GLU CB C 172 28.821 28.821 32.697 -3.876 18792 6441 1 8 . 1 1 172 172 GLU H H 172 8.405 8.405 9.014 -0.609 18792 6442 1 8 . 1 1 173 173 ARG N N 173 121.852 121.852 120.053 1.799 18792 6443 1 8 . 1 1 173 173 ARG C C 173 176.365 176.365 174.189 2.176 18792 6444 1 8 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.301 0.898 18792 6445 1 8 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.694 -2.563 18792 6446 1 8 . 1 1 173 173 ARG H H 173 8.335 8.335 8.623 -0.288 18792 6447 1 8 . 1 1 174 174 LEU N N 174 122.640 122.640 119.533 3.107 18792 6448 1 8 . 1 1 174 174 LEU C C 174 176.523 176.523 175.040 1.483 18792 6449 1 8 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.519 0.249 18792 6450 1 8 . 1 1 174 174 LEU CB C 174 40.784 40.784 44.860 -4.076 18792 6451 1 8 . 1 1 174 174 LEU H H 174 8.082 8.082 8.935 -0.853 18792 6452 1 8 . 1 1 175 175 GLU N N 175 125.909 125.909 120.002 5.907 18792 6453 1 8 . 1 1 175 175 GLU C C 175 181.029 181.029 174.660 6.369 18792 6454 1 8 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.095 1.303 18792 6455 1 8 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.909 -1.859 18792 6456 1 8 . 1 1 175 175 GLU H H 175 7.785 7.785 8.917 -1.132 18792 6457 1 9 . 1 1 4 4 ALA N N 4 124.786 124.786 123.365 1.421 18792 6458 1 9 . 1 1 4 4 ALA C C 4 178.272 178.272 179.642 -1.370 18792 6459 1 9 . 1 1 4 4 ALA CA C 4 52.566 52.566 55.245 -2.679 18792 6460 1 9 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.349 -0.115 18792 6461 1 9 . 1 1 4 4 ALA H H 4 8.414 8.414 8.476 -0.062 18792 6462 1 9 . 1 1 5 5 MET N N 5 119.681 119.681 114.376 5.305 18792 6463 1 9 . 1 1 5 5 MET C C 5 176.929 176.929 177.468 -0.539 18792 6464 1 9 . 1 1 5 5 MET CA C 5 55.594 55.594 57.998 -2.404 18792 6465 1 9 . 1 1 5 5 MET CB C 5 31.540 31.540 31.804 -0.264 18792 6466 1 9 . 1 1 5 5 MET H H 5 8.336 8.336 8.221 0.115 18792 6467 1 9 . 1 1 6 6 SER N N 6 116.162 116.162 116.598 -0.436 18792 6468 1 9 . 1 1 6 6 SER C C 6 175.924 175.924 176.326 -0.402 18792 6469 1 9 . 1 1 6 6 SER CA C 6 59.009 59.009 61.787 -2.778 18792 6470 1 9 . 1 1 6 6 SER CB C 6 62.537 62.537 62.299 0.238 18792 6471 1 9 . 1 1 6 6 SER H H 6 8.272 8.272 8.427 -0.155 18792 6472 1 9 . 1 1 7 7 GLN N N 7 122.263 122.263 121.548 0.715 18792 6473 1 9 . 1 1 7 7 GLN C C 7 177.027 177.027 178.040 -1.013 18792 6474 1 9 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.694 -2.424 18792 6475 1 9 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.421 -0.682 18792 6476 1 9 . 1 1 7 7 GLN H H 7 8.314 8.314 7.621 0.693 18792 6477 1 9 . 1 1 8 8 SER N N 8 116.625 116.625 115.162 1.463 18792 6478 1 9 . 1 1 8 8 SER C C 8 176.457 176.457 176.046 0.411 18792 6479 1 9 . 1 1 8 8 SER CA C 8 59.650 59.650 61.835 -2.185 18792 6480 1 9 . 1 1 8 8 SER CB C 8 62.226 62.226 62.872 -0.646 18792 6481 1 9 . 1 1 8 8 SER H H 8 8.333 8.333 8.182 0.151 18792 6482 1 9 . 1 1 9 9 ASN N N 9 121.307 121.307 119.571 1.736 18792 6483 1 9 . 1 1 9 9 ASN C C 9 177.419 177.419 177.246 0.173 18792 6484 1 9 . 1 1 9 9 ASN CA C 9 55.487 55.487 55.828 -0.341 18792 6485 1 9 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.243 -1.110 18792 6486 1 9 . 1 1 9 9 ASN H H 9 8.611 8.611 7.591 1.020 18792 6487 1 9 . 1 1 10 10 ARG N N 10 119.830 119.830 121.433 -1.603 18792 6488 1 9 . 1 1 10 10 ARG C C 10 177.615 177.615 178.340 -0.725 18792 6489 1 9 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.791 -0.533 18792 6490 1 9 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.268 -2.069 18792 6491 1 9 . 1 1 10 10 ARG H H 10 7.996 7.996 8.092 -0.096 18792 6492 1 9 . 1 1 11 11 GLU N N 11 117.270 117.270 119.806 -2.536 18792 6493 1 9 . 1 1 11 11 GLU C C 11 179.649 179.649 178.603 1.046 18792 6494 1 9 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.189 -0.180 18792 6495 1 9 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.371 -1.250 18792 6496 1 9 . 1 1 11 11 GLU H H 11 7.885 7.885 8.237 -0.352 18792 6497 1 9 . 1 1 12 12 LEU N N 12 119.900 119.900 120.736 -0.836 18792 6498 1 9 . 1 1 12 12 LEU C C 12 178.473 178.473 178.919 -0.446 18792 6499 1 9 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.442 -0.749 18792 6500 1 9 . 1 1 12 12 LEU CB C 12 40.629 40.629 42.154 -1.526 18792 6501 1 9 . 1 1 12 12 LEU H H 12 7.691 7.691 8.044 -0.353 18792 6502 1 9 . 1 1 13 13 VAL N N 13 117.320 117.320 118.882 -1.562 18792 6503 1 9 . 1 1 13 13 VAL C C 13 177.272 177.272 177.769 -0.497 18792 6504 1 9 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.367 0.789 18792 6505 1 9 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.837 -0.608 18792 6506 1 9 . 1 1 13 13 VAL H H 13 7.629 7.629 7.748 -0.119 18792 6507 1 9 . 1 1 14 14 VAL N N 14 116.659 116.659 120.170 -3.511 18792 6508 1 9 . 1 1 14 14 VAL C C 14 178.718 178.718 177.197 1.521 18792 6509 1 9 . 1 1 14 14 VAL CA C 14 66.516 66.516 65.810 0.706 18792 6510 1 9 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.740 -1.366 18792 6511 1 9 . 1 1 14 14 VAL H H 14 8.210 8.210 7.768 0.442 18792 6512 1 9 . 1 1 15 15 ASP N N 15 120.374 120.374 121.217 -0.843 18792 6513 1 9 . 1 1 15 15 ASP C C 15 177.557 177.557 178.449 -0.892 18792 6514 1 9 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.491 0.985 18792 6515 1 9 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.548 2.005 18792 6516 1 9 . 1 1 15 15 ASP H H 15 7.967 7.967 8.808 -0.841 18792 6517 1 9 . 1 1 16 16 PHE N N 16 119.864 119.864 122.307 -2.443 18792 6518 1 9 . 1 1 16 16 PHE C C 16 178.252 178.252 176.930 1.322 18792 6519 1 9 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.712 2.068 18792 6520 1 9 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.919 0.141 18792 6521 1 9 . 1 1 16 16 PHE H H 16 8.228 8.228 8.054 0.174 18792 6522 1 9 . 1 1 17 17 LEU N N 17 116.312 116.312 118.127 -1.815 18792 6523 1 9 . 1 1 17 17 LEU C C 17 179.649 179.649 178.899 0.750 18792 6524 1 9 . 1 1 17 17 LEU CA C 17 57.764 57.764 57.809 -0.046 18792 6525 1 9 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.483 -1.398 18792 6526 1 9 . 1 1 17 17 LEU H H 17 8.766 8.766 7.825 0.941 18792 6527 1 9 . 1 1 18 18 SER N N 18 113.715 113.715 116.084 -2.369 18792 6528 1 9 . 1 1 18 18 SER C C 18 177.362 177.362 176.582 0.780 18792 6529 1 9 . 1 1 18 18 SER CA C 18 61.948 61.948 62.231 -0.283 18792 6530 1 9 . 1 1 18 18 SER CB C 18 63.003 63.003 63.194 -0.191 18792 6531 1 9 . 1 1 18 18 SER H H 18 8.384 8.384 7.767 0.617 18792 6532 1 9 . 1 1 19 19 TYR N N 19 124.570 124.570 123.247 1.323 18792 6533 1 9 . 1 1 19 19 TYR C C 19 178.415 178.415 178.237 0.178 18792 6534 1 9 . 1 1 19 19 TYR CA C 19 59.764 59.764 62.044 -2.280 18792 6535 1 9 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.658 -1.642 18792 6536 1 9 . 1 1 19 19 TYR H H 19 8.155 8.155 8.920 -0.765 18792 6537 1 9 . 1 1 20 20 LYS N N 20 119.739 119.739 119.369 0.370 18792 6538 1 9 . 1 1 20 20 LYS C C 20 180.456 180.456 178.974 1.482 18792 6539 1 9 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.558 -2.070 18792 6540 1 9 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.097 -3.938 18792 6541 1 9 . 1 1 20 20 LYS H H 20 8.224 8.224 7.975 0.249 18792 6542 1 9 . 1 1 21 21 LEU N N 21 118.092 118.092 120.985 -2.893 18792 6543 1 9 . 1 1 21 21 LEU C C 21 179.989 179.989 178.976 1.013 18792 6544 1 9 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.536 -0.410 18792 6545 1 9 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.943 -2.334 18792 6546 1 9 . 1 1 21 21 LEU H H 21 8.586 8.586 8.053 0.533 18792 6547 1 9 . 1 1 22 22 SER N N 22 117.304 117.304 113.972 3.332 18792 6548 1 9 . 1 1 22 22 SER C C 22 180.152 180.152 177.051 3.101 18792 6549 1 9 . 1 1 22 22 SER CA C 22 61.287 61.287 60.844 0.443 18792 6550 1 9 . 1 1 22 22 SER H H 22 8.266 8.266 7.826 0.440 18792 6551 1 9 . 1 1 23 23 GLN N N 23 122.497 122.497 121.427 1.070 18792 6552 1 9 . 1 1 23 23 GLN C C 23 177.297 177.297 177.428 -0.131 18792 6553 1 9 . 1 1 23 23 GLN CA C 23 57.942 57.942 57.752 0.190 18792 6554 1 9 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.329 -0.518 18792 6555 1 9 . 1 1 23 23 GLN H H 23 7.571 7.571 8.184 -0.613 18792 6556 1 9 . 1 1 24 24 LYS N N 24 116.038 116.038 117.209 -1.171 18792 6557 1 9 . 1 1 24 24 LYS C C 24 175.704 175.704 176.729 -1.025 18792 6558 1 9 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.546 -3.051 18792 6559 1 9 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.603 -2.374 18792 6560 1 9 . 1 1 24 24 LYS H H 24 7.134 7.134 7.558 -0.424 18792 6561 1 9 . 1 1 25 25 GLY N N 25 105.283 105.283 106.057 -0.774 18792 6562 1 9 . 1 1 25 25 GLY C C 25 174.013 174.013 173.450 0.563 18792 6563 1 9 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.668 0.111 18792 6564 1 9 . 1 1 25 25 GLY H H 25 7.483 7.483 7.576 -0.093 18792 6565 1 9 . 1 1 26 26 TYR N N 26 119.547 119.547 120.718 -1.171 18792 6566 1 9 . 1 1 26 26 TYR C C 26 175.122 175.122 174.391 0.731 18792 6567 1 9 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.034 -0.902 18792 6568 1 9 . 1 1 26 26 TYR CB C 26 40.080 40.080 38.712 1.368 18792 6569 1 9 . 1 1 26 26 TYR H H 26 7.788 7.788 7.642 0.146 18792 6570 1 9 . 1 1 27 27 SER N N 27 115.088 115.088 120.309 -5.221 18792 6571 1 9 . 1 1 27 27 SER C C 27 174.452 174.452 174.803 -0.351 18792 6572 1 9 . 1 1 27 27 SER CA C 27 56.306 56.306 56.354 -0.048 18792 6573 1 9 . 1 1 27 27 SER CB C 27 63.921 63.921 64.581 -0.660 18792 6574 1 9 . 1 1 27 27 SER H H 27 8.473 8.473 8.870 -0.397 18792 6575 1 9 . 1 1 28 28 TRP N N 28 127.014 127.014 127.216 -0.202 18792 6576 1 9 . 1 1 28 28 TRP C C 28 177.002 177.002 177.520 -0.518 18792 6577 1 9 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.840 -0.368 18792 6578 1 9 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.143 0.687 18792 6579 1 9 . 1 1 28 28 TRP H H 28 8.897 8.897 8.873 0.024 18792 6580 1 9 . 1 1 29 29 SER N N 29 112.044 112.044 111.253 0.791 18792 6581 1 9 . 1 1 29 29 SER C C 29 175.106 175.106 174.707 0.399 18792 6582 1 9 . 1 1 29 29 SER CA C 29 59.472 59.472 58.632 0.840 18792 6583 1 9 . 1 1 29 29 SER CB C 29 62.226 62.226 62.874 -0.648 18792 6584 1 9 . 1 1 29 29 SER H H 29 8.129 8.129 8.345 -0.216 18792 6585 1 9 . 1 1 30 30 GLN N N 30 119.160 119.160 121.022 -1.862 18792 6586 1 9 . 1 1 30 30 GLN C C 30 176.218 176.218 176.619 -0.401 18792 6587 1 9 . 1 1 30 30 GLN CA C 30 56.412 56.412 57.105 -0.693 18792 6588 1 9 . 1 1 30 30 GLN CB C 30 27.578 27.578 30.225 -2.647 18792 6589 1 9 . 1 1 30 30 GLN H H 30 7.370 7.370 8.008 -0.638 18792 6590 1 9 . 1 1 31 31 PHE N N 31 116.277 116.277 120.027 -3.750 18792 6591 1 9 . 1 1 31 31 PHE C C 31 175.217 175.217 176.245 -1.028 18792 6592 1 9 . 1 1 31 31 PHE CA C 31 56.234 56.234 60.314 -4.080 18792 6593 1 9 . 1 1 31 31 PHE CB C 31 39.066 39.066 40.832 -1.766 18792 6594 1 9 . 1 1 31 31 PHE H H 31 7.248 7.248 8.337 -1.089 18792 6595 1 9 . 1 1 32 32 SER N N 32 113.683 113.683 116.559 -2.876 18792 6596 1 9 . 1 1 32 32 SER C C 32 173.793 173.793 174.163 -0.370 18792 6597 1 9 . 1 1 32 32 SER CA C 32 57.124 57.124 59.647 -2.523 18792 6598 1 9 . 1 1 32 32 SER CB C 32 63.081 63.081 63.214 -0.133 18792 6599 1 9 . 1 1 32 32 SER H H 32 7.242 7.242 8.052 -0.810 18792 6600 1 9 . 1 1 33 33 ASP N N 33 122.195 122.195 125.862 -3.667 18792 6601 1 9 . 1 1 33 33 ASP C C 33 176.394 176.394 178.269 -1.875 18792 6602 1 9 . 1 1 33 33 ASP CA C 33 53.748 53.748 56.440 -2.692 18792 6603 1 9 . 1 1 33 33 ASP CB C 33 40.398 40.398 41.085 -0.687 18792 6604 1 9 . 1 1 33 33 ASP H H 33 8.257 8.257 8.674 -0.417 18792 6605 1 9 . 1 1 34 34 VAL N N 34 118.913 118.913 117.349 1.564 18792 6606 1 9 . 1 1 34 34 VAL C C 34 176.328 176.328 175.060 1.268 18792 6607 1 9 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.977 -1.086 18792 6608 1 9 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.089 -0.074 18792 6609 1 9 . 1 1 34 34 VAL H H 34 7.852 7.852 7.584 0.268 18792 6610 1 9 . 1 1 35 35 GLU N N 35 124.205 124.205 116.132 8.073 18792 6611 1 9 . 1 1 35 35 GLU C C 35 176.586 176.586 174.863 1.723 18792 6612 1 9 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.633 -1.576 18792 6613 1 9 . 1 1 35 35 GLU CB C 35 28.898 28.898 29.506 -0.608 18792 6614 1 9 . 1 1 35 35 GLU H H 35 8.401 8.401 7.881 0.520 18792 6615 1 9 . 1 1 36 36 GLU N N 36 121.670 121.670 119.743 1.927 18792 6616 1 9 . 1 1 36 36 GLU C C 36 176.218 176.218 175.594 0.624 18792 6617 1 9 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.574 -0.586 18792 6618 1 9 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.476 -1.034 18792 6619 1 9 . 1 1 36 36 GLU H H 36 8.239 8.239 8.678 -0.439 18792 6620 1 9 . 1 1 37 37 ASN N N 37 119.252 119.252 115.217 4.035 18792 6621 1 9 . 1 1 37 37 ASN C C 37 175.003 175.003 175.878 -0.875 18792 6622 1 9 . 1 1 37 37 ASN CA C 37 52.655 52.655 52.825 -0.170 18792 6623 1 9 . 1 1 37 37 ASN CB C 37 38.212 38.212 38.997 -0.785 18792 6624 1 9 . 1 1 37 37 ASN H H 37 8.412 8.412 8.182 0.230 18792 6625 1 9 . 1 1 38 38 ARG N N 38 121.622 121.622 120.208 1.414 18792 6626 1 9 . 1 1 38 38 ARG C C 38 176.610 176.610 175.799 0.811 18792 6627 1 9 . 1 1 38 38 ARG CA C 38 55.364 55.364 57.616 -2.252 18792 6628 1 9 . 1 1 38 38 ARG CB C 38 29.419 29.419 30.545 -1.126 18792 6629 1 9 . 1 1 38 38 ARG H H 38 8.227 8.227 8.650 -0.423 18792 6630 1 9 . 1 1 39 39 THR N N 39 115.681 115.681 112.497 3.184 18792 6631 1 9 . 1 1 39 39 THR C C 39 174.500 174.500 173.873 0.627 18792 6632 1 9 . 1 1 39 39 THR CA C 39 61.606 61.606 63.224 -1.618 18792 6633 1 9 . 1 1 39 39 THR CB C 39 69.163 69.163 68.234 0.929 18792 6634 1 9 . 1 1 39 39 THR H H 39 8.173 8.173 8.105 0.068 18792 6635 1 9 . 1 1 40 40 GLU N N 40 122.708 122.708 120.357 2.351 18792 6636 1 9 . 1 1 40 40 GLU C C 40 175.728 175.728 176.207 -0.479 18792 6637 1 9 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.629 -0.857 18792 6638 1 9 . 1 1 40 40 GLU CB C 40 29.054 29.054 30.730 -1.676 18792 6639 1 9 . 1 1 40 40 GLU H H 40 8.298 8.298 7.913 0.385 18792 6640 1 9 . 1 1 41 41 ALA N N 41 125.922 125.922 126.063 -0.141 18792 6641 1 9 . 1 1 41 41 ALA C C 41 175.557 175.557 175.703 -0.146 18792 6642 1 9 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.919 -1.946 18792 6643 1 9 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.730 -0.485 18792 6644 1 9 . 1 1 41 41 ALA H H 41 8.212 8.212 8.238 -0.026 18792 6645 1 9 . 1 1 43 43 GLU N N 43 120.783 120.783 123.901 -3.118 18792 6646 1 9 . 1 1 43 43 GLU C C 43 177.174 177.174 176.983 0.191 18792 6647 1 9 . 1 1 43 43 GLU CA C 43 56.341 56.341 58.020 -1.679 18792 6648 1 9 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.889 -0.602 18792 6649 1 9 . 1 1 43 43 GLU H H 43 8.519 8.519 8.700 -0.181 18792 6650 1 9 . 1 1 44 44 GLY N N 44 110.022 110.022 107.091 2.931 18792 6651 1 9 . 1 1 44 44 GLY C C 44 174.773 174.773 173.884 0.889 18792 6652 1 9 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.368 -0.340 18792 6653 1 9 . 1 1 44 44 GLY H H 44 8.429 8.429 8.452 -0.023 18792 6654 1 9 . 1 1 45 45 THR N N 45 112.790 112.790 114.452 -1.662 18792 6655 1 9 . 1 1 45 45 THR C C 45 175.726 175.726 174.617 1.109 18792 6656 1 9 . 1 1 45 45 THR CA C 45 61.987 61.987 62.061 -0.074 18792 6657 1 9 . 1 1 45 45 THR CB C 45 69.304 69.304 69.427 -0.122 18792 6658 1 9 . 1 1 45 45 THR H H 45 8.125 8.125 7.856 0.269 18792 6659 1 9 . 1 1 46 46 GLU N N 46 122.752 122.752 119.604 3.148 18792 6660 1 9 . 1 1 46 46 GLU C C 46 177.419 177.419 177.652 -0.233 18792 6661 1 9 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.962 0.269 18792 6662 1 9 . 1 1 46 46 GLU CB C 46 28.199 28.199 30.888 -2.689 18792 6663 1 9 . 1 1 46 46 GLU H H 46 8.765 8.765 8.407 0.358 18792 6664 1 9 . 1 1 47 47 SER N N 47 114.895 114.895 116.066 -1.171 18792 6665 1 9 . 1 1 47 47 SER C C 47 175.826 175.826 175.789 0.037 18792 6666 1 9 . 1 1 47 47 SER CA C 47 58.582 58.582 60.279 -1.697 18792 6667 1 9 . 1 1 47 47 SER CB C 47 62.537 62.537 63.069 -0.532 18792 6668 1 9 . 1 1 47 47 SER H H 47 8.355 8.355 8.173 0.182 18792 6669 1 9 . 1 1 48 48 GLU N N 48 122.429 122.429 120.928 1.501 18792 6670 1 9 . 1 1 48 48 GLU C C 48 178.099 178.099 177.575 0.524 18792 6671 1 9 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.966 -0.348 18792 6672 1 9 . 1 1 48 48 GLU CB C 48 28.475 28.475 28.650 -0.175 18792 6673 1 9 . 1 1 48 48 GLU H H 48 8.139 8.139 8.628 -0.489 18792 6674 1 9 . 1 1 49 49 ALA N N 49 120.374 120.374 121.300 -0.926 18792 6675 1 9 . 1 1 49 49 ALA C C 49 180.843 180.843 178.979 1.864 18792 6676 1 9 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.487 -0.004 18792 6677 1 9 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.062 -0.627 18792 6678 1 9 . 1 1 49 49 ALA H H 49 8.079 8.079 7.514 0.565 18792 6679 1 9 . 1 1 50 50 VAL N N 50 118.599 118.599 118.027 0.572 18792 6680 1 9 . 1 1 50 50 VAL C C 50 176.921 176.921 178.070 -1.149 18792 6681 1 9 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.166 -0.606 18792 6682 1 9 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.384 -1.087 18792 6683 1 9 . 1 1 50 50 VAL H H 50 7.419 7.419 7.404 0.015 18792 6684 1 9 . 1 1 51 51 LYS N N 51 117.469 117.469 120.483 -3.014 18792 6685 1 9 . 1 1 51 51 LYS C C 51 179.061 179.061 179.175 -0.114 18792 6686 1 9 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.688 -0.465 18792 6687 1 9 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.742 -0.746 18792 6688 1 9 . 1 1 51 51 LYS H H 51 7.359 7.359 7.651 -0.292 18792 6689 1 9 . 1 1 52 52 GLN N N 52 115.930 115.930 117.786 -1.856 18792 6690 1 9 . 1 1 52 52 GLN C C 52 177.713 177.713 178.005 -0.292 18792 6691 1 9 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.983 -0.506 18792 6692 1 9 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.488 -1.920 18792 6693 1 9 . 1 1 52 52 GLN H H 52 8.025 8.025 7.928 0.097 18792 6694 1 9 . 1 1 53 53 ALA N N 53 119.782 119.782 122.879 -3.097 18792 6695 1 9 . 1 1 53 53 ALA C C 53 180.008 180.008 178.824 1.184 18792 6696 1 9 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.913 -0.528 18792 6697 1 9 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.498 -0.983 18792 6698 1 9 . 1 1 53 53 ALA H H 53 7.655 7.655 7.982 -0.327 18792 6699 1 9 . 1 1 54 54 LEU N N 54 120.443 120.443 119.267 1.176 18792 6700 1 9 . 1 1 54 54 LEU C C 54 179.330 179.330 178.152 1.178 18792 6701 1 9 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.200 0.813 18792 6702 1 9 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.736 -0.874 18792 6703 1 9 . 1 1 54 54 LEU H H 54 8.419 8.419 8.315 0.104 18792 6704 1 9 . 1 1 55 55 ARG N N 55 118.423 118.423 118.190 0.233 18792 6705 1 9 . 1 1 55 55 ARG C C 55 178.767 178.767 178.386 0.381 18792 6706 1 9 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.260 1.137 18792 6707 1 9 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.516 -0.773 18792 6708 1 9 . 1 1 55 55 ARG H H 55 8.062 8.062 7.529 0.533 18792 6709 1 9 . 1 1 56 56 GLU N N 56 115.988 115.988 120.108 -4.120 18792 6710 1 9 . 1 1 56 56 GLU C C 56 180.090 180.090 178.376 1.714 18792 6711 1 9 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.081 -0.321 18792 6712 1 9 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.585 -1.231 18792 6713 1 9 . 1 1 56 56 GLU H H 56 7.772 7.772 7.848 -0.076 18792 6714 1 9 . 1 1 57 57 ALA N N 57 122.837 122.837 120.827 2.010 18792 6715 1 9 . 1 1 57 57 ALA C C 57 181.861 181.861 179.394 2.467 18792 6716 1 9 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.578 0.056 18792 6717 1 9 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.094 0.379 18792 6718 1 9 . 1 1 57 57 ALA H H 57 8.774 8.774 7.944 0.830 18792 6719 1 9 . 1 1 58 58 GLY N N 58 108.409 108.409 106.236 2.173 18792 6720 1 9 . 1 1 58 58 GLY C C 58 175.331 175.331 175.721 -0.390 18792 6721 1 9 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.626 0.042 18792 6722 1 9 . 1 1 58 58 GLY H H 58 9.073 9.073 8.291 0.782 18792 6723 1 9 . 1 1 59 59 ASP N N 59 122.074 122.074 122.740 -0.666 18792 6724 1 9 . 1 1 59 59 ASP C C 59 179.023 179.023 177.818 1.205 18792 6725 1 9 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.481 -0.179 18792 6726 1 9 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.312 -2.470 18792 6727 1 9 . 1 1 59 59 ASP H H 59 8.049 8.049 8.083 -0.034 18792 6728 1 9 . 1 1 60 60 GLU N N 60 120.131 120.131 119.915 0.216 18792 6729 1 9 . 1 1 60 60 GLU C C 60 178.522 178.522 179.035 -0.513 18792 6730 1 9 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.268 -0.259 18792 6731 1 9 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.880 -1.681 18792 6732 1 9 . 1 1 60 60 GLU H H 60 8.136 8.136 8.056 0.080 18792 6733 1 9 . 1 1 61 61 PHE N N 61 121.309 121.309 118.851 2.458 18792 6734 1 9 . 1 1 61 61 PHE C C 61 176.904 176.904 177.965 -1.061 18792 6735 1 9 . 1 1 61 61 PHE CA C 61 61.322 61.322 60.816 0.506 18792 6736 1 9 . 1 1 61 61 PHE CB C 61 38.609 38.609 38.808 -0.199 18792 6737 1 9 . 1 1 61 61 PHE H H 61 8.523 8.523 8.242 0.281 18792 6738 1 9 . 1 1 62 62 GLU N N 62 115.971 115.971 120.105 -4.134 18792 6739 1 9 . 1 1 62 62 GLU C C 62 177.713 177.713 178.592 -0.879 18792 6740 1 9 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.445 -1.254 18792 6741 1 9 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.951 -1.674 18792 6742 1 9 . 1 1 62 62 GLU H H 62 7.969 7.969 8.410 -0.441 18792 6743 1 9 . 1 1 63 63 LEU N N 63 116.703 116.703 120.017 -3.314 18792 6744 1 9 . 1 1 63 63 LEU C C 63 178.963 178.963 178.594 0.369 18792 6745 1 9 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.200 -0.789 18792 6746 1 9 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.269 -0.863 18792 6747 1 9 . 1 1 63 63 LEU H H 63 7.347 7.347 8.111 -0.764 18792 6748 1 9 . 1 1 64 64 ARG N N 64 117.453 117.453 116.157 1.296 18792 6749 1 9 . 1 1 64 64 ARG C C 64 177.297 177.297 177.773 -0.476 18792 6750 1 9 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.261 1.076 18792 6751 1 9 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.407 -0.810 18792 6752 1 9 . 1 1 64 64 ARG H H 64 7.995 7.995 7.849 0.146 18792 6753 1 9 . 1 1 65 65 TYR N N 65 118.956 118.956 119.490 -0.534 18792 6754 1 9 . 1 1 65 65 TYR C C 65 175.278 175.278 176.218 -0.940 18792 6755 1 9 . 1 1 65 65 TYR CA C 65 55.701 55.701 60.384 -4.683 18792 6756 1 9 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.208 -3.222 18792 6757 1 9 . 1 1 65 65 TYR H H 65 7.909 7.909 7.871 0.038 18792 6758 1 9 . 1 1 66 66 ARG N N 66 119.438 119.438 115.212 4.226 18792 6759 1 9 . 1 1 66 66 ARG C C 66 178.424 178.424 176.396 2.028 18792 6760 1 9 . 1 1 66 66 ARG CA C 66 58.476 58.476 55.939 2.537 18792 6761 1 9 . 1 1 66 66 ARG CB C 66 28.821 28.821 32.621 -3.800 18792 6762 1 9 . 1 1 66 66 ARG H H 66 7.244 7.244 7.643 -0.399 18792 6763 1 9 . 1 1 67 67 ARG N N 67 118.936 118.936 123.648 -4.712 18792 6764 1 9 . 1 1 67 67 ARG C C 67 177.542 177.542 178.187 -0.645 18792 6765 1 9 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.228 -1.784 18792 6766 1 9 . 1 1 67 67 ARG CB C 67 28.121 28.121 30.420 -2.299 18792 6767 1 9 . 1 1 67 67 ARG H H 67 8.417 8.417 8.819 -0.402 18792 6768 1 9 . 1 1 68 68 ALA N N 68 121.797 121.797 122.679 -0.882 18792 6769 1 9 . 1 1 68 68 ALA C C 68 180.337 180.337 179.306 1.031 18792 6770 1 9 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.735 -0.599 18792 6771 1 9 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.983 -0.516 18792 6772 1 9 . 1 1 68 68 ALA H H 68 7.827 7.827 8.547 -0.720 18792 6773 1 9 . 1 1 69 69 PHE N N 69 115.986 115.986 117.035 -1.049 18792 6774 1 9 . 1 1 69 69 PHE C C 69 177.468 177.468 177.615 -0.147 18792 6775 1 9 . 1 1 69 69 PHE CA C 69 58.049 58.049 61.582 -3.533 18792 6776 1 9 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.612 -1.013 18792 6777 1 9 . 1 1 69 69 PHE H H 69 8.517 8.517 8.001 0.516 18792 6778 1 9 . 1 1 70 70 SER N N 70 116.526 116.526 114.505 2.021 18792 6779 1 9 . 1 1 70 70 SER C C 70 177.640 177.640 175.951 1.689 18792 6780 1 9 . 1 1 70 70 SER CA C 70 61.073 61.073 60.606 0.467 18792 6781 1 9 . 1 1 70 70 SER CB C 70 61.993 61.993 62.953 -0.960 18792 6782 1 9 . 1 1 70 70 SER H H 70 8.152 8.152 8.120 0.032 18792 6783 1 9 . 1 1 71 71 ASP N N 71 121.181 121.181 121.805 -0.624 18792 6784 1 9 . 1 1 71 71 ASP C C 71 178.546 178.546 178.156 0.390 18792 6785 1 9 . 1 1 71 71 ASP CA C 71 56.448 56.448 56.638 -0.190 18792 6786 1 9 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.557 -1.326 18792 6787 1 9 . 1 1 71 71 ASP H H 71 8.356 8.356 7.433 0.923 18792 6788 1 9 . 1 1 72 72 LEU N N 72 120.747 120.747 120.562 0.185 18792 6789 1 9 . 1 1 72 72 LEU C C 72 178.963 178.963 177.956 1.007 18792 6790 1 9 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.856 -1.412 18792 6791 1 9 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.042 -1.025 18792 6792 1 9 . 1 1 72 72 LEU H H 72 7.738 7.738 7.909 -0.171 18792 6793 1 9 . 1 1 73 73 THR N N 73 109.432 109.432 109.549 -0.117 18792 6794 1 9 . 1 1 73 73 THR C C 73 177.481 177.481 176.956 0.525 18792 6795 1 9 . 1 1 73 73 THR CA C 73 65.128 65.128 65.618 -0.490 18792 6796 1 9 . 1 1 73 73 THR CB C 73 67.720 67.720 68.371 -0.651 18792 6797 1 9 . 1 1 73 73 THR H H 73 8.296 8.296 7.766 0.530 18792 6798 1 9 . 1 1 74 74 SER N N 74 115.862 115.862 116.104 -0.242 18792 6799 1 9 . 1 1 74 74 SER C C 74 175.361 175.361 176.129 -0.768 18792 6800 1 9 . 1 1 74 74 SER CA C 74 60.112 60.112 60.431 -0.320 18792 6801 1 9 . 1 1 74 74 SER CB C 74 62.537 62.537 62.906 -0.369 18792 6802 1 9 . 1 1 74 74 SER H H 74 7.629 7.629 7.750 -0.121 18792 6803 1 9 . 1 1 75 75 GLN N N 75 118.551 118.551 120.176 -1.625 18792 6804 1 9 . 1 1 75 75 GLN C C 75 176.316 176.316 177.470 -1.154 18792 6805 1 9 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.489 -0.685 18792 6806 1 9 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.526 -1.249 18792 6807 1 9 . 1 1 75 75 GLN H H 75 7.640 7.640 7.823 -0.183 18792 6808 1 9 . 1 1 76 76 LEU N N 76 118.313 118.313 120.376 -2.063 18792 6809 1 9 . 1 1 76 76 LEU C C 76 174.160 174.160 177.163 -3.003 18792 6810 1 9 . 1 1 76 76 LEU CA C 76 54.740 54.740 56.354 -1.614 18792 6811 1 9 . 1 1 76 76 LEU CB C 76 42.727 42.727 42.340 0.387 18792 6812 1 9 . 1 1 76 76 LEU H H 76 7.411 7.411 7.800 -0.389 18792 6813 1 9 . 1 1 77 77 HIS N N 77 120.104 120.104 117.591 2.513 18792 6814 1 9 . 1 1 77 77 HIS C C 77 174.528 174.528 173.901 0.627 18792 6815 1 9 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.994 -1.787 18792 6816 1 9 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.591 -0.625 18792 6817 1 9 . 1 1 77 77 HIS H H 77 8.117 8.117 7.626 0.491 18792 6818 1 9 . 1 1 78 78 ILE N N 78 122.298 122.298 123.705 -1.407 18792 6819 1 9 . 1 1 78 78 ILE C C 78 174.240 174.240 174.761 -0.521 18792 6820 1 9 . 1 1 78 78 ILE CA C 78 61.402 61.402 63.091 -1.689 18792 6821 1 9 . 1 1 78 78 ILE CB C 78 37.591 37.591 38.628 -1.037 18792 6822 1 9 . 1 1 78 78 ILE H H 78 8.655 8.655 8.003 0.652 18792 6823 1 9 . 1 1 79 79 THR N N 79 116.442 116.442 119.151 -2.709 18792 6824 1 9 . 1 1 79 79 THR C C 79 174.291 174.291 172.935 1.356 18792 6825 1 9 . 1 1 79 79 THR CA C 79 61.632 61.632 62.180 -0.548 18792 6826 1 9 . 1 1 79 79 THR CB C 79 68.704 68.704 67.832 0.872 18792 6827 1 9 . 1 1 79 79 THR H H 79 8.245 8.245 8.576 -0.331 18792 6828 1 9 . 1 1 84 84 TYR N N 84 120.888 120.888 122.485 -1.597 18792 6829 1 9 . 1 1 84 84 TYR C C 84 176.708 176.708 177.283 -0.575 18792 6830 1 9 . 1 1 84 84 TYR CA C 84 60.432 60.432 60.995 -0.563 18792 6831 1 9 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.510 -0.765 18792 6832 1 9 . 1 1 84 84 TYR H H 84 8.733 8.733 9.246 -0.513 18792 6833 1 9 . 1 1 85 85 GLN N N 85 114.530 114.530 119.485 -4.955 18792 6834 1 9 . 1 1 85 85 GLN C C 85 178.473 178.473 178.479 -0.006 18792 6835 1 9 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.213 0.081 18792 6836 1 9 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.864 -1.063 18792 6837 1 9 . 1 1 85 85 GLN H H 85 8.413 8.413 7.820 0.593 18792 6838 1 9 . 1 1 86 86 SER N N 86 114.032 114.032 115.807 -1.775 18792 6839 1 9 . 1 1 86 86 SER C C 86 178.473 178.473 176.718 1.755 18792 6840 1 9 . 1 1 86 86 SER CA C 86 62.175 62.175 61.236 0.939 18792 6841 1 9 . 1 1 86 86 SER CB C 86 63.252 63.252 62.725 0.527 18792 6842 1 9 . 1 1 86 86 SER H H 86 7.258 7.258 7.492 -0.234 18792 6843 1 9 . 1 1 88 88 GLU N N 88 119.386 119.386 119.819 -0.433 18792 6844 1 9 . 1 1 88 88 GLU C C 88 177.199 177.199 179.124 -1.925 18792 6845 1 9 . 1 1 88 88 GLU CA C 88 58.582 58.582 60.173 -1.591 18792 6846 1 9 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.142 -0.166 18792 6847 1 9 . 1 1 88 88 GLU H H 88 8.534 8.534 8.668 -0.134 18792 6848 1 9 . 1 1 89 89 GLN N N 89 114.678 114.678 119.247 -4.569 18792 6849 1 9 . 1 1 89 89 GLN C C 89 178.669 178.669 178.595 0.074 18792 6850 1 9 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.097 -0.515 18792 6851 1 9 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.839 -1.417 18792 6852 1 9 . 1 1 89 89 GLN H H 89 7.500 7.500 7.798 -0.298 18792 6853 1 9 . 1 1 90 90 VAL N N 90 118.174 118.174 119.772 -1.598 18792 6854 1 9 . 1 1 90 90 VAL C C 90 178.081 178.081 178.311 -0.230 18792 6855 1 9 . 1 1 90 90 VAL CA C 90 65.555 65.555 66.150 -0.595 18792 6856 1 9 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.547 0.060 18792 6857 1 9 . 1 1 90 90 VAL H H 90 7.017 7.017 7.680 -0.663 18792 6858 1 9 . 1 1 91 91 VAL N N 91 119.489 119.489 120.654 -1.165 18792 6859 1 9 . 1 1 91 91 VAL C C 91 177.914 177.914 178.097 -0.183 18792 6860 1 9 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.574 -0.805 18792 6861 1 9 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.160 -0.869 18792 6862 1 9 . 1 1 91 91 VAL H H 91 7.833 7.833 8.590 -0.757 18792 6863 1 9 . 1 1 92 92 ASN N N 92 117.180 117.180 117.365 -0.185 18792 6864 1 9 . 1 1 92 92 ASN C C 92 179.110 179.110 177.133 1.977 18792 6865 1 9 . 1 1 92 92 ASN CA C 92 54.918 54.918 55.997 -1.079 18792 6866 1 9 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.802 -2.834 18792 6867 1 9 . 1 1 92 92 ASN H H 92 8.368 8.368 8.472 -0.104 18792 6868 1 9 . 1 1 93 93 GLU N N 93 118.476 118.476 118.463 0.013 18792 6869 1 9 . 1 1 93 93 GLU C C 93 179.355 179.355 179.170 0.185 18792 6870 1 9 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.001 -0.596 18792 6871 1 9 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.146 -2.413 18792 6872 1 9 . 1 1 93 93 GLU H H 93 7.213 7.213 8.068 -0.855 18792 6873 1 9 . 1 1 94 94 LEU N N 94 120.889 120.889 119.531 1.358 18792 6874 1 9 . 1 1 94 94 LEU C C 94 178.473 178.473 177.903 0.570 18792 6875 1 9 . 1 1 94 94 LEU CA C 94 57.017 57.017 56.774 0.243 18792 6876 1 9 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.349 -2.419 18792 6877 1 9 . 1 1 94 94 LEU H H 94 7.446 7.446 7.914 -0.468 18792 6878 1 9 . 1 1 95 95 PHE N N 95 112.902 112.902 116.941 -4.039 18792 6879 1 9 . 1 1 95 95 PHE C C 95 176.586 176.586 176.162 0.424 18792 6880 1 9 . 1 1 95 95 PHE CA C 95 57.159 57.159 57.120 0.039 18792 6881 1 9 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.703 -1.482 18792 6882 1 9 . 1 1 95 95 PHE H H 95 6.916 6.916 7.900 -0.984 18792 6883 1 9 . 1 1 96 96 ARG N N 96 123.729 123.729 120.106 3.623 18792 6884 1 9 . 1 1 96 96 ARG C C 96 177.272 177.272 176.347 0.925 18792 6885 1 9 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.285 0.938 18792 6886 1 9 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.724 -2.292 18792 6887 1 9 . 1 1 96 96 ARG H H 96 7.126 7.126 7.521 -0.395 18792 6888 1 9 . 1 1 97 97 ASP N N 97 116.576 116.576 116.998 -0.422 18792 6889 1 9 . 1 1 97 97 ASP C C 97 175.687 175.687 174.581 1.106 18792 6890 1 9 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.180 -0.507 18792 6891 1 9 . 1 1 97 97 ASP CB C 97 40.045 40.045 41.842 -1.797 18792 6892 1 9 . 1 1 97 97 ASP H H 97 8.644 8.644 8.017 0.627 18792 6893 1 9 . 1 1 98 98 GLY N N 98 108.551 108.551 108.931 -0.380 18792 6894 1 9 . 1 1 98 98 GLY C C 98 172.690 172.690 173.745 -1.055 18792 6895 1 9 . 1 1 98 98 GLY CA C 98 43.250 43.250 44.681 -1.431 18792 6896 1 9 . 1 1 98 98 GLY H H 98 7.463 7.463 7.630 -0.167 18792 6897 1 9 . 1 1 99 99 VAL N N 99 120.630 120.630 121.631 -1.001 18792 6898 1 9 . 1 1 99 99 VAL C C 99 174.503 174.503 174.832 -0.329 18792 6899 1 9 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.341 -1.023 18792 6900 1 9 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.229 -1.466 18792 6901 1 9 . 1 1 99 99 VAL H H 99 8.184 8.184 8.799 -0.615 18792 6902 1 9 . 1 1 100 100 ASN N N 100 115.485 115.485 113.504 1.981 18792 6903 1 9 . 1 1 100 100 ASN C C 100 175.239 175.239 176.360 -1.121 18792 6904 1 9 . 1 1 100 100 ASN CA C 100 51.361 51.361 53.586 -2.225 18792 6905 1 9 . 1 1 100 100 ASN CB C 100 38.920 38.920 37.500 1.420 18792 6906 1 9 . 1 1 100 100 ASN H H 100 6.241 6.241 7.977 -1.736 18792 6907 1 9 . 1 1 101 101 TRP N N 101 118.266 118.266 120.291 -2.025 18792 6908 1 9 . 1 1 101 101 TRP C C 101 178.301 178.301 176.932 1.369 18792 6909 1 9 . 1 1 101 101 TRP CA C 101 60.539 60.539 60.291 0.249 18792 6910 1 9 . 1 1 101 101 TRP CB C 101 29.830 29.830 29.307 0.523 18792 6911 1 9 . 1 1 101 101 TRP H H 101 8.409 8.409 7.758 0.651 18792 6912 1 9 . 1 1 102 102 GLY N N 102 106.147 106.147 103.880 2.267 18792 6913 1 9 . 1 1 102 102 GLY C C 102 177.640 177.640 175.688 1.952 18792 6914 1 9 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.610 2.304 18792 6915 1 9 . 1 1 102 102 GLY H H 102 8.504 8.504 8.566 -0.062 18792 6916 1 9 . 1 1 103 103 ARG N N 103 121.347 121.347 121.690 -0.343 18792 6917 1 9 . 1 1 103 103 ARG C C 103 177.738 177.738 178.102 -0.364 18792 6918 1 9 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.163 -0.221 18792 6919 1 9 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.808 0.411 18792 6920 1 9 . 1 1 103 103 ARG H H 103 8.099 8.099 8.388 -0.289 18792 6921 1 9 . 1 1 104 104 ILE N N 104 120.930 120.930 119.908 1.022 18792 6922 1 9 . 1 1 104 104 ILE C C 104 178.197 178.197 177.879 0.318 18792 6923 1 9 . 1 1 104 104 ILE CA C 104 66.535 66.535 65.417 1.118 18792 6924 1 9 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.325 -2.280 18792 6925 1 9 . 1 1 104 104 ILE H H 104 7.690 7.690 7.867 -0.177 18792 6926 1 9 . 1 1 105 105 VAL N N 105 120.938 120.938 119.367 1.571 18792 6927 1 9 . 1 1 105 105 VAL C C 105 177.854 177.854 178.051 -0.197 18792 6928 1 9 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.020 1.438 18792 6929 1 9 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.727 -0.353 18792 6930 1 9 . 1 1 105 105 VAL H H 105 8.245 8.245 7.537 0.708 18792 6931 1 9 . 1 1 106 106 ALA N N 106 121.165 121.165 120.682 0.483 18792 6932 1 9 . 1 1 106 106 ALA C C 106 178.284 178.284 179.234 -0.950 18792 6933 1 9 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.089 0.509 18792 6934 1 9 . 1 1 106 106 ALA CB C 106 17.515 17.515 19.064 -1.549 18792 6935 1 9 . 1 1 106 106 ALA H H 106 7.529 7.529 7.823 -0.294 18792 6936 1 9 . 1 1 107 107 PHE N N 107 119.242 119.242 121.566 -2.324 18792 6937 1 9 . 1 1 107 107 PHE C C 107 176.390 176.390 176.616 -0.226 18792 6938 1 9 . 1 1 107 107 PHE CA C 107 60.173 60.173 61.240 -1.067 18792 6939 1 9 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.240 -2.153 18792 6940 1 9 . 1 1 107 107 PHE H H 107 7.974 7.974 7.821 0.153 18792 6941 1 9 . 1 1 108 108 PHE N N 108 120.009 120.009 119.534 0.475 18792 6942 1 9 . 1 1 108 108 PHE C C 108 177.640 177.640 176.621 1.019 18792 6943 1 9 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.340 2.084 18792 6944 1 9 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.709 -3.363 18792 6945 1 9 . 1 1 108 108 PHE H H 108 7.946 7.946 8.504 -0.558 18792 6946 1 9 . 1 1 109 109 SER N N 109 114.631 114.631 116.300 -1.669 18792 6947 1 9 . 1 1 109 109 SER C C 109 177.770 177.770 176.199 1.571 18792 6948 1 9 . 1 1 109 109 SER CA C 109 63.349 63.349 62.050 1.299 18792 6949 1 9 . 1 1 109 109 SER H H 109 8.424 8.424 7.644 0.780 18792 6950 1 9 . 1 1 110 110 PHE N N 110 124.230 124.230 124.270 -0.040 18792 6951 1 9 . 1 1 110 110 PHE C C 110 176.708 176.708 177.287 -0.579 18792 6952 1 9 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.908 -0.294 18792 6953 1 9 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.921 -1.477 18792 6954 1 9 . 1 1 110 110 PHE H H 110 9.052 9.052 8.395 0.657 18792 6955 1 9 . 1 1 111 111 GLY N N 111 105.893 105.893 105.844 0.049 18792 6956 1 9 . 1 1 111 111 GLY C C 111 176.795 176.795 176.154 0.641 18792 6957 1 9 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.350 1.026 18792 6958 1 9 . 1 1 111 111 GLY H H 111 7.926 7.926 8.505 -0.579 18792 6959 1 9 . 1 1 112 112 GLY N N 112 107.410 107.410 109.495 -2.085 18792 6960 1 9 . 1 1 112 112 GLY C C 112 174.650 174.650 175.160 -0.510 18792 6961 1 9 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.187 1.118 18792 6962 1 9 . 1 1 112 112 GLY H H 112 8.799 8.799 7.906 0.893 18792 6963 1 9 . 1 1 113 113 ALA N N 113 124.313 124.313 124.827 -0.514 18792 6964 1 9 . 1 1 113 113 ALA C C 113 181.300 181.300 179.478 1.822 18792 6965 1 9 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.714 -0.187 18792 6966 1 9 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.239 -0.756 18792 6967 1 9 . 1 1 113 113 ALA H H 113 8.212 8.212 7.595 0.617 18792 6968 1 9 . 1 1 114 114 LEU N N 114 118.878 118.878 118.225 0.653 18792 6969 1 9 . 1 1 114 114 LEU C C 114 180.286 180.286 179.111 1.175 18792 6970 1 9 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.631 -0.649 18792 6971 1 9 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.355 -0.338 18792 6972 1 9 . 1 1 114 114 LEU H H 114 8.161 8.161 7.661 0.500 18792 6973 1 9 . 1 1 115 115 CYS N N 115 119.002 119.002 117.738 1.264 18792 6974 1 9 . 1 1 115 115 CYS C C 115 176.087 176.087 176.733 -0.646 18792 6975 1 9 . 1 1 115 115 CYS CA C 115 63.944 63.944 64.063 -0.119 18792 6976 1 9 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.005 -1.370 18792 6977 1 9 . 1 1 115 115 CYS H H 115 8.070 8.070 7.895 0.175 18792 6978 1 9 . 1 1 116 116 VAL N N 116 118.737 118.737 120.112 -1.375 18792 6979 1 9 . 1 1 116 116 VAL C C 116 177.494 177.494 178.403 -0.909 18792 6980 1 9 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.458 0.304 18792 6981 1 9 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.112 -0.349 18792 6982 1 9 . 1 1 116 116 VAL H H 116 7.995 7.995 7.492 0.503 18792 6983 1 9 . 1 1 117 117 GLU N N 117 118.886 118.886 118.921 -0.035 18792 6984 1 9 . 1 1 117 117 GLU C C 117 178.424 178.424 179.203 -0.779 18792 6985 1 9 . 1 1 117 117 GLU CA C 117 58.760 58.760 58.789 -0.030 18792 6986 1 9 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.107 -1.053 18792 6987 1 9 . 1 1 117 117 GLU H H 117 8.059 8.059 7.686 0.373 18792 6988 1 9 . 1 1 118 118 SER N N 118 113.417 113.417 115.850 -2.433 18792 6989 1 9 . 1 1 118 118 SER C C 118 175.607 175.607 176.594 -0.987 18792 6990 1 9 . 1 1 118 118 SER CA C 118 62.638 62.638 61.640 0.998 18792 6991 1 9 . 1 1 118 118 SER CB C 118 61.061 61.061 62.623 -1.562 18792 6992 1 9 . 1 1 118 118 SER H H 118 7.626 7.626 7.570 0.056 18792 6993 1 9 . 1 1 119 119 VAL N N 119 120.612 120.612 119.994 0.618 18792 6994 1 9 . 1 1 119 119 VAL C C 119 179.713 179.713 177.892 1.821 18792 6995 1 9 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.149 1.076 18792 6996 1 9 . 1 1 119 119 VAL CB C 119 30.079 30.079 30.723 -0.644 18792 6997 1 9 . 1 1 119 119 VAL H H 119 7.297 7.297 7.480 -0.183 18792 6998 1 9 . 1 1 120 120 ASP N N 120 122.546 122.546 120.336 2.210 18792 6999 1 9 . 1 1 120 120 ASP C C 120 178.057 178.057 177.529 0.528 18792 7000 1 9 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.540 0.449 18792 7001 1 9 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.931 -1.008 18792 7002 1 9 . 1 1 120 120 ASP H H 120 8.264 8.264 7.601 0.663 18792 7003 1 9 . 1 1 121 121 LYS N N 121 115.636 115.636 117.371 -1.735 18792 7004 1 9 . 1 1 121 121 LYS C C 121 175.159 175.159 175.598 -0.439 18792 7005 1 9 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.880 -1.620 18792 7006 1 9 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.903 -2.128 18792 7007 1 9 . 1 1 121 121 LYS H H 121 7.558 7.558 7.409 0.149 18792 7008 1 9 . 1 1 122 122 GLU N N 122 113.915 113.915 117.484 -3.569 18792 7009 1 9 . 1 1 122 122 GLU C C 122 176.109 176.109 175.491 0.618 18792 7010 1 9 . 1 1 122 122 GLU CA C 122 57.307 57.307 56.718 0.589 18792 7011 1 9 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.153 -2.821 18792 7012 1 9 . 1 1 122 122 GLU H H 122 7.826 7.826 7.669 0.157 18792 7013 1 9 . 1 1 124 124 GLN N N 124 119.233 119.233 119.323 -0.090 18792 7014 1 9 . 1 1 124 124 GLN C C 124 177.640 177.640 176.455 1.185 18792 7015 1 9 . 1 1 124 124 GLN CA C 124 59.472 59.472 56.517 2.955 18792 7016 1 9 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.561 -2.071 18792 7017 1 9 . 1 1 124 124 GLN H H 124 8.626 8.626 8.636 -0.010 18792 7018 1 9 . 1 1 125 125 VAL N N 125 117.011 117.011 114.790 2.221 18792 7019 1 9 . 1 1 125 125 VAL C C 125 175.826 175.826 175.983 -0.157 18792 7020 1 9 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.365 -0.229 18792 7021 1 9 . 1 1 125 125 VAL CB C 125 30.297 30.297 30.948 -0.651 18792 7022 1 9 . 1 1 125 125 VAL H H 125 7.870 7.870 7.306 0.564 18792 7023 1 9 . 1 1 126 126 LEU N N 126 117.058 117.058 118.846 -1.788 18792 7024 1 9 . 1 1 126 126 LEU C C 126 178.096 178.096 178.502 -0.406 18792 7025 1 9 . 1 1 126 126 LEU CA C 126 55.085 55.085 58.002 -2.917 18792 7026 1 9 . 1 1 126 126 LEU CB C 126 40.273 40.273 41.525 -1.252 18792 7027 1 9 . 1 1 126 126 LEU H H 126 7.747 7.747 8.200 -0.453 18792 7028 1 9 . 1 1 127 127 VAL N N 127 119.457 119.457 118.736 0.721 18792 7029 1 9 . 1 1 127 127 VAL C C 127 177.150 177.150 178.318 -1.168 18792 7030 1 9 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.751 0.405 18792 7031 1 9 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.897 -1.144 18792 7032 1 9 . 1 1 127 127 VAL H H 127 7.306 7.306 8.037 -0.731 18792 7033 1 9 . 1 1 128 128 SER N N 128 110.647 110.647 115.203 -4.556 18792 7034 1 9 . 1 1 128 128 SER C C 128 177.222 177.222 177.041 0.181 18792 7035 1 9 . 1 1 128 128 SER CA C 128 60.752 60.752 61.484 -0.733 18792 7036 1 9 . 1 1 128 128 SER CB C 128 61.605 61.605 62.732 -1.127 18792 7037 1 9 . 1 1 128 128 SER H H 128 8.237 8.237 8.175 0.062 18792 7038 1 9 . 1 1 129 129 ARG N N 129 123.100 123.100 122.260 0.840 18792 7039 1 9 . 1 1 129 129 ARG C C 129 175.802 175.802 178.519 -2.717 18792 7040 1 9 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.400 -0.173 18792 7041 1 9 . 1 1 129 129 ARG CB C 129 28.199 28.199 29.753 -1.554 18792 7042 1 9 . 1 1 129 129 ARG H H 129 6.564 6.564 7.883 -1.319 18792 7043 1 9 . 1 1 130 130 ILE N N 130 118.182 118.182 120.158 -1.976 18792 7044 1 9 . 1 1 130 130 ILE C C 130 178.156 178.156 177.955 0.201 18792 7045 1 9 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.443 -1.097 18792 7046 1 9 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.580 -0.898 18792 7047 1 9 . 1 1 130 130 ILE H H 130 7.955 7.955 8.536 -0.581 18792 7048 1 9 . 1 1 131 131 ALA N N 131 119.029 119.029 121.298 -2.269 18792 7049 1 9 . 1 1 131 131 ALA C C 131 179.593 179.593 179.384 0.209 18792 7050 1 9 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.290 -0.692 18792 7051 1 9 . 1 1 131 131 ALA CB C 131 17.388 17.388 17.890 -0.502 18792 7052 1 9 . 1 1 131 131 ALA H H 131 7.582 7.582 8.563 -0.981 18792 7053 1 9 . 1 1 132 132 ALA N N 132 120.336 120.336 122.039 -1.703 18792 7054 1 9 . 1 1 132 132 ALA C C 132 181.095 181.095 179.727 1.368 18792 7055 1 9 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.771 -0.173 18792 7056 1 9 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.471 -1.770 18792 7057 1 9 . 1 1 132 132 ALA H H 132 7.224 7.224 7.687 -0.463 18792 7058 1 9 . 1 1 133 133 TRP N N 133 121.194 121.194 119.820 1.374 18792 7059 1 9 . 1 1 133 133 TRP C C 133 179.698 179.698 178.625 1.073 18792 7060 1 9 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.057 -2.755 18792 7061 1 9 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.650 -1.995 18792 7062 1 9 . 1 1 133 133 TRP H H 133 8.925 8.925 8.666 0.259 18792 7063 1 9 . 1 1 134 134 MET N N 134 116.987 116.987 118.139 -1.152 18792 7064 1 9 . 1 1 134 134 MET C C 134 178.277 178.277 178.318 -0.041 18792 7065 1 9 . 1 1 134 134 MET CA C 134 59.578 59.578 57.844 1.734 18792 7066 1 9 . 1 1 134 134 MET CB C 134 33.559 33.559 32.146 1.413 18792 7067 1 9 . 1 1 134 134 MET H H 134 8.863 8.863 8.538 0.325 18792 7068 1 9 . 1 1 135 135 ALA N N 135 120.523 120.523 121.229 -0.706 18792 7069 1 9 . 1 1 135 135 ALA C C 135 179.298 179.298 179.504 -0.206 18792 7070 1 9 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.160 0.273 18792 7071 1 9 . 1 1 135 135 ALA CB C 135 16.637 16.637 17.947 -1.310 18792 7072 1 9 . 1 1 135 135 ALA H H 135 8.152 8.152 8.414 -0.262 18792 7073 1 9 . 1 1 136 136 THR N N 136 116.715 116.715 117.172 -0.457 18792 7074 1 9 . 1 1 136 136 THR C C 136 175.106 175.106 176.145 -1.039 18792 7075 1 9 . 1 1 136 136 THR CA C 136 66.729 66.729 67.643 -0.914 18792 7076 1 9 . 1 1 136 136 THR CB C 136 68.441 68.441 68.901 -0.460 18792 7077 1 9 . 1 1 136 136 THR H H 136 8.532 8.532 8.081 0.451 18792 7078 1 9 . 1 1 137 137 TYR N N 137 123.204 123.204 121.000 2.204 18792 7079 1 9 . 1 1 137 137 TYR C C 137 179.592 179.592 177.784 1.808 18792 7080 1 9 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.914 1.151 18792 7081 1 9 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.333 -0.345 18792 7082 1 9 . 1 1 137 137 TYR H H 137 8.809 8.809 7.663 1.146 18792 7083 1 9 . 1 1 138 138 LEU N N 138 119.247 119.247 121.637 -2.390 18792 7084 1 9 . 1 1 138 138 LEU C C 138 178.385 178.385 177.666 0.719 18792 7085 1 9 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.425 0.513 18792 7086 1 9 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.976 -0.268 18792 7087 1 9 . 1 1 138 138 LEU H H 138 8.742 8.742 8.512 0.230 18792 7088 1 9 . 1 1 139 139 ASN N N 139 117.122 117.122 115.598 1.524 18792 7089 1 9 . 1 1 139 139 ASN C C 139 176.417 176.417 177.332 -0.915 18792 7090 1 9 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.330 1.118 18792 7091 1 9 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.194 0.458 18792 7092 1 9 . 1 1 139 139 ASN H H 139 8.307 8.307 8.001 0.306 18792 7093 1 9 . 1 1 140 140 ASP N N 140 115.394 115.394 119.764 -4.370 18792 7094 1 9 . 1 1 140 140 ASP C C 140 177.919 177.919 177.342 0.577 18792 7095 1 9 . 1 1 140 140 ASP CA C 140 55.953 55.953 57.187 -1.234 18792 7096 1 9 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.950 -1.565 18792 7097 1 9 . 1 1 140 140 ASP H H 140 8.439 8.439 7.823 0.616 18792 7098 1 9 . 1 1 141 141 HIS N N 141 111.695 111.695 111.603 0.092 18792 7099 1 9 . 1 1 141 141 HIS C C 141 175.949 175.949 176.045 -0.096 18792 7100 1 9 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.464 -0.407 18792 7101 1 9 . 1 1 141 141 HIS CB C 141 29.908 29.908 30.334 -0.426 18792 7102 1 9 . 1 1 141 141 HIS H H 141 8.043 8.043 7.131 0.912 18792 7103 1 9 . 1 1 142 142 LEU N N 142 117.054 117.054 122.146 -5.092 18792 7104 1 9 . 1 1 142 142 LEU C C 142 176.530 176.530 177.571 -1.041 18792 7105 1 9 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.952 -2.643 18792 7106 1 9 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.679 0.659 18792 7107 1 9 . 1 1 142 142 LEU H H 142 7.198 7.198 7.572 -0.374 18792 7108 1 9 . 1 1 143 143 GLU N N 143 121.335 121.335 119.822 1.513 18792 7109 1 9 . 1 1 143 143 GLU C C 143 173.964 173.964 175.524 -1.560 18792 7110 1 9 . 1 1 143 143 GLU CA C 143 60.254 60.254 61.167 -0.913 18792 7111 1 9 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.333 -2.076 18792 7112 1 9 . 1 1 143 143 GLU H H 143 8.565 8.565 7.844 0.721 18792 7113 1 9 . 1 1 145 145 TRP N N 145 117.973 117.973 120.297 -2.324 18792 7114 1 9 . 1 1 145 145 TRP C C 145 179.526 179.526 177.849 1.677 18792 7115 1 9 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.606 1.000 18792 7116 1 9 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.614 -1.726 18792 7117 1 9 . 1 1 145 145 TRP H H 145 7.078 7.078 8.469 -1.391 18792 7118 1 9 . 1 1 146 146 ILE N N 146 122.101 122.101 111.191 10.910 18792 7119 1 9 . 1 1 146 146 ILE C C 146 179.110 179.110 177.528 1.582 18792 7120 1 9 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.183 4.151 18792 7121 1 9 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.680 -0.858 18792 7122 1 9 . 1 1 146 146 ILE H H 146 8.389 8.389 7.534 0.855 18792 7123 1 9 . 1 1 147 147 GLN N N 147 116.344 116.344 121.247 -4.903 18792 7124 1 9 . 1 1 147 147 GLN C C 147 179.526 179.526 177.611 1.915 18792 7125 1 9 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.424 -0.411 18792 7126 1 9 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.366 -0.643 18792 7127 1 9 . 1 1 147 147 GLN H H 147 8.376 8.376 8.041 0.335 18792 7128 1 9 . 1 1 148 148 GLU N N 148 118.913 118.913 120.315 -1.402 18792 7129 1 9 . 1 1 148 148 GLU C C 148 176.880 176.880 178.639 -1.759 18792 7130 1 9 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.358 -2.985 18792 7131 1 9 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.567 -1.135 18792 7132 1 9 . 1 1 148 148 GLU H H 148 7.504 7.504 8.080 -0.576 18792 7133 1 9 . 1 1 149 149 ASN N N 149 116.616 116.616 113.837 2.779 18792 7134 1 9 . 1 1 149 149 ASN C C 149 173.964 173.964 176.762 -2.798 18792 7135 1 9 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.605 -0.359 18792 7136 1 9 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.597 -2.464 18792 7137 1 9 . 1 1 149 149 ASN H H 149 7.070 7.070 8.182 -1.112 18792 7138 1 9 . 1 1 150 150 GLY N N 150 104.750 104.750 105.789 -1.039 18792 7139 1 9 . 1 1 150 150 GLY C C 150 176.022 176.022 174.055 1.967 18792 7140 1 9 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.793 -0.551 18792 7141 1 9 . 1 1 150 150 GLY H H 150 7.313 7.313 8.180 -0.867 18792 7142 1 9 . 1 1 151 151 GLY N N 151 108.385 108.385 108.205 0.180 18792 7143 1 9 . 1 1 151 151 GLY C C 151 173.449 173.449 174.472 -1.023 18792 7144 1 9 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.450 -0.418 18792 7145 1 9 . 1 1 151 151 GLY H H 151 8.452 8.452 7.292 1.160 18792 7146 1 9 . 1 1 152 152 TRP N N 152 118.092 118.092 121.682 -3.590 18792 7147 1 9 . 1 1 152 152 TRP C C 152 178.571 178.571 177.959 0.612 18792 7148 1 9 . 1 1 152 152 TRP CA C 152 60.077 60.077 60.094 -0.017 18792 7149 1 9 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.826 -1.238 18792 7150 1 9 . 1 1 152 152 TRP H H 152 8.644 8.644 8.375 0.269 18792 7151 1 9 . 1 1 153 153 ASP N N 153 117.758 117.758 118.541 -0.783 18792 7152 1 9 . 1 1 153 153 ASP C C 153 179.796 179.796 178.491 1.305 18792 7153 1 9 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.430 -0.128 18792 7154 1 9 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.176 -1.945 18792 7155 1 9 . 1 1 153 153 ASP H H 153 8.827 8.827 8.296 0.531 18792 7156 1 9 . 1 1 154 154 THR N N 154 116.817 116.817 117.391 -0.574 18792 7157 1 9 . 1 1 154 154 THR C C 154 175.352 175.352 176.590 -1.238 18792 7158 1 9 . 1 1 154 154 THR CA C 154 65.910 65.910 66.594 -0.684 18792 7159 1 9 . 1 1 154 154 THR CB C 154 67.712 67.712 69.075 -1.363 18792 7160 1 9 . 1 1 154 154 THR H H 154 7.494 7.494 7.716 -0.222 18792 7161 1 9 . 1 1 155 155 PHE N N 155 122.196 122.196 121.311 0.885 18792 7162 1 9 . 1 1 155 155 PHE C C 155 176.831 176.831 177.585 -0.754 18792 7163 1 9 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.864 0.422 18792 7164 1 9 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.263 -1.596 18792 7165 1 9 . 1 1 155 155 PHE H H 155 6.477 6.477 8.778 -2.301 18792 7166 1 9 . 1 1 156 156 VAL N N 156 117.387 117.387 119.212 -1.825 18792 7167 1 9 . 1 1 156 156 VAL C C 156 178.497 178.497 177.998 0.499 18792 7168 1 9 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.607 -0.376 18792 7169 1 9 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.177 -0.492 18792 7170 1 9 . 1 1 156 156 VAL H H 156 7.788 7.788 8.263 -0.475 18792 7171 1 9 . 1 1 157 157 GLU N N 157 119.876 119.876 120.720 -0.844 18792 7172 1 9 . 1 1 157 157 GLU C C 157 178.399 178.399 179.415 -1.016 18792 7173 1 9 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.802 -1.042 18792 7174 1 9 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.767 -1.490 18792 7175 1 9 . 1 1 157 157 GLU H H 157 7.409 7.409 8.260 -0.851 18792 7176 1 9 . 1 1 158 158 LEU N N 158 117.194 117.194 119.484 -2.290 18792 7177 1 9 . 1 1 158 158 LEU C C 158 178.595 178.595 178.378 0.217 18792 7178 1 9 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.319 -0.942 18792 7179 1 9 . 1 1 158 158 LEU CB C 158 42.571 42.571 41.456 1.115 18792 7180 1 9 . 1 1 158 158 LEU H H 158 7.584 7.584 7.892 -0.308 18792 7181 1 9 . 1 1 159 159 TYR N N 159 115.549 115.549 117.912 -2.363 18792 7182 1 9 . 1 1 159 159 TYR C C 159 177.032 177.032 177.180 -0.148 18792 7183 1 9 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.847 -0.731 18792 7184 1 9 . 1 1 159 159 TYR CB C 159 37.599 37.599 39.321 -1.722 18792 7185 1 9 . 1 1 159 159 TYR H H 159 8.099 8.099 8.049 0.050 18792 7186 1 9 . 1 1 160 160 GLY N N 160 108.334 108.334 106.588 1.746 18792 7187 1 9 . 1 1 160 160 GLY C C 160 173.973 173.973 174.867 -0.894 18792 7188 1 9 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.864 0.200 18792 7189 1 9 . 1 1 160 160 GLY H H 160 8.020 8.020 8.269 -0.249 18792 7190 1 9 . 1 1 161 161 ASN N N 161 118.189 118.189 120.133 -1.944 18792 7191 1 9 . 1 1 161 161 ASN C C 161 175.513 175.513 174.595 0.918 18792 7192 1 9 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.114 -1.010 18792 7193 1 9 . 1 1 161 161 ASN CB C 161 38.203 38.203 39.310 -1.107 18792 7194 1 9 . 1 1 161 161 ASN H H 161 8.327 8.327 8.059 0.268 18792 7195 1 9 . 1 1 162 162 ASN N N 162 119.022 119.022 117.976 1.046 18792 7196 1 9 . 1 1 162 162 ASN C C 162 175.690 175.690 174.234 1.456 18792 7197 1 9 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.028 0.396 18792 7198 1 9 . 1 1 162 162 ASN CB C 162 38.203 38.203 39.057 -0.854 18792 7199 1 9 . 1 1 162 162 ASN H H 162 8.363 8.363 8.747 -0.384 18792 7200 1 9 . 1 1 163 163 ALA N N 163 123.275 123.275 125.592 -2.317 18792 7201 1 9 . 1 1 163 163 ALA C C 163 178.598 178.598 177.252 1.346 18792 7202 1 9 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.531 -0.293 18792 7203 1 9 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.551 -1.940 18792 7204 1 9 . 1 1 163 163 ALA H H 163 8.103 8.103 8.519 -0.416 18792 7205 1 9 . 1 1 164 164 ALA N N 164 121.521 121.521 121.534 -0.013 18792 7206 1 9 . 1 1 164 164 ALA C C 164 178.642 178.642 178.627 0.015 18792 7207 1 9 . 1 1 164 164 ALA CA C 164 52.584 52.584 53.730 -1.147 18792 7208 1 9 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.273 -0.455 18792 7209 1 9 . 1 1 164 164 ALA H H 164 8.053 8.053 8.259 -0.206 18792 7210 1 9 . 1 1 165 165 ALA N N 165 122.101 122.101 119.655 2.446 18792 7211 1 9 . 1 1 165 165 ALA C C 165 179.124 179.124 178.315 0.809 18792 7212 1 9 . 1 1 165 165 ALA CA C 165 53.139 53.139 53.495 -0.356 18792 7213 1 9 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.794 -0.816 18792 7214 1 9 . 1 1 165 165 ALA H H 165 7.949 7.949 7.783 0.166 18792 7215 1 9 . 1 1 166 166 GLU N N 166 118.381 118.381 118.236 0.145 18792 7216 1 9 . 1 1 166 166 GLU C C 166 177.664 177.664 177.473 0.191 18792 7217 1 9 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.350 0.738 18792 7218 1 9 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.911 -1.557 18792 7219 1 9 . 1 1 166 166 GLU H H 166 8.202 8.202 8.169 0.033 18792 7220 1 9 . 1 1 167 167 SER N N 167 115.193 115.193 115.255 -0.062 18792 7221 1 9 . 1 1 167 167 SER C C 167 175.312 175.312 175.152 0.160 18792 7222 1 9 . 1 1 167 167 SER CA C 167 58.831 58.831 60.846 -2.015 18792 7223 1 9 . 1 1 167 167 SER CB C 167 62.537 62.537 63.474 -0.937 18792 7224 1 9 . 1 1 167 167 SER H H 167 8.029 8.029 7.653 0.376 18792 7225 1 9 . 1 1 168 168 ARG N N 168 121.696 121.696 119.194 2.502 18792 7226 1 9 . 1 1 168 168 ARG C C 168 176.880 176.880 175.194 1.686 18792 7227 1 9 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.291 -0.128 18792 7228 1 9 . 1 1 168 168 ARG CB C 168 29.209 29.209 30.301 -1.092 18792 7229 1 9 . 1 1 168 168 ARG H H 168 7.967 7.967 8.224 -0.257 18792 7230 1 9 . 1 1 169 169 LYS N N 169 120.917 120.917 122.801 -1.884 18792 7231 1 9 . 1 1 169 169 LYS C C 169 177.640 177.640 177.452 0.188 18792 7232 1 9 . 1 1 169 169 LYS CA C 169 56.697 56.697 57.555 -0.858 18792 7233 1 9 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.481 -1.019 18792 7234 1 9 . 1 1 169 169 LYS H H 169 8.011 8.011 8.530 -0.519 18792 7235 1 9 . 1 1 170 170 GLY N N 170 109.155 109.155 105.003 4.152 18792 7236 1 9 . 1 1 170 170 GLY C C 170 174.479 174.479 174.023 0.456 18792 7237 1 9 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.998 0.066 18792 7238 1 9 . 1 1 170 170 GLY H H 170 8.329 8.329 8.282 0.047 18792 7239 1 9 . 1 1 171 171 GLN N N 171 119.292 119.292 117.651 1.641 18792 7240 1 9 . 1 1 171 171 GLN C C 171 176.463 176.463 175.015 1.448 18792 7241 1 9 . 1 1 171 171 GLN CA C 171 55.666 55.666 56.577 -0.911 18792 7242 1 9 . 1 1 171 171 GLN CB C 171 28.199 28.199 27.988 0.211 18792 7243 1 9 . 1 1 171 171 GLN H H 171 8.035 8.035 8.376 -0.341 18792 7244 1 9 . 1 1 172 172 GLU N N 172 121.703 121.703 115.210 6.493 18792 7245 1 9 . 1 1 172 172 GLU C C 172 176.414 176.414 175.414 1.000 18792 7246 1 9 . 1 1 172 172 GLU CA C 172 56.341 56.341 57.545 -1.204 18792 7247 1 9 . 1 1 172 172 GLU CB C 172 28.821 28.821 27.829 0.992 18792 7248 1 9 . 1 1 172 172 GLU H H 172 8.405 8.405 8.140 0.265 18792 7249 1 9 . 1 1 173 173 ARG N N 173 121.852 121.852 121.295 0.557 18792 7250 1 9 . 1 1 173 173 ARG C C 173 176.365 176.365 175.869 0.496 18792 7251 1 9 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.266 0.934 18792 7252 1 9 . 1 1 173 173 ARG CB C 173 29.131 29.131 32.425 -3.294 18792 7253 1 9 . 1 1 173 173 ARG H H 173 8.335 8.335 8.402 -0.067 18792 7254 1 9 . 1 1 174 174 LEU N N 174 122.640 122.640 122.360 0.280 18792 7255 1 9 . 1 1 174 174 LEU C C 174 176.523 176.523 175.919 0.604 18792 7256 1 9 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.490 -0.722 18792 7257 1 9 . 1 1 174 174 LEU CB C 174 40.784 40.784 42.051 -1.267 18792 7258 1 9 . 1 1 174 174 LEU H H 174 8.082 8.082 8.540 -0.458 18792 7259 1 9 . 1 1 175 175 GLU N N 175 125.909 125.909 121.687 4.222 18792 7260 1 9 . 1 1 175 175 GLU C C 175 181.029 181.029 176.148 4.881 18792 7261 1 9 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.947 1.452 18792 7262 1 9 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.235 -1.185 18792 7263 1 9 . 1 1 175 175 GLU H H 175 7.785 7.785 8.422 -0.637 18792 7264 1 10 . 1 1 4 4 ALA N N 4 124.786 124.786 124.439 0.347 18792 7265 1 10 . 1 1 4 4 ALA C C 4 178.272 178.272 179.400 -1.128 18792 7266 1 10 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.977 -2.412 18792 7267 1 10 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.685 -0.451 18792 7268 1 10 . 1 1 4 4 ALA H H 4 8.414 8.414 8.812 -0.398 18792 7269 1 10 . 1 1 5 5 MET N N 5 119.681 119.681 117.626 2.055 18792 7270 1 10 . 1 1 5 5 MET C C 5 176.929 176.929 178.324 -1.395 18792 7271 1 10 . 1 1 5 5 MET CA C 5 55.594 55.594 58.611 -3.017 18792 7272 1 10 . 1 1 5 5 MET CB C 5 31.540 31.540 32.179 -0.639 18792 7273 1 10 . 1 1 5 5 MET H H 5 8.336 8.336 8.226 0.110 18792 7274 1 10 . 1 1 6 6 SER N N 6 116.162 116.162 116.102 0.060 18792 7275 1 10 . 1 1 6 6 SER C C 6 175.924 175.924 176.938 -1.014 18792 7276 1 10 . 1 1 6 6 SER CA C 6 59.009 59.009 62.092 -3.083 18792 7277 1 10 . 1 1 6 6 SER CB C 6 62.537 62.537 62.507 0.030 18792 7278 1 10 . 1 1 6 6 SER H H 6 8.272 8.272 8.705 -0.433 18792 7279 1 10 . 1 1 7 7 GLN N N 7 122.263 122.263 122.163 0.100 18792 7280 1 10 . 1 1 7 7 GLN C C 7 177.027 177.027 178.995 -1.968 18792 7281 1 10 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.862 -2.592 18792 7282 1 10 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.407 -0.668 18792 7283 1 10 . 1 1 7 7 GLN H H 7 8.314 8.314 7.776 0.538 18792 7284 1 10 . 1 1 8 8 SER N N 8 116.625 116.625 116.811 -0.186 18792 7285 1 10 . 1 1 8 8 SER C C 8 176.457 176.457 176.475 -0.018 18792 7286 1 10 . 1 1 8 8 SER CA C 8 59.650 59.650 61.849 -2.199 18792 7287 1 10 . 1 1 8 8 SER CB C 8 62.226 62.226 63.010 -0.784 18792 7288 1 10 . 1 1 8 8 SER H H 8 8.333 8.333 7.787 0.546 18792 7289 1 10 . 1 1 9 9 ASN N N 9 121.307 121.307 119.931 1.376 18792 7290 1 10 . 1 1 9 9 ASN C C 9 177.419 177.419 177.278 0.141 18792 7291 1 10 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.395 -0.908 18792 7292 1 10 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.962 -1.829 18792 7293 1 10 . 1 1 9 9 ASN H H 9 8.611 8.611 8.749 -0.138 18792 7294 1 10 . 1 1 10 10 ARG N N 10 119.830 119.830 120.989 -1.159 18792 7295 1 10 . 1 1 10 10 ARG C C 10 177.615 177.615 178.307 -0.692 18792 7296 1 10 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.751 -0.493 18792 7297 1 10 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.409 -2.210 18792 7298 1 10 . 1 1 10 10 ARG H H 10 7.996 7.996 8.565 -0.569 18792 7299 1 10 . 1 1 11 11 GLU N N 11 117.270 117.270 119.719 -2.449 18792 7300 1 10 . 1 1 11 11 GLU C C 11 179.649 179.649 178.783 0.866 18792 7301 1 10 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.289 -0.280 18792 7302 1 10 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.584 -1.463 18792 7303 1 10 . 1 1 11 11 GLU H H 11 7.885 7.885 8.372 -0.487 18792 7304 1 10 . 1 1 12 12 LEU N N 12 119.900 119.900 121.110 -1.210 18792 7305 1 10 . 1 1 12 12 LEU C C 12 178.473 178.473 178.416 0.057 18792 7306 1 10 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.272 -0.579 18792 7307 1 10 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.748 -1.119 18792 7308 1 10 . 1 1 12 12 LEU H H 12 7.691 7.691 7.994 -0.303 18792 7309 1 10 . 1 1 13 13 VAL N N 13 117.320 117.320 118.315 -0.995 18792 7310 1 10 . 1 1 13 13 VAL C C 13 177.272 177.272 178.370 -1.098 18792 7311 1 10 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.477 0.679 18792 7312 1 10 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.213 0.016 18792 7313 1 10 . 1 1 13 13 VAL H H 13 7.629 7.629 7.743 -0.114 18792 7314 1 10 . 1 1 14 14 VAL N N 14 116.659 116.659 120.399 -3.740 18792 7315 1 10 . 1 1 14 14 VAL C C 14 178.718 178.718 177.898 0.820 18792 7316 1 10 . 1 1 14 14 VAL CA C 14 66.516 66.516 67.000 -0.484 18792 7317 1 10 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.537 -1.163 18792 7318 1 10 . 1 1 14 14 VAL H H 14 8.210 8.210 8.162 0.047 18792 7319 1 10 . 1 1 15 15 ASP N N 15 120.374 120.374 121.407 -1.033 18792 7320 1 10 . 1 1 15 15 ASP C C 15 177.557 177.557 178.344 -0.787 18792 7321 1 10 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.435 1.041 18792 7322 1 10 . 1 1 15 15 ASP CB C 15 42.553 42.553 41.245 1.308 18792 7323 1 10 . 1 1 15 15 ASP H H 15 7.967 7.967 8.717 -0.750 18792 7324 1 10 . 1 1 16 16 PHE N N 16 119.864 119.864 121.145 -1.281 18792 7325 1 10 . 1 1 16 16 PHE C C 16 178.252 178.252 177.494 0.758 18792 7326 1 10 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.689 1.091 18792 7327 1 10 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.028 0.032 18792 7328 1 10 . 1 1 16 16 PHE H H 16 8.228 8.228 7.920 0.308 18792 7329 1 10 . 1 1 17 17 LEU N N 17 116.312 116.312 118.514 -2.202 18792 7330 1 10 . 1 1 17 17 LEU C C 17 179.649 179.649 178.997 0.652 18792 7331 1 10 . 1 1 17 17 LEU CA C 17 57.764 57.764 57.976 -0.212 18792 7332 1 10 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.724 -1.639 18792 7333 1 10 . 1 1 17 17 LEU H H 17 8.766 8.766 8.143 0.623 18792 7334 1 10 . 1 1 18 18 SER N N 18 113.715 113.715 115.208 -1.493 18792 7335 1 10 . 1 1 18 18 SER C C 18 177.362 177.362 176.082 1.280 18792 7336 1 10 . 1 1 18 18 SER CA C 18 61.948 61.948 61.378 0.570 18792 7337 1 10 . 1 1 18 18 SER CB C 18 63.003 63.003 63.148 -0.145 18792 7338 1 10 . 1 1 18 18 SER H H 18 8.384 8.384 8.307 0.077 18792 7339 1 10 . 1 1 19 19 TYR N N 19 124.570 124.570 123.761 0.809 18792 7340 1 10 . 1 1 19 19 TYR C C 19 178.415 178.415 177.189 1.226 18792 7341 1 10 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.561 -1.797 18792 7342 1 10 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.553 -1.537 18792 7343 1 10 . 1 1 19 19 TYR H H 19 8.155 8.155 8.697 -0.542 18792 7344 1 10 . 1 1 20 20 LYS N N 20 119.739 119.739 118.821 0.918 18792 7345 1 10 . 1 1 20 20 LYS C C 20 180.456 180.456 178.829 1.627 18792 7346 1 10 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.775 -3.287 18792 7347 1 10 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.156 -3.997 18792 7348 1 10 . 1 1 20 20 LYS H H 20 8.224 8.224 7.816 0.408 18792 7349 1 10 . 1 1 21 21 LEU N N 21 118.092 118.092 120.473 -2.381 18792 7350 1 10 . 1 1 21 21 LEU C C 21 179.989 179.989 178.719 1.270 18792 7351 1 10 . 1 1 21 21 LEU CA C 21 58.126 58.126 57.770 0.356 18792 7352 1 10 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.851 -2.243 18792 7353 1 10 . 1 1 21 21 LEU H H 21 8.586 8.586 7.950 0.636 18792 7354 1 10 . 1 1 22 22 SER N N 22 117.304 117.304 114.559 2.745 18792 7355 1 10 . 1 1 22 22 SER C C 22 180.152 180.152 176.958 3.194 18792 7356 1 10 . 1 1 22 22 SER CA C 22 61.287 61.287 61.411 -0.124 18792 7357 1 10 . 1 1 22 22 SER H H 22 8.266 8.266 7.684 0.582 18792 7358 1 10 . 1 1 23 23 GLN N N 23 122.497 122.497 121.839 0.658 18792 7359 1 10 . 1 1 23 23 GLN C C 23 177.297 177.297 177.463 -0.166 18792 7360 1 10 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.028 -0.086 18792 7361 1 10 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.443 -0.632 18792 7362 1 10 . 1 1 23 23 GLN H H 23 7.571 7.571 8.209 -0.638 18792 7363 1 10 . 1 1 24 24 LYS N N 24 116.038 116.038 117.277 -1.239 18792 7364 1 10 . 1 1 24 24 LYS C C 24 175.704 175.704 176.625 -0.921 18792 7365 1 10 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.253 -2.758 18792 7366 1 10 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.065 -1.836 18792 7367 1 10 . 1 1 24 24 LYS H H 24 7.134 7.134 7.655 -0.521 18792 7368 1 10 . 1 1 25 25 GLY N N 25 105.283 105.283 104.850 0.433 18792 7369 1 10 . 1 1 25 25 GLY C C 25 174.013 174.013 173.548 0.465 18792 7370 1 10 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.745 0.034 18792 7371 1 10 . 1 1 25 25 GLY H H 25 7.483 7.483 7.764 -0.281 18792 7372 1 10 . 1 1 26 26 TYR N N 26 119.547 119.547 120.007 -0.460 18792 7373 1 10 . 1 1 26 26 TYR C C 26 175.122 175.122 174.054 1.068 18792 7374 1 10 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.378 -1.246 18792 7375 1 10 . 1 1 26 26 TYR CB C 26 40.080 40.080 40.203 -0.123 18792 7376 1 10 . 1 1 26 26 TYR H H 26 7.788 7.788 7.695 0.093 18792 7377 1 10 . 1 1 27 27 SER N N 27 115.088 115.088 118.171 -3.083 18792 7378 1 10 . 1 1 27 27 SER C C 27 174.452 174.452 175.555 -1.103 18792 7379 1 10 . 1 1 27 27 SER CA C 27 56.306 56.306 56.171 0.135 18792 7380 1 10 . 1 1 27 27 SER CB C 27 63.921 63.921 65.432 -1.511 18792 7381 1 10 . 1 1 27 27 SER H H 27 8.473 8.473 8.160 0.313 18792 7382 1 10 . 1 1 28 28 TRP N N 28 127.014 127.014 122.323 4.691 18792 7383 1 10 . 1 1 28 28 TRP C C 28 177.002 177.002 178.452 -1.450 18792 7384 1 10 . 1 1 28 28 TRP CA C 28 59.472 59.472 58.278 1.194 18792 7385 1 10 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.362 1.468 18792 7386 1 10 . 1 1 28 28 TRP H H 28 8.897 8.897 8.853 0.044 18792 7387 1 10 . 1 1 29 29 SER N N 29 112.044 112.044 116.113 -4.069 18792 7388 1 10 . 1 1 29 29 SER C C 29 175.106 175.106 175.457 -0.351 18792 7389 1 10 . 1 1 29 29 SER CA C 29 59.472 59.472 60.496 -1.024 18792 7390 1 10 . 1 1 29 29 SER CB C 29 62.226 62.226 62.622 -0.396 18792 7391 1 10 . 1 1 29 29 SER H H 29 8.129 8.129 7.635 0.494 18792 7392 1 10 . 1 1 30 30 GLN N N 30 119.160 119.160 118.105 1.055 18792 7393 1 10 . 1 1 30 30 GLN C C 30 176.218 176.218 175.821 0.397 18792 7394 1 10 . 1 1 30 30 GLN CA C 30 56.412 56.412 55.890 0.522 18792 7395 1 10 . 1 1 30 30 GLN CB C 30 27.578 27.578 29.095 -1.517 18792 7396 1 10 . 1 1 30 30 GLN H H 30 7.370 7.370 7.761 -0.391 18792 7397 1 10 . 1 1 31 31 PHE N N 31 116.277 116.277 114.035 2.242 18792 7398 1 10 . 1 1 31 31 PHE C C 31 175.217 175.217 175.140 0.077 18792 7399 1 10 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.440 -3.206 18792 7400 1 10 . 1 1 31 31 PHE CB C 31 39.066 39.066 35.967 3.099 18792 7401 1 10 . 1 1 31 31 PHE H H 31 7.248 7.248 7.683 -0.435 18792 7402 1 10 . 1 1 32 32 SER N N 32 113.683 113.683 114.385 -0.702 18792 7403 1 10 . 1 1 32 32 SER C C 32 173.793 173.793 173.005 0.788 18792 7404 1 10 . 1 1 32 32 SER CA C 32 57.124 57.124 58.386 -1.262 18792 7405 1 10 . 1 1 32 32 SER CB C 32 63.081 63.081 64.066 -0.985 18792 7406 1 10 . 1 1 32 32 SER H H 32 7.242 7.242 8.270 -1.028 18792 7407 1 10 . 1 1 33 33 ASP N N 33 122.195 122.195 121.071 1.124 18792 7408 1 10 . 1 1 33 33 ASP C C 33 176.394 176.394 174.984 1.410 18792 7409 1 10 . 1 1 33 33 ASP CA C 33 53.748 53.748 54.734 -0.986 18792 7410 1 10 . 1 1 33 33 ASP CB C 33 40.398 40.398 42.515 -2.117 18792 7411 1 10 . 1 1 33 33 ASP H H 33 8.257 8.257 8.545 -0.288 18792 7412 1 10 . 1 1 34 34 VAL N N 34 118.913 118.913 118.603 0.310 18792 7413 1 10 . 1 1 34 34 VAL C C 34 176.328 176.328 174.362 1.966 18792 7414 1 10 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.839 -0.948 18792 7415 1 10 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.710 -0.695 18792 7416 1 10 . 1 1 34 34 VAL H H 34 7.852 7.852 7.830 0.022 18792 7417 1 10 . 1 1 35 35 GLU N N 35 124.205 124.205 120.308 3.897 18792 7418 1 10 . 1 1 35 35 GLU C C 35 176.586 176.586 175.028 1.558 18792 7419 1 10 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.071 -1.014 18792 7420 1 10 . 1 1 35 35 GLU CB C 35 28.898 28.898 28.777 0.121 18792 7421 1 10 . 1 1 35 35 GLU H H 35 8.401 8.401 8.165 0.236 18792 7422 1 10 . 1 1 36 36 GLU N N 36 121.670 121.670 121.238 0.432 18792 7423 1 10 . 1 1 36 36 GLU C C 36 176.218 176.218 174.935 1.283 18792 7424 1 10 . 1 1 36 36 GLU CA C 36 55.988 55.988 55.961 0.028 18792 7425 1 10 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.751 -1.309 18792 7426 1 10 . 1 1 36 36 GLU H H 36 8.239 8.239 7.949 0.290 18792 7427 1 10 . 1 1 37 37 ASN N N 37 119.252 119.252 124.236 -4.984 18792 7428 1 10 . 1 1 37 37 ASN C C 37 175.003 175.003 174.530 0.473 18792 7429 1 10 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.026 -0.371 18792 7430 1 10 . 1 1 37 37 ASN CB C 37 38.212 38.212 37.929 0.283 18792 7431 1 10 . 1 1 37 37 ASN H H 37 8.412 8.412 8.664 -0.252 18792 7432 1 10 . 1 1 38 38 ARG N N 38 121.622 121.622 120.844 0.778 18792 7433 1 10 . 1 1 38 38 ARG C C 38 176.610 176.610 175.189 1.421 18792 7434 1 10 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.238 -0.874 18792 7435 1 10 . 1 1 38 38 ARG CB C 38 29.419 29.419 32.788 -3.369 18792 7436 1 10 . 1 1 38 38 ARG H H 38 8.227 8.227 7.829 0.398 18792 7437 1 10 . 1 1 39 39 THR N N 39 115.681 115.681 114.464 1.217 18792 7438 1 10 . 1 1 39 39 THR C C 39 174.500 174.500 174.112 0.388 18792 7439 1 10 . 1 1 39 39 THR CA C 39 61.606 61.606 62.856 -1.250 18792 7440 1 10 . 1 1 39 39 THR CB C 39 69.163 69.163 69.270 -0.107 18792 7441 1 10 . 1 1 39 39 THR H H 39 8.173 8.173 8.445 -0.272 18792 7442 1 10 . 1 1 40 40 GLU N N 40 122.708 122.708 118.788 3.920 18792 7443 1 10 . 1 1 40 40 GLU C C 40 175.728 175.728 174.458 1.270 18792 7444 1 10 . 1 1 40 40 GLU CA C 40 55.772 55.772 57.223 -1.451 18792 7445 1 10 . 1 1 40 40 GLU CB C 40 29.054 29.054 30.027 -0.973 18792 7446 1 10 . 1 1 40 40 GLU H H 40 8.298 8.298 8.600 -0.302 18792 7447 1 10 . 1 1 41 41 ALA N N 41 125.922 125.922 122.345 3.577 18792 7448 1 10 . 1 1 41 41 ALA C C 41 175.557 175.557 174.695 0.862 18792 7449 1 10 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.033 -1.060 18792 7450 1 10 . 1 1 41 41 ALA CB C 41 17.245 17.245 20.593 -3.348 18792 7451 1 10 . 1 1 41 41 ALA H H 41 8.212 8.212 7.909 0.303 18792 7452 1 10 . 1 1 43 43 GLU N N 43 120.783 120.783 123.639 -2.856 18792 7453 1 10 . 1 1 43 43 GLU C C 43 177.174 177.174 175.253 1.921 18792 7454 1 10 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.579 -0.238 18792 7455 1 10 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.586 -1.299 18792 7456 1 10 . 1 1 43 43 GLU H H 43 8.519 8.519 8.610 -0.091 18792 7457 1 10 . 1 1 44 44 GLY N N 44 110.022 110.022 110.199 -0.177 18792 7458 1 10 . 1 1 44 44 GLY C C 44 174.773 174.773 174.962 -0.189 18792 7459 1 10 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.161 -0.133 18792 7460 1 10 . 1 1 44 44 GLY H H 44 8.429 8.429 8.043 0.386 18792 7461 1 10 . 1 1 45 45 THR N N 45 112.790 112.790 114.630 -1.840 18792 7462 1 10 . 1 1 45 45 THR C C 45 175.726 175.726 175.258 0.468 18792 7463 1 10 . 1 1 45 45 THR CA C 45 61.987 61.987 64.220 -2.233 18792 7464 1 10 . 1 1 45 45 THR CB C 45 69.304 69.304 69.089 0.215 18792 7465 1 10 . 1 1 45 45 THR H H 45 8.125 8.125 8.449 -0.324 18792 7466 1 10 . 1 1 46 46 GLU N N 46 122.752 122.752 119.592 3.160 18792 7467 1 10 . 1 1 46 46 GLU C C 46 177.419 177.419 176.573 0.846 18792 7468 1 10 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.350 0.881 18792 7469 1 10 . 1 1 46 46 GLU CB C 46 28.199 28.199 30.548 -2.349 18792 7470 1 10 . 1 1 46 46 GLU H H 46 8.765 8.765 7.848 0.917 18792 7471 1 10 . 1 1 47 47 SER N N 47 114.895 114.895 113.442 1.453 18792 7472 1 10 . 1 1 47 47 SER C C 47 175.826 175.826 174.898 0.928 18792 7473 1 10 . 1 1 47 47 SER CA C 47 58.582 58.582 59.102 -0.520 18792 7474 1 10 . 1 1 47 47 SER CB C 47 62.537 62.537 62.800 -0.263 18792 7475 1 10 . 1 1 47 47 SER H H 47 8.355 8.355 8.234 0.121 18792 7476 1 10 . 1 1 48 48 GLU N N 48 122.429 122.429 118.431 3.998 18792 7477 1 10 . 1 1 48 48 GLU C C 48 178.099 178.099 177.804 0.295 18792 7478 1 10 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.722 -0.104 18792 7479 1 10 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.825 -1.350 18792 7480 1 10 . 1 1 48 48 GLU H H 48 8.139 8.139 8.320 -0.181 18792 7481 1 10 . 1 1 49 49 ALA N N 49 120.374 120.374 123.758 -3.384 18792 7482 1 10 . 1 1 49 49 ALA C C 49 180.843 180.843 179.238 1.605 18792 7483 1 10 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.433 -0.950 18792 7484 1 10 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.100 -0.665 18792 7485 1 10 . 1 1 49 49 ALA H H 49 8.079 8.079 8.376 -0.297 18792 7486 1 10 . 1 1 50 50 VAL N N 50 118.599 118.599 118.629 -0.030 18792 7487 1 10 . 1 1 50 50 VAL C C 50 176.921 176.921 178.045 -1.124 18792 7488 1 10 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.735 -0.175 18792 7489 1 10 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.846 -0.549 18792 7490 1 10 . 1 1 50 50 VAL H H 50 7.419 7.419 7.959 -0.540 18792 7491 1 10 . 1 1 51 51 LYS N N 51 117.469 117.469 121.013 -3.544 18792 7492 1 10 . 1 1 51 51 LYS C C 51 179.061 179.061 178.902 0.159 18792 7493 1 10 . 1 1 51 51 LYS CA C 51 59.223 59.223 60.207 -0.984 18792 7494 1 10 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.297 -1.301 18792 7495 1 10 . 1 1 51 51 LYS H H 51 7.359 7.359 7.738 -0.379 18792 7496 1 10 . 1 1 52 52 GLN N N 52 115.930 115.930 118.134 -2.204 18792 7497 1 10 . 1 1 52 52 GLN C C 52 177.713 177.713 178.514 -0.801 18792 7498 1 10 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.791 -0.315 18792 7499 1 10 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.840 -2.272 18792 7500 1 10 . 1 1 52 52 GLN H H 52 8.025 8.025 8.568 -0.543 18792 7501 1 10 . 1 1 53 53 ALA N N 53 119.782 119.782 122.116 -2.334 18792 7502 1 10 . 1 1 53 53 ALA C C 53 180.008 180.008 178.531 1.477 18792 7503 1 10 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.542 -0.157 18792 7504 1 10 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.826 -1.311 18792 7505 1 10 . 1 1 53 53 ALA H H 53 7.655 7.655 8.148 -0.493 18792 7506 1 10 . 1 1 54 54 LEU N N 54 120.443 120.443 117.554 2.889 18792 7507 1 10 . 1 1 54 54 LEU C C 54 179.330 179.330 178.205 1.125 18792 7508 1 10 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.570 1.443 18792 7509 1 10 . 1 1 54 54 LEU CB C 54 40.862 40.862 42.905 -2.043 18792 7510 1 10 . 1 1 54 54 LEU H H 54 8.419 8.419 7.888 0.531 18792 7511 1 10 . 1 1 55 55 ARG N N 55 118.423 118.423 121.289 -2.866 18792 7512 1 10 . 1 1 55 55 ARG C C 55 178.767 178.767 178.586 0.181 18792 7513 1 10 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.894 0.503 18792 7514 1 10 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.982 -1.239 18792 7515 1 10 . 1 1 55 55 ARG H H 55 8.062 8.062 8.595 -0.533 18792 7516 1 10 . 1 1 56 56 GLU N N 56 115.988 115.988 118.310 -2.322 18792 7517 1 10 . 1 1 56 56 GLU C C 56 180.090 180.090 178.496 1.594 18792 7518 1 10 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.919 -1.159 18792 7519 1 10 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.286 -0.932 18792 7520 1 10 . 1 1 56 56 GLU H H 56 7.772 7.772 8.614 -0.842 18792 7521 1 10 . 1 1 57 57 ALA N N 57 122.837 122.837 121.131 1.706 18792 7522 1 10 . 1 1 57 57 ALA C C 57 181.861 181.861 179.379 2.482 18792 7523 1 10 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.616 0.018 18792 7524 1 10 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.368 0.105 18792 7525 1 10 . 1 1 57 57 ALA H H 57 8.774 8.774 7.714 1.060 18792 7526 1 10 . 1 1 58 58 GLY N N 58 108.409 108.409 106.641 1.768 18792 7527 1 10 . 1 1 58 58 GLY C C 58 175.331 175.331 175.832 -0.501 18792 7528 1 10 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.872 -0.204 18792 7529 1 10 . 1 1 58 58 GLY H H 58 9.073 9.073 8.481 0.592 18792 7530 1 10 . 1 1 59 59 ASP N N 59 122.074 122.074 121.885 0.189 18792 7531 1 10 . 1 1 59 59 ASP C C 59 179.023 179.023 178.483 0.540 18792 7532 1 10 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.340 -0.038 18792 7533 1 10 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.024 -2.182 18792 7534 1 10 . 1 1 59 59 ASP H H 59 8.049 8.049 8.232 -0.183 18792 7535 1 10 . 1 1 60 60 GLU N N 60 120.131 120.131 119.617 0.514 18792 7536 1 10 . 1 1 60 60 GLU C C 60 178.522 178.522 178.788 -0.266 18792 7537 1 10 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.335 -0.326 18792 7538 1 10 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.814 -1.615 18792 7539 1 10 . 1 1 60 60 GLU H H 60 8.136 8.136 7.857 0.279 18792 7540 1 10 . 1 1 61 61 PHE N N 61 121.309 121.309 119.747 1.562 18792 7541 1 10 . 1 1 61 61 PHE C C 61 176.904 176.904 177.760 -0.856 18792 7542 1 10 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.672 -0.350 18792 7543 1 10 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.518 -0.909 18792 7544 1 10 . 1 1 61 61 PHE H H 61 8.523 8.523 8.200 0.323 18792 7545 1 10 . 1 1 62 62 GLU N N 62 115.971 115.971 119.140 -3.169 18792 7546 1 10 . 1 1 62 62 GLU C C 62 177.713 177.713 177.712 0.001 18792 7547 1 10 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.682 -0.491 18792 7548 1 10 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.310 -1.033 18792 7549 1 10 . 1 1 62 62 GLU H H 62 7.969 7.969 8.578 -0.609 18792 7550 1 10 . 1 1 63 63 LEU N N 63 116.703 116.703 119.556 -2.853 18792 7551 1 10 . 1 1 63 63 LEU C C 63 178.963 178.963 178.529 0.434 18792 7552 1 10 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.489 -0.077 18792 7553 1 10 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.459 -1.053 18792 7554 1 10 . 1 1 63 63 LEU H H 63 7.347 7.347 7.759 -0.412 18792 7555 1 10 . 1 1 64 64 ARG N N 64 117.453 117.453 118.180 -0.727 18792 7556 1 10 . 1 1 64 64 ARG C C 64 177.297 177.297 176.196 1.101 18792 7557 1 10 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.968 0.369 18792 7558 1 10 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.706 -2.109 18792 7559 1 10 . 1 1 64 64 ARG H H 64 7.995 7.995 7.801 0.194 18792 7560 1 10 . 1 1 65 65 TYR N N 65 118.956 118.956 120.450 -1.494 18792 7561 1 10 . 1 1 65 65 TYR C C 65 175.278 175.278 174.096 1.182 18792 7562 1 10 . 1 1 65 65 TYR CA C 65 55.701 55.701 56.689 -0.988 18792 7563 1 10 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.152 -3.166 18792 7564 1 10 . 1 1 65 65 TYR H H 65 7.909 7.909 7.752 0.157 18792 7565 1 10 . 1 1 66 66 ARG N N 66 119.438 119.438 120.543 -1.105 18792 7566 1 10 . 1 1 66 66 ARG C C 66 178.424 178.424 176.564 1.860 18792 7567 1 10 . 1 1 66 66 ARG CA C 66 58.476 58.476 56.868 1.608 18792 7568 1 10 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.607 -1.786 18792 7569 1 10 . 1 1 66 66 ARG H H 66 7.244 7.244 8.436 -1.192 18792 7570 1 10 . 1 1 67 67 ARG N N 67 118.936 118.936 121.142 -2.206 18792 7571 1 10 . 1 1 67 67 ARG C C 67 177.542 177.542 177.890 -0.348 18792 7572 1 10 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.160 -1.716 18792 7573 1 10 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.836 -1.715 18792 7574 1 10 . 1 1 67 67 ARG H H 67 8.417 8.417 8.352 0.065 18792 7575 1 10 . 1 1 68 68 ALA N N 68 121.797 121.797 122.302 -0.505 18792 7576 1 10 . 1 1 68 68 ALA C C 68 180.337 180.337 179.317 1.020 18792 7577 1 10 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.817 -0.681 18792 7578 1 10 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.913 -0.446 18792 7579 1 10 . 1 1 68 68 ALA H H 68 7.827 7.827 8.804 -0.977 18792 7580 1 10 . 1 1 69 69 PHE N N 69 115.986 115.986 118.272 -2.286 18792 7581 1 10 . 1 1 69 69 PHE C C 69 177.468 177.468 176.682 0.786 18792 7582 1 10 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.254 -1.205 18792 7583 1 10 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.942 -1.343 18792 7584 1 10 . 1 1 69 69 PHE H H 69 8.517 8.517 8.824 -0.307 18792 7585 1 10 . 1 1 70 70 SER N N 70 116.526 116.526 115.243 1.283 18792 7586 1 10 . 1 1 70 70 SER C C 70 177.640 177.640 176.352 1.288 18792 7587 1 10 . 1 1 70 70 SER CA C 70 61.073 61.073 62.319 -1.246 18792 7588 1 10 . 1 1 70 70 SER CB C 70 61.993 61.993 62.566 -0.572 18792 7589 1 10 . 1 1 70 70 SER H H 70 8.152 8.152 8.146 0.006 18792 7590 1 10 . 1 1 71 71 ASP N N 71 121.181 121.181 123.189 -2.008 18792 7591 1 10 . 1 1 71 71 ASP C C 71 178.546 178.546 178.464 0.082 18792 7592 1 10 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.304 -0.856 18792 7593 1 10 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.766 -1.534 18792 7594 1 10 . 1 1 71 71 ASP H H 71 8.356 8.356 7.564 0.792 18792 7595 1 10 . 1 1 72 72 LEU N N 72 120.747 120.747 120.972 -0.225 18792 7596 1 10 . 1 1 72 72 LEU C C 72 178.963 178.963 177.922 1.041 18792 7597 1 10 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.039 -0.595 18792 7598 1 10 . 1 1 72 72 LEU CB C 72 41.017 41.017 41.916 -0.900 18792 7599 1 10 . 1 1 72 72 LEU H H 72 7.738 7.738 8.319 -0.581 18792 7600 1 10 . 1 1 73 73 THR N N 73 109.432 109.432 113.444 -4.012 18792 7601 1 10 . 1 1 73 73 THR C C 73 177.481 177.481 175.874 1.607 18792 7602 1 10 . 1 1 73 73 THR CA C 73 65.128 65.128 65.384 -0.256 18792 7603 1 10 . 1 1 73 73 THR CB C 73 67.720 67.720 68.165 -0.445 18792 7604 1 10 . 1 1 73 73 THR H H 73 8.296 8.296 7.996 0.300 18792 7605 1 10 . 1 1 74 74 SER N N 74 115.862 115.862 114.830 1.032 18792 7606 1 10 . 1 1 74 74 SER C C 74 175.361 175.361 175.995 -0.634 18792 7607 1 10 . 1 1 74 74 SER CA C 74 60.112 60.112 60.089 0.023 18792 7608 1 10 . 1 1 74 74 SER CB C 74 62.537 62.537 63.450 -0.914 18792 7609 1 10 . 1 1 74 74 SER H H 74 7.629 7.629 8.054 -0.425 18792 7610 1 10 . 1 1 75 75 GLN N N 75 118.551 118.551 120.450 -1.899 18792 7611 1 10 . 1 1 75 75 GLN C C 75 176.316 176.316 177.213 -0.897 18792 7612 1 10 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.601 -0.797 18792 7613 1 10 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.359 -1.082 18792 7614 1 10 . 1 1 75 75 GLN H H 75 7.640 7.640 7.522 0.118 18792 7615 1 10 . 1 1 76 76 LEU N N 76 118.313 118.313 119.331 -1.018 18792 7616 1 10 . 1 1 76 76 LEU C C 76 174.160 174.160 176.100 -1.940 18792 7617 1 10 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.211 -0.471 18792 7618 1 10 . 1 1 76 76 LEU CB C 76 42.727 42.727 44.301 -1.574 18792 7619 1 10 . 1 1 76 76 LEU H H 76 7.411 7.411 7.874 -0.463 18792 7620 1 10 . 1 1 77 77 HIS N N 77 120.104 120.104 116.053 4.051 18792 7621 1 10 . 1 1 77 77 HIS C C 77 174.528 174.528 174.541 -0.013 18792 7622 1 10 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.316 -1.109 18792 7623 1 10 . 1 1 77 77 HIS CB C 77 27.966 27.966 29.286 -1.320 18792 7624 1 10 . 1 1 77 77 HIS H H 77 8.117 8.117 7.883 0.234 18792 7625 1 10 . 1 1 78 78 ILE N N 78 122.298 122.298 125.286 -2.988 18792 7626 1 10 . 1 1 78 78 ILE C C 78 174.240 174.240 176.011 -1.771 18792 7627 1 10 . 1 1 78 78 ILE CA C 78 61.402 61.402 62.784 -1.382 18792 7628 1 10 . 1 1 78 78 ILE CB C 78 37.591 37.591 37.858 -0.267 18792 7629 1 10 . 1 1 78 78 ILE H H 78 8.655 8.655 8.606 0.049 18792 7630 1 10 . 1 1 79 79 THR N N 79 116.442 116.442 119.510 -3.068 18792 7631 1 10 . 1 1 79 79 THR C C 79 174.291 174.291 172.924 1.367 18792 7632 1 10 . 1 1 79 79 THR CA C 79 61.632 61.632 58.659 2.973 18792 7633 1 10 . 1 1 79 79 THR CB C 79 68.704 68.704 69.498 -0.794 18792 7634 1 10 . 1 1 79 79 THR H H 79 8.245 8.245 7.889 0.356 18792 7635 1 10 . 1 1 84 84 TYR N N 84 120.888 120.888 118.724 2.164 18792 7636 1 10 . 1 1 84 84 TYR C C 84 176.708 176.708 177.437 -0.729 18792 7637 1 10 . 1 1 84 84 TYR CA C 84 60.432 60.432 60.809 -0.377 18792 7638 1 10 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.490 -0.745 18792 7639 1 10 . 1 1 84 84 TYR H H 84 8.733 8.733 8.258 0.475 18792 7640 1 10 . 1 1 85 85 GLN N N 85 114.530 114.530 119.720 -5.190 18792 7641 1 10 . 1 1 85 85 GLN C C 85 178.473 178.473 178.655 -0.182 18792 7642 1 10 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.381 -0.087 18792 7643 1 10 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.880 -1.079 18792 7644 1 10 . 1 1 85 85 GLN H H 85 8.413 8.413 7.716 0.697 18792 7645 1 10 . 1 1 86 86 SER N N 86 114.032 114.032 116.016 -1.984 18792 7646 1 10 . 1 1 86 86 SER C C 86 178.473 178.473 176.775 1.698 18792 7647 1 10 . 1 1 86 86 SER CA C 86 62.175 62.175 61.484 0.691 18792 7648 1 10 . 1 1 86 86 SER CB C 86 63.252 63.252 63.080 0.172 18792 7649 1 10 . 1 1 86 86 SER H H 86 7.258 7.258 7.503 -0.245 18792 7650 1 10 . 1 1 88 88 GLU N N 88 119.386 119.386 118.260 1.126 18792 7651 1 10 . 1 1 88 88 GLU C C 88 177.199 177.199 179.273 -2.074 18792 7652 1 10 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.385 -0.803 18792 7653 1 10 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.487 -0.511 18792 7654 1 10 . 1 1 88 88 GLU H H 88 8.534 8.534 8.802 -0.268 18792 7655 1 10 . 1 1 89 89 GLN N N 89 114.678 114.678 119.100 -4.422 18792 7656 1 10 . 1 1 89 89 GLN C C 89 178.669 178.669 178.685 -0.016 18792 7657 1 10 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.023 -0.441 18792 7658 1 10 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.940 -1.518 18792 7659 1 10 . 1 1 89 89 GLN H H 89 7.500 7.500 7.700 -0.200 18792 7660 1 10 . 1 1 90 90 VAL N N 90 118.174 118.174 116.537 1.637 18792 7661 1 10 . 1 1 90 90 VAL C C 90 178.081 178.081 177.963 0.118 18792 7662 1 10 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.732 -0.177 18792 7663 1 10 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.621 -0.014 18792 7664 1 10 . 1 1 90 90 VAL H H 90 7.017 7.017 8.345 -1.328 18792 7665 1 10 . 1 1 91 91 VAL N N 91 119.489 119.489 118.349 1.140 18792 7666 1 10 . 1 1 91 91 VAL C C 91 177.914 177.914 177.381 0.533 18792 7667 1 10 . 1 1 91 91 VAL CA C 91 65.769 65.769 65.945 -0.176 18792 7668 1 10 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.426 -0.135 18792 7669 1 10 . 1 1 91 91 VAL H H 91 7.833 7.833 7.520 0.313 18792 7670 1 10 . 1 1 92 92 ASN N N 92 117.180 117.180 118.289 -1.109 18792 7671 1 10 . 1 1 92 92 ASN C C 92 179.110 179.110 177.061 2.049 18792 7672 1 10 . 1 1 92 92 ASN CA C 92 54.918 54.918 55.980 -1.062 18792 7673 1 10 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.653 -2.684 18792 7674 1 10 . 1 1 92 92 ASN H H 92 8.368 8.368 7.936 0.432 18792 7675 1 10 . 1 1 93 93 GLU N N 93 118.476 118.476 119.044 -0.568 18792 7676 1 10 . 1 1 93 93 GLU C C 93 179.355 179.355 179.439 -0.084 18792 7677 1 10 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.021 -0.616 18792 7678 1 10 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.051 -2.318 18792 7679 1 10 . 1 1 93 93 GLU H H 93 7.213 7.213 8.113 -0.900 18792 7680 1 10 . 1 1 94 94 LEU N N 94 120.889 120.889 120.741 0.148 18792 7681 1 10 . 1 1 94 94 LEU C C 94 178.473 178.473 179.529 -1.056 18792 7682 1 10 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.698 -0.681 18792 7683 1 10 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.965 -2.035 18792 7684 1 10 . 1 1 94 94 LEU H H 94 7.446 7.446 8.024 -0.578 18792 7685 1 10 . 1 1 95 95 PHE N N 95 112.902 112.902 118.994 -6.092 18792 7686 1 10 . 1 1 95 95 PHE C C 95 176.586 176.586 177.206 -0.620 18792 7687 1 10 . 1 1 95 95 PHE CA C 95 57.159 57.159 60.283 -3.124 18792 7688 1 10 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.386 -0.166 18792 7689 1 10 . 1 1 95 95 PHE H H 95 6.916 6.916 8.439 -1.523 18792 7690 1 10 . 1 1 96 96 ARG N N 96 123.729 123.729 118.190 5.539 18792 7691 1 10 . 1 1 96 96 ARG C C 96 177.272 177.272 177.406 -0.134 18792 7692 1 10 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.267 0.957 18792 7693 1 10 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.442 -2.010 18792 7694 1 10 . 1 1 96 96 ARG H H 96 7.126 7.126 7.874 -0.748 18792 7695 1 10 . 1 1 97 97 ASP N N 97 116.576 116.576 116.904 -0.328 18792 7696 1 10 . 1 1 97 97 ASP C C 97 175.687 175.687 176.297 -0.610 18792 7697 1 10 . 1 1 97 97 ASP CA C 97 53.673 53.673 55.206 -1.533 18792 7698 1 10 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.255 -3.210 18792 7699 1 10 . 1 1 97 97 ASP H H 97 8.644 8.644 8.009 0.635 18792 7700 1 10 . 1 1 98 98 GLY N N 98 108.551 108.551 106.961 1.590 18792 7701 1 10 . 1 1 98 98 GLY C C 98 172.690 172.690 172.241 0.449 18792 7702 1 10 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.692 -2.442 18792 7703 1 10 . 1 1 98 98 GLY H H 98 7.463 7.463 7.561 -0.098 18792 7704 1 10 . 1 1 99 99 VAL N N 99 120.630 120.630 115.993 4.637 18792 7705 1 10 . 1 1 99 99 VAL C C 99 174.503 174.503 173.489 1.014 18792 7706 1 10 . 1 1 99 99 VAL CA C 99 62.318 62.318 62.962 -0.644 18792 7707 1 10 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.800 -2.037 18792 7708 1 10 . 1 1 99 99 VAL H H 99 8.184 8.184 7.257 0.927 18792 7709 1 10 . 1 1 100 100 ASN N N 100 115.485 115.485 114.842 0.643 18792 7710 1 10 . 1 1 100 100 ASN C C 100 175.239 175.239 176.415 -1.176 18792 7711 1 10 . 1 1 100 100 ASN CA C 100 51.361 51.361 53.829 -2.468 18792 7712 1 10 . 1 1 100 100 ASN CB C 100 38.920 38.920 37.439 1.481 18792 7713 1 10 . 1 1 100 100 ASN H H 100 6.241 6.241 6.808 -0.567 18792 7714 1 10 . 1 1 101 101 TRP N N 101 118.266 118.266 120.666 -2.400 18792 7715 1 10 . 1 1 101 101 TRP C C 101 178.301 178.301 176.601 1.700 18792 7716 1 10 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.632 0.907 18792 7717 1 10 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.443 1.387 18792 7718 1 10 . 1 1 101 101 TRP H H 101 8.409 8.409 7.857 0.552 18792 7719 1 10 . 1 1 102 102 GLY N N 102 106.147 106.147 106.704 -0.557 18792 7720 1 10 . 1 1 102 102 GLY C C 102 177.640 177.640 175.649 1.991 18792 7721 1 10 . 1 1 102 102 GLY CA C 102 46.914 46.914 45.161 1.753 18792 7722 1 10 . 1 1 102 102 GLY H H 102 8.504 8.504 7.752 0.752 18792 7723 1 10 . 1 1 103 103 ARG N N 103 121.347 121.347 122.244 -0.897 18792 7724 1 10 . 1 1 103 103 ARG C C 103 177.738 177.738 178.013 -0.275 18792 7725 1 10 . 1 1 103 103 ARG CA C 103 57.942 57.942 57.533 0.409 18792 7726 1 10 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.682 0.537 18792 7727 1 10 . 1 1 103 103 ARG H H 103 8.099 8.099 8.387 -0.288 18792 7728 1 10 . 1 1 104 104 ILE N N 104 120.930 120.930 120.734 0.196 18792 7729 1 10 . 1 1 104 104 ILE C C 104 178.197 178.197 177.302 0.895 18792 7730 1 10 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.339 2.196 18792 7731 1 10 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.691 -1.646 18792 7732 1 10 . 1 1 104 104 ILE H H 104 7.690 7.690 7.632 0.058 18792 7733 1 10 . 1 1 105 105 VAL N N 105 120.938 120.938 119.309 1.629 18792 7734 1 10 . 1 1 105 105 VAL C C 105 177.854 177.854 177.812 0.042 18792 7735 1 10 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.098 1.360 18792 7736 1 10 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.289 0.085 18792 7737 1 10 . 1 1 105 105 VAL H H 105 8.245 8.245 7.403 0.842 18792 7738 1 10 . 1 1 106 106 ALA N N 106 121.165 121.165 123.259 -2.094 18792 7739 1 10 . 1 1 106 106 ALA C C 106 178.284 178.284 178.891 -0.607 18792 7740 1 10 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.413 0.185 18792 7741 1 10 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.224 -0.709 18792 7742 1 10 . 1 1 106 106 ALA H H 106 7.529 7.529 7.809 -0.281 18792 7743 1 10 . 1 1 107 107 PHE N N 107 119.242 119.242 119.995 -0.753 18792 7744 1 10 . 1 1 107 107 PHE C C 107 176.390 176.390 176.911 -0.521 18792 7745 1 10 . 1 1 107 107 PHE CA C 107 60.173 60.173 59.323 0.850 18792 7746 1 10 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.915 -1.828 18792 7747 1 10 . 1 1 107 107 PHE H H 107 7.974 7.974 8.422 -0.448 18792 7748 1 10 . 1 1 108 108 PHE N N 108 120.009 120.009 117.621 2.388 18792 7749 1 10 . 1 1 108 108 PHE C C 108 177.640 177.640 177.617 0.023 18792 7750 1 10 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.459 0.965 18792 7751 1 10 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.214 -2.868 18792 7752 1 10 . 1 1 108 108 PHE H H 108 7.946 7.946 8.505 -0.559 18792 7753 1 10 . 1 1 109 109 SER N N 109 114.631 114.631 115.712 -1.081 18792 7754 1 10 . 1 1 109 109 SER C C 109 177.770 177.770 176.246 1.524 18792 7755 1 10 . 1 1 109 109 SER CA C 109 63.349 63.349 61.703 1.647 18792 7756 1 10 . 1 1 109 109 SER H H 109 8.424 8.424 7.588 0.836 18792 7757 1 10 . 1 1 110 110 PHE N N 110 124.230 124.230 121.062 3.168 18792 7758 1 10 . 1 1 110 110 PHE C C 110 176.708 176.708 178.035 -1.327 18792 7759 1 10 . 1 1 110 110 PHE CA C 110 59.614 59.614 58.412 1.202 18792 7760 1 10 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.087 -0.643 18792 7761 1 10 . 1 1 110 110 PHE H H 110 9.052 9.052 7.437 1.615 18792 7762 1 10 . 1 1 111 111 GLY N N 111 105.893 105.893 107.125 -1.232 18792 7763 1 10 . 1 1 111 111 GLY C C 111 176.795 176.795 176.057 0.738 18792 7764 1 10 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.745 0.631 18792 7765 1 10 . 1 1 111 111 GLY H H 111 7.926 7.926 8.722 -0.796 18792 7766 1 10 . 1 1 112 112 GLY N N 112 107.410 107.410 109.069 -1.659 18792 7767 1 10 . 1 1 112 112 GLY C C 112 174.650 174.650 175.421 -0.771 18792 7768 1 10 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.224 1.081 18792 7769 1 10 . 1 1 112 112 GLY H H 112 8.799 8.799 8.082 0.717 18792 7770 1 10 . 1 1 113 113 ALA N N 113 124.313 124.313 124.984 -0.671 18792 7771 1 10 . 1 1 113 113 ALA C C 113 181.300 181.300 179.516 1.784 18792 7772 1 10 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.494 0.033 18792 7773 1 10 . 1 1 113 113 ALA CB C 113 17.483 17.483 17.377 0.106 18792 7774 1 10 . 1 1 113 113 ALA H H 113 8.212 8.212 7.558 0.654 18792 7775 1 10 . 1 1 114 114 LEU N N 114 118.878 118.878 119.286 -0.408 18792 7776 1 10 . 1 1 114 114 LEU C C 114 180.286 180.286 179.131 1.155 18792 7777 1 10 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.483 -0.502 18792 7778 1 10 . 1 1 114 114 LEU CB C 114 41.017 41.017 42.142 -1.125 18792 7779 1 10 . 1 1 114 114 LEU H H 114 8.161 8.161 7.917 0.244 18792 7780 1 10 . 1 1 115 115 CYS N N 115 119.002 119.002 118.835 0.167 18792 7781 1 10 . 1 1 115 115 CYS C C 115 176.087 176.087 176.735 -0.648 18792 7782 1 10 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.467 0.477 18792 7783 1 10 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.430 -1.795 18792 7784 1 10 . 1 1 115 115 CYS H H 115 8.070 8.070 7.976 0.094 18792 7785 1 10 . 1 1 116 116 VAL N N 116 118.737 118.737 119.581 -0.844 18792 7786 1 10 . 1 1 116 116 VAL C C 116 177.494 177.494 178.277 -0.783 18792 7787 1 10 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.529 0.232 18792 7788 1 10 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.093 -0.331 18792 7789 1 10 . 1 1 116 116 VAL H H 116 7.995 7.995 7.615 0.380 18792 7790 1 10 . 1 1 117 117 GLU N N 117 118.886 118.886 120.502 -1.616 18792 7791 1 10 . 1 1 117 117 GLU C C 117 178.424 178.424 179.069 -0.645 18792 7792 1 10 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.756 -0.996 18792 7793 1 10 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.538 -1.484 18792 7794 1 10 . 1 1 117 117 GLU H H 117 8.059 8.059 7.965 0.094 18792 7795 1 10 . 1 1 118 118 SER N N 118 113.417 113.417 116.018 -2.601 18792 7796 1 10 . 1 1 118 118 SER C C 118 175.607 175.607 176.606 -0.999 18792 7797 1 10 . 1 1 118 118 SER CA C 118 62.638 62.638 62.212 0.426 18792 7798 1 10 . 1 1 118 118 SER CB C 118 61.061 61.061 62.915 -1.854 18792 7799 1 10 . 1 1 118 118 SER H H 118 7.626 7.626 7.948 -0.322 18792 7800 1 10 . 1 1 119 119 VAL N N 119 120.612 120.612 121.950 -1.338 18792 7801 1 10 . 1 1 119 119 VAL C C 119 179.713 179.713 178.281 1.432 18792 7802 1 10 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.837 0.388 18792 7803 1 10 . 1 1 119 119 VAL CB C 119 30.079 30.079 30.864 -0.785 18792 7804 1 10 . 1 1 119 119 VAL H H 119 7.297 7.297 7.654 -0.357 18792 7805 1 10 . 1 1 120 120 ASP N N 120 122.546 122.546 120.601 1.945 18792 7806 1 10 . 1 1 120 120 ASP C C 120 178.057 178.057 177.607 0.450 18792 7807 1 10 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.555 0.434 18792 7808 1 10 . 1 1 120 120 ASP CB C 120 39.923 39.923 41.078 -1.155 18792 7809 1 10 . 1 1 120 120 ASP H H 120 8.264 8.264 7.972 0.292 18792 7810 1 10 . 1 1 121 121 LYS N N 121 115.636 115.636 118.117 -2.481 18792 7811 1 10 . 1 1 121 121 LYS C C 121 175.159 175.159 175.668 -0.509 18792 7812 1 10 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.547 -1.288 18792 7813 1 10 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.935 -2.160 18792 7814 1 10 . 1 1 121 121 LYS H H 121 7.558 7.558 7.440 0.118 18792 7815 1 10 . 1 1 122 122 GLU N N 122 113.915 113.915 113.708 0.207 18792 7816 1 10 . 1 1 122 122 GLU C C 122 176.109 176.109 176.483 -0.374 18792 7817 1 10 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.102 -0.795 18792 7818 1 10 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.253 -1.921 18792 7819 1 10 . 1 1 122 122 GLU H H 122 7.826 7.826 7.842 -0.016 18792 7820 1 10 . 1 1 124 124 GLN N N 124 119.233 119.233 120.483 -1.250 18792 7821 1 10 . 1 1 124 124 GLN C C 124 177.640 177.640 177.053 0.587 18792 7822 1 10 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.647 0.825 18792 7823 1 10 . 1 1 124 124 GLN CB C 124 26.490 26.490 27.517 -1.028 18792 7824 1 10 . 1 1 124 124 GLN H H 124 8.626 8.626 8.483 0.143 18792 7825 1 10 . 1 1 125 125 VAL N N 125 117.011 117.011 116.232 0.779 18792 7826 1 10 . 1 1 125 125 VAL C C 125 175.826 175.826 176.923 -1.097 18792 7827 1 10 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.641 -1.505 18792 7828 1 10 . 1 1 125 125 VAL CB C 125 30.297 30.297 30.534 -0.237 18792 7829 1 10 . 1 1 125 125 VAL H H 125 7.870 7.870 7.766 0.104 18792 7830 1 10 . 1 1 126 126 LEU N N 126 117.058 117.058 117.101 -0.043 18792 7831 1 10 . 1 1 126 126 LEU C C 126 178.096 178.096 178.686 -0.590 18792 7832 1 10 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.026 -1.940 18792 7833 1 10 . 1 1 126 126 LEU CB C 126 40.273 40.273 40.899 -0.626 18792 7834 1 10 . 1 1 126 126 LEU H H 126 7.747 7.747 7.602 0.145 18792 7835 1 10 . 1 1 127 127 VAL N N 127 119.457 119.457 121.355 -1.898 18792 7836 1 10 . 1 1 127 127 VAL C C 127 177.150 177.150 178.120 -0.970 18792 7837 1 10 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.499 0.657 18792 7838 1 10 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.176 -0.423 18792 7839 1 10 . 1 1 127 127 VAL H H 127 7.306 7.306 8.299 -0.993 18792 7840 1 10 . 1 1 128 128 SER N N 128 110.647 110.647 114.488 -3.841 18792 7841 1 10 . 1 1 128 128 SER C C 128 177.222 177.222 176.766 0.456 18792 7842 1 10 . 1 1 128 128 SER CA C 128 60.752 60.752 61.603 -0.851 18792 7843 1 10 . 1 1 128 128 SER CB C 128 61.605 61.605 62.861 -1.256 18792 7844 1 10 . 1 1 128 128 SER H H 128 8.237 8.237 8.030 0.207 18792 7845 1 10 . 1 1 129 129 ARG N N 129 123.100 123.100 121.208 1.892 18792 7846 1 10 . 1 1 129 129 ARG C C 129 175.802 175.802 178.634 -2.832 18792 7847 1 10 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.214 0.013 18792 7848 1 10 . 1 1 129 129 ARG CB C 129 28.199 28.199 29.636 -1.437 18792 7849 1 10 . 1 1 129 129 ARG H H 129 6.564 6.564 8.069 -1.505 18792 7850 1 10 . 1 1 130 130 ILE N N 130 118.182 118.182 117.061 1.121 18792 7851 1 10 . 1 1 130 130 ILE C C 130 178.156 178.156 177.686 0.470 18792 7852 1 10 . 1 1 130 130 ILE CA C 130 64.346 64.346 64.716 -0.370 18792 7853 1 10 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.380 -0.698 18792 7854 1 10 . 1 1 130 130 ILE H H 130 7.955 7.955 8.047 -0.092 18792 7855 1 10 . 1 1 131 131 ALA N N 131 119.029 119.029 122.207 -3.178 18792 7856 1 10 . 1 1 131 131 ALA C C 131 179.593 179.593 179.263 0.330 18792 7857 1 10 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.033 -0.435 18792 7858 1 10 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.194 -0.806 18792 7859 1 10 . 1 1 131 131 ALA H H 131 7.582 7.582 8.700 -1.118 18792 7860 1 10 . 1 1 132 132 ALA N N 132 120.336 120.336 122.405 -2.069 18792 7861 1 10 . 1 1 132 132 ALA C C 132 181.095 181.095 179.671 1.424 18792 7862 1 10 . 1 1 132 132 ALA CA C 132 54.598 54.598 55.245 -0.647 18792 7863 1 10 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.623 -1.922 18792 7864 1 10 . 1 1 132 132 ALA H H 132 7.224 7.224 8.085 -0.861 18792 7865 1 10 . 1 1 133 133 TRP N N 133 121.194 121.194 118.821 2.373 18792 7866 1 10 . 1 1 133 133 TRP C C 133 179.698 179.698 178.294 1.404 18792 7867 1 10 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.308 -3.006 18792 7868 1 10 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.236 -1.581 18792 7869 1 10 . 1 1 133 133 TRP H H 133 8.925 8.925 8.368 0.557 18792 7870 1 10 . 1 1 134 134 MET N N 134 116.987 116.987 119.543 -2.556 18792 7871 1 10 . 1 1 134 134 MET C C 134 178.277 178.277 178.078 0.199 18792 7872 1 10 . 1 1 134 134 MET CA C 134 59.578 59.578 59.418 0.160 18792 7873 1 10 . 1 1 134 134 MET CB C 134 33.559 33.559 32.861 0.698 18792 7874 1 10 . 1 1 134 134 MET H H 134 8.863 8.863 8.220 0.643 18792 7875 1 10 . 1 1 135 135 ALA N N 135 120.523 120.523 120.925 -0.402 18792 7876 1 10 . 1 1 135 135 ALA C C 135 179.298 179.298 179.402 -0.104 18792 7877 1 10 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.124 0.308 18792 7878 1 10 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.393 -1.756 18792 7879 1 10 . 1 1 135 135 ALA H H 135 8.152 8.152 8.566 -0.414 18792 7880 1 10 . 1 1 136 136 THR N N 136 116.715 116.715 117.462 -0.747 18792 7881 1 10 . 1 1 136 136 THR C C 136 175.106 175.106 176.411 -1.305 18792 7882 1 10 . 1 1 136 136 THR CA C 136 66.729 66.729 67.549 -0.820 18792 7883 1 10 . 1 1 136 136 THR CB C 136 68.441 68.441 68.985 -0.544 18792 7884 1 10 . 1 1 136 136 THR H H 136 8.532 8.532 8.225 0.307 18792 7885 1 10 . 1 1 137 137 TYR N N 137 123.204 123.204 120.781 2.423 18792 7886 1 10 . 1 1 137 137 TYR C C 137 179.592 179.592 177.850 1.742 18792 7887 1 10 . 1 1 137 137 TYR CA C 137 63.065 63.065 60.346 2.719 18792 7888 1 10 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.604 0.384 18792 7889 1 10 . 1 1 137 137 TYR H H 137 8.809 8.809 8.127 0.682 18792 7890 1 10 . 1 1 138 138 LEU N N 138 119.247 119.247 120.658 -1.411 18792 7891 1 10 . 1 1 138 138 LEU C C 138 178.385 178.385 178.401 -0.016 18792 7892 1 10 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.295 0.643 18792 7893 1 10 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.479 0.229 18792 7894 1 10 . 1 1 138 138 LEU H H 138 8.742 8.742 7.876 0.866 18792 7895 1 10 . 1 1 139 139 ASN N N 139 117.122 117.122 116.051 1.071 18792 7896 1 10 . 1 1 139 139 ASN C C 139 176.417 176.417 177.774 -1.357 18792 7897 1 10 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.184 1.264 18792 7898 1 10 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.290 0.362 18792 7899 1 10 . 1 1 139 139 ASN H H 139 8.307 8.307 7.922 0.385 18792 7900 1 10 . 1 1 140 140 ASP N N 140 115.394 115.394 119.964 -4.570 18792 7901 1 10 . 1 1 140 140 ASP C C 140 177.919 177.919 177.263 0.656 18792 7902 1 10 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.853 -0.900 18792 7903 1 10 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.939 -1.553 18792 7904 1 10 . 1 1 140 140 ASP H H 140 8.439 8.439 8.475 -0.036 18792 7905 1 10 . 1 1 141 141 HIS N N 141 111.695 111.695 110.744 0.951 18792 7906 1 10 . 1 1 141 141 HIS C C 141 175.949 175.949 175.366 0.583 18792 7907 1 10 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.049 0.008 18792 7908 1 10 . 1 1 141 141 HIS CB C 141 29.908 29.908 31.160 -1.252 18792 7909 1 10 . 1 1 141 141 HIS H H 141 8.043 8.043 7.218 0.825 18792 7910 1 10 . 1 1 142 142 LEU N N 142 117.054 117.054 122.971 -5.917 18792 7911 1 10 . 1 1 142 142 LEU C C 142 176.530 176.530 177.680 -1.150 18792 7912 1 10 . 1 1 142 142 LEU CA C 142 55.309 55.309 56.861 -1.552 18792 7913 1 10 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.681 0.657 18792 7914 1 10 . 1 1 142 142 LEU H H 142 7.198 7.198 7.576 -0.378 18792 7915 1 10 . 1 1 143 143 GLU N N 143 121.335 121.335 120.391 0.944 18792 7916 1 10 . 1 1 143 143 GLU C C 143 173.964 173.964 175.410 -1.446 18792 7917 1 10 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.808 -0.554 18792 7918 1 10 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.294 -2.037 18792 7919 1 10 . 1 1 143 143 GLU H H 143 8.565 8.565 8.057 0.508 18792 7920 1 10 . 1 1 145 145 TRP N N 145 117.973 117.973 120.009 -2.036 18792 7921 1 10 . 1 1 145 145 TRP C C 145 179.526 179.526 177.904 1.622 18792 7922 1 10 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.701 0.905 18792 7923 1 10 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.537 -1.649 18792 7924 1 10 . 1 1 145 145 TRP H H 145 7.078 7.078 7.921 -0.843 18792 7925 1 10 . 1 1 146 146 ILE N N 146 122.101 122.101 111.086 11.015 18792 7926 1 10 . 1 1 146 146 ILE C C 146 179.110 179.110 177.576 1.534 18792 7927 1 10 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.314 4.020 18792 7928 1 10 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.777 -0.955 18792 7929 1 10 . 1 1 146 146 ILE H H 146 8.389 8.389 7.547 0.842 18792 7930 1 10 . 1 1 147 147 GLN N N 147 116.344 116.344 121.230 -4.886 18792 7931 1 10 . 1 1 147 147 GLN C C 147 179.526 179.526 177.724 1.802 18792 7932 1 10 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.913 -0.899 18792 7933 1 10 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.796 -1.073 18792 7934 1 10 . 1 1 147 147 GLN H H 147 8.376 8.376 8.148 0.228 18792 7935 1 10 . 1 1 148 148 GLU N N 148 118.913 118.913 120.065 -1.152 18792 7936 1 10 . 1 1 148 148 GLU C C 148 176.880 176.880 177.386 -0.506 18792 7937 1 10 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.381 -3.008 18792 7938 1 10 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.535 -1.103 18792 7939 1 10 . 1 1 148 148 GLU H H 148 7.504 7.504 8.097 -0.593 18792 7940 1 10 . 1 1 149 149 ASN N N 149 116.616 116.616 112.383 4.233 18792 7941 1 10 . 1 1 149 149 ASN C C 149 173.964 173.964 176.987 -3.023 18792 7942 1 10 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.604 -0.358 18792 7943 1 10 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.162 -2.029 18792 7944 1 10 . 1 1 149 149 ASN H H 149 7.070 7.070 8.125 -1.055 18792 7945 1 10 . 1 1 150 150 GLY N N 150 104.750 104.750 108.381 -3.631 18792 7946 1 10 . 1 1 150 150 GLY C C 150 176.022 176.022 174.005 2.017 18792 7947 1 10 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.543 -0.301 18792 7948 1 10 . 1 1 150 150 GLY H H 150 7.313 7.313 8.141 -0.828 18792 7949 1 10 . 1 1 151 151 GLY N N 151 108.385 108.385 107.355 1.030 18792 7950 1 10 . 1 1 151 151 GLY C C 151 173.449 173.449 175.621 -2.172 18792 7951 1 10 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.469 -1.437 18792 7952 1 10 . 1 1 151 151 GLY H H 151 8.452 8.452 7.439 1.013 18792 7953 1 10 . 1 1 152 152 TRP N N 152 118.092 118.092 122.145 -4.053 18792 7954 1 10 . 1 1 152 152 TRP C C 152 178.571 178.571 178.012 0.559 18792 7955 1 10 . 1 1 152 152 TRP CA C 152 60.077 60.077 60.030 0.047 18792 7956 1 10 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.424 -0.837 18792 7957 1 10 . 1 1 152 152 TRP H H 152 8.644 8.644 9.144 -0.500 18792 7958 1 10 . 1 1 153 153 ASP N N 153 117.758 117.758 118.266 -0.508 18792 7959 1 10 . 1 1 153 153 ASP C C 153 179.796 179.796 178.632 1.164 18792 7960 1 10 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.452 -0.150 18792 7961 1 10 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.195 -1.964 18792 7962 1 10 . 1 1 153 153 ASP H H 153 8.827 8.827 8.205 0.622 18792 7963 1 10 . 1 1 154 154 THR N N 154 116.817 116.817 117.546 -0.729 18792 7964 1 10 . 1 1 154 154 THR C C 154 175.352 175.352 176.397 -1.045 18792 7965 1 10 . 1 1 154 154 THR CA C 154 65.910 65.910 66.565 -0.655 18792 7966 1 10 . 1 1 154 154 THR CB C 154 67.712 67.712 69.123 -1.411 18792 7967 1 10 . 1 1 154 154 THR H H 154 7.494 7.494 7.689 -0.195 18792 7968 1 10 . 1 1 155 155 PHE N N 155 122.196 122.196 121.499 0.697 18792 7969 1 10 . 1 1 155 155 PHE C C 155 176.831 176.831 177.698 -0.867 18792 7970 1 10 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.904 0.382 18792 7971 1 10 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.449 -1.782 18792 7972 1 10 . 1 1 155 155 PHE H H 155 6.477 6.477 8.904 -2.427 18792 7973 1 10 . 1 1 156 156 VAL N N 156 117.387 117.387 118.276 -0.889 18792 7974 1 10 . 1 1 156 156 VAL C C 156 178.497 178.497 177.567 0.930 18792 7975 1 10 . 1 1 156 156 VAL CA C 156 66.231 66.231 65.849 0.382 18792 7976 1 10 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.024 -0.339 18792 7977 1 10 . 1 1 156 156 VAL H H 156 7.788 7.788 8.093 -0.305 18792 7978 1 10 . 1 1 157 157 GLU N N 157 119.876 119.876 120.161 -0.285 18792 7979 1 10 . 1 1 157 157 GLU C C 157 178.399 178.399 178.093 0.306 18792 7980 1 10 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.848 -0.088 18792 7981 1 10 . 1 1 157 157 GLU CB C 157 28.277 28.277 30.368 -2.091 18792 7982 1 10 . 1 1 157 157 GLU H H 157 7.409 7.409 7.962 -0.553 18792 7983 1 10 . 1 1 158 158 LEU N N 158 117.194 117.194 118.371 -1.177 18792 7984 1 10 . 1 1 158 158 LEU C C 158 178.595 178.595 176.569 2.026 18792 7985 1 10 . 1 1 158 158 LEU CA C 158 56.377 56.377 54.938 1.439 18792 7986 1 10 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.563 0.008 18792 7987 1 10 . 1 1 158 158 LEU H H 158 7.584 7.584 7.976 -0.392 18792 7988 1 10 . 1 1 159 159 TYR N N 159 115.549 115.549 117.681 -2.132 18792 7989 1 10 . 1 1 159 159 TYR C C 159 177.032 177.032 175.553 1.479 18792 7990 1 10 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.448 -0.332 18792 7991 1 10 . 1 1 159 159 TYR CB C 159 37.599 37.599 36.092 1.507 18792 7992 1 10 . 1 1 159 159 TYR H H 159 8.099 8.099 7.510 0.589 18792 7993 1 10 . 1 1 160 160 GLY N N 160 108.334 108.334 105.799 2.535 18792 7994 1 10 . 1 1 160 160 GLY C C 160 173.973 173.973 172.940 1.033 18792 7995 1 10 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.952 0.112 18792 7996 1 10 . 1 1 160 160 GLY H H 160 8.020 8.020 8.035 -0.015 18792 7997 1 10 . 1 1 161 161 ASN N N 161 118.189 118.189 116.915 1.274 18792 7998 1 10 . 1 1 161 161 ASN C C 161 175.513 175.513 173.377 2.136 18792 7999 1 10 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.693 -1.589 18792 8000 1 10 . 1 1 161 161 ASN CB C 161 38.203 38.203 37.420 0.783 18792 8001 1 10 . 1 1 161 161 ASN H H 161 8.327 8.327 8.452 -0.125 18792 8002 1 10 . 1 1 162 162 ASN N N 162 119.022 119.022 115.173 3.849 18792 8003 1 10 . 1 1 162 162 ASN C C 162 175.690 175.690 173.470 2.220 18792 8004 1 10 . 1 1 162 162 ASN CA C 162 53.424 53.424 52.794 0.630 18792 8005 1 10 . 1 1 162 162 ASN CB C 162 38.203 38.203 39.494 -1.291 18792 8006 1 10 . 1 1 162 162 ASN H H 162 8.363 8.363 7.658 0.705 18792 8007 1 10 . 1 1 163 163 ALA N N 163 123.275 123.275 123.888 -0.613 18792 8008 1 10 . 1 1 163 163 ALA C C 163 178.598 178.598 177.862 0.736 18792 8009 1 10 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.475 0.763 18792 8010 1 10 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.546 -1.935 18792 8011 1 10 . 1 1 163 163 ALA H H 163 8.103 8.103 8.331 -0.228 18792 8012 1 10 . 1 1 164 164 ALA N N 164 121.521 121.521 122.104 -0.583 18792 8013 1 10 . 1 1 164 164 ALA C C 164 178.642 178.642 180.048 -1.406 18792 8014 1 10 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.541 -1.957 18792 8015 1 10 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.517 -0.698 18792 8016 1 10 . 1 1 164 164 ALA H H 164 8.053 8.053 8.278 -0.225 18792 8017 1 10 . 1 1 165 165 ALA N N 165 122.101 122.101 120.725 1.376 18792 8018 1 10 . 1 1 165 165 ALA C C 165 179.124 179.124 178.807 0.317 18792 8019 1 10 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.170 -1.031 18792 8020 1 10 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.150 -0.172 18792 8021 1 10 . 1 1 165 165 ALA H H 165 7.949 7.949 7.904 0.045 18792 8022 1 10 . 1 1 166 166 GLU N N 166 118.381 118.381 117.954 0.427 18792 8023 1 10 . 1 1 166 166 GLU C C 166 177.664 177.664 177.105 0.559 18792 8024 1 10 . 1 1 166 166 GLU CA C 166 57.088 57.088 55.906 1.182 18792 8025 1 10 . 1 1 166 166 GLU CB C 166 28.354 28.354 28.368 -0.014 18792 8026 1 10 . 1 1 166 166 GLU H H 166 8.202 8.202 8.240 -0.038 18792 8027 1 10 . 1 1 167 167 SER N N 167 115.193 115.193 115.762 -0.569 18792 8028 1 10 . 1 1 167 167 SER C C 167 175.312 175.312 175.594 -0.282 18792 8029 1 10 . 1 1 167 167 SER CA C 167 58.831 58.831 61.518 -2.687 18792 8030 1 10 . 1 1 167 167 SER CB C 167 62.537 62.537 62.924 -0.387 18792 8031 1 10 . 1 1 167 167 SER H H 167 8.029 8.029 7.907 0.122 18792 8032 1 10 . 1 1 168 168 ARG N N 168 121.696 121.696 120.466 1.230 18792 8033 1 10 . 1 1 168 168 ARG C C 168 176.880 176.880 176.126 0.754 18792 8034 1 10 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.703 -0.540 18792 8035 1 10 . 1 1 168 168 ARG CB C 168 29.209 29.209 30.547 -1.338 18792 8036 1 10 . 1 1 168 168 ARG H H 168 7.967 7.967 7.867 0.100 18792 8037 1 10 . 1 1 169 169 LYS N N 169 120.917 120.917 118.603 2.314 18792 8038 1 10 . 1 1 169 169 LYS C C 169 177.640 177.640 175.604 2.036 18792 8039 1 10 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.703 -0.006 18792 8040 1 10 . 1 1 169 169 LYS CB C 169 31.462 31.462 31.538 -0.076 18792 8041 1 10 . 1 1 169 169 LYS H H 169 8.011 8.011 7.943 0.068 18792 8042 1 10 . 1 1 170 170 GLY N N 170 109.155 109.155 112.763 -3.608 18792 8043 1 10 . 1 1 170 170 GLY C C 170 174.479 174.479 173.005 1.474 18792 8044 1 10 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.836 0.229 18792 8045 1 10 . 1 1 170 170 GLY H H 170 8.329 8.329 8.455 -0.126 18792 8046 1 10 . 1 1 171 171 GLN N N 171 119.292 119.292 121.338 -2.046 18792 8047 1 10 . 1 1 171 171 GLN C C 171 176.463 176.463 175.859 0.604 18792 8048 1 10 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.229 0.437 18792 8049 1 10 . 1 1 171 171 GLN CB C 171 28.199 28.199 31.525 -3.326 18792 8050 1 10 . 1 1 171 171 GLN H H 171 8.035 8.035 8.554 -0.519 18792 8051 1 10 . 1 1 172 172 GLU N N 172 121.703 121.703 119.542 2.161 18792 8052 1 10 . 1 1 172 172 GLU C C 172 176.414 176.414 174.769 1.645 18792 8053 1 10 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.839 0.502 18792 8054 1 10 . 1 1 172 172 GLU CB C 172 28.821 28.821 30.615 -1.794 18792 8055 1 10 . 1 1 172 172 GLU H H 172 8.405 8.405 8.691 -0.286 18792 8056 1 10 . 1 1 173 173 ARG N N 173 121.852 121.852 119.995 1.857 18792 8057 1 10 . 1 1 173 173 ARG C C 173 176.365 176.365 175.361 1.004 18792 8058 1 10 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.685 0.514 18792 8059 1 10 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.518 -2.387 18792 8060 1 10 . 1 1 173 173 ARG H H 173 8.335 8.335 8.361 -0.026 18792 8061 1 10 . 1 1 174 174 LEU N N 174 122.640 122.640 120.647 1.993 18792 8062 1 10 . 1 1 174 174 LEU C C 174 176.523 176.523 175.868 0.655 18792 8063 1 10 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.617 -0.849 18792 8064 1 10 . 1 1 174 174 LEU CB C 174 40.784 40.784 41.857 -1.073 18792 8065 1 10 . 1 1 174 174 LEU H H 174 8.082 8.082 8.402 -0.320 18792 8066 1 10 . 1 1 175 175 GLU N N 175 125.909 125.909 119.940 5.969 18792 8067 1 10 . 1 1 175 175 GLU C C 175 181.029 181.029 174.721 6.308 18792 8068 1 10 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.711 1.687 18792 8069 1 10 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.474 -1.424 18792 8070 1 10 . 1 1 175 175 GLU H H 175 7.785 7.785 8.497 -0.712 18792 8071 1 11 . 1 1 4 4 ALA N N 4 124.786 124.786 124.353 0.433 18792 8072 1 11 . 1 1 4 4 ALA C C 4 178.272 178.272 178.657 -0.385 18792 8073 1 11 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.663 -2.097 18792 8074 1 11 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.738 -0.504 18792 8075 1 11 . 1 1 4 4 ALA H H 4 8.414 8.414 8.561 -0.147 18792 8076 1 11 . 1 1 5 5 MET N N 5 119.681 119.681 118.561 1.120 18792 8077 1 11 . 1 1 5 5 MET C C 5 176.929 176.929 176.744 0.185 18792 8078 1 11 . 1 1 5 5 MET CA C 5 55.594 55.594 54.422 1.172 18792 8079 1 11 . 1 1 5 5 MET CB C 5 31.540 31.540 32.032 -0.492 18792 8080 1 11 . 1 1 5 5 MET H H 5 8.336 8.336 8.200 0.136 18792 8081 1 11 . 1 1 6 6 SER N N 6 116.162 116.162 116.882 -0.720 18792 8082 1 11 . 1 1 6 6 SER C C 6 175.924 175.924 175.876 0.048 18792 8083 1 11 . 1 1 6 6 SER CA C 6 59.009 59.009 61.177 -2.168 18792 8084 1 11 . 1 1 6 6 SER CB C 6 62.537 62.537 63.280 -0.743 18792 8085 1 11 . 1 1 6 6 SER H H 6 8.272 8.272 7.745 0.527 18792 8086 1 11 . 1 1 7 7 GLN N N 7 122.263 122.263 121.109 1.154 18792 8087 1 11 . 1 1 7 7 GLN C C 7 177.027 177.027 178.315 -1.288 18792 8088 1 11 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.366 -2.096 18792 8089 1 11 . 1 1 7 7 GLN CB C 7 27.739 27.739 27.436 0.303 18792 8090 1 11 . 1 1 7 7 GLN H H 7 8.314 8.314 8.448 -0.134 18792 8091 1 11 . 1 1 8 8 SER N N 8 116.625 116.625 115.837 0.788 18792 8092 1 11 . 1 1 8 8 SER C C 8 176.457 176.457 176.479 -0.022 18792 8093 1 11 . 1 1 8 8 SER CA C 8 59.650 59.650 61.227 -1.577 18792 8094 1 11 . 1 1 8 8 SER CB C 8 62.226 62.226 62.773 -0.547 18792 8095 1 11 . 1 1 8 8 SER H H 8 8.333 8.333 8.070 0.263 18792 8096 1 11 . 1 1 9 9 ASN N N 9 121.307 121.307 118.983 2.324 18792 8097 1 11 . 1 1 9 9 ASN C C 9 177.419 177.419 177.431 -0.012 18792 8098 1 11 . 1 1 9 9 ASN CA C 9 55.487 55.487 55.639 -0.152 18792 8099 1 11 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.124 -0.991 18792 8100 1 11 . 1 1 9 9 ASN H H 9 8.611 8.611 7.785 0.826 18792 8101 1 11 . 1 1 10 10 ARG N N 10 119.830 119.830 120.964 -1.134 18792 8102 1 11 . 1 1 10 10 ARG C C 10 177.615 177.615 178.443 -0.828 18792 8103 1 11 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.736 -0.478 18792 8104 1 11 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.402 -2.203 18792 8105 1 11 . 1 1 10 10 ARG H H 10 7.996 7.996 8.690 -0.694 18792 8106 1 11 . 1 1 11 11 GLU N N 11 117.270 117.270 120.157 -2.887 18792 8107 1 11 . 1 1 11 11 GLU C C 11 179.649 179.649 178.950 0.699 18792 8108 1 11 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.178 -0.170 18792 8109 1 11 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.110 -0.989 18792 8110 1 11 . 1 1 11 11 GLU H H 11 7.885 7.885 8.114 -0.229 18792 8111 1 11 . 1 1 12 12 LEU N N 12 119.900 119.900 120.932 -1.032 18792 8112 1 11 . 1 1 12 12 LEU C C 12 178.473 178.473 179.145 -0.672 18792 8113 1 11 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.205 -0.512 18792 8114 1 11 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.044 -0.415 18792 8115 1 11 . 1 1 12 12 LEU H H 12 7.691 7.691 7.972 -0.281 18792 8116 1 11 . 1 1 13 13 VAL N N 13 117.320 117.320 119.431 -2.111 18792 8117 1 11 . 1 1 13 13 VAL C C 13 177.272 177.272 177.854 -0.582 18792 8118 1 11 . 1 1 13 13 VAL CA C 13 67.156 67.156 65.718 1.438 18792 8119 1 11 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.662 -0.433 18792 8120 1 11 . 1 1 13 13 VAL H H 13 7.629 7.629 7.754 -0.125 18792 8121 1 11 . 1 1 14 14 VAL N N 14 116.659 116.659 120.011 -3.352 18792 8122 1 11 . 1 1 14 14 VAL C C 14 178.718 178.718 177.695 1.023 18792 8123 1 11 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.878 -0.362 18792 8124 1 11 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.558 -1.184 18792 8125 1 11 . 1 1 14 14 VAL H H 14 8.210 8.210 7.775 0.435 18792 8126 1 11 . 1 1 15 15 ASP N N 15 120.374 120.374 121.379 -1.005 18792 8127 1 11 . 1 1 15 15 ASP C C 15 177.557 177.557 177.801 -0.244 18792 8128 1 11 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.804 0.672 18792 8129 1 11 . 1 1 15 15 ASP CB C 15 42.553 42.553 41.118 1.435 18792 8130 1 11 . 1 1 15 15 ASP H H 15 7.967 7.967 8.574 -0.607 18792 8131 1 11 . 1 1 16 16 PHE N N 16 119.864 119.864 121.155 -1.291 18792 8132 1 11 . 1 1 16 16 PHE C C 16 178.252 178.252 177.178 1.074 18792 8133 1 11 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.677 1.103 18792 8134 1 11 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.947 0.113 18792 8135 1 11 . 1 1 16 16 PHE H H 16 8.228 8.228 7.840 0.388 18792 8136 1 11 . 1 1 17 17 LEU N N 17 116.312 116.312 119.176 -2.864 18792 8137 1 11 . 1 1 17 17 LEU C C 17 179.649 179.649 178.959 0.690 18792 8138 1 11 . 1 1 17 17 LEU CA C 17 57.764 57.764 57.918 -0.154 18792 8139 1 11 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.636 -1.551 18792 8140 1 11 . 1 1 17 17 LEU H H 17 8.766 8.766 8.152 0.614 18792 8141 1 11 . 1 1 18 18 SER N N 18 113.715 113.715 114.745 -1.030 18792 8142 1 11 . 1 1 18 18 SER C C 18 177.362 177.362 176.215 1.147 18792 8143 1 11 . 1 1 18 18 SER CA C 18 61.948 61.948 61.127 0.821 18792 8144 1 11 . 1 1 18 18 SER CB C 18 63.003 63.003 62.975 0.028 18792 8145 1 11 . 1 1 18 18 SER H H 18 8.384 8.384 8.413 -0.029 18792 8146 1 11 . 1 1 19 19 TYR N N 19 124.570 124.570 121.433 3.137 18792 8147 1 11 . 1 1 19 19 TYR C C 19 178.415 178.415 177.743 0.672 18792 8148 1 11 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.428 -1.664 18792 8149 1 11 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.168 -1.152 18792 8150 1 11 . 1 1 19 19 TYR H H 19 8.155 8.155 8.774 -0.619 18792 8151 1 11 . 1 1 20 20 LYS N N 20 119.739 119.739 119.826 -0.087 18792 8152 1 11 . 1 1 20 20 LYS C C 20 180.456 180.456 179.071 1.385 18792 8153 1 11 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.225 -1.737 18792 8154 1 11 . 1 1 20 20 LYS CB C 20 28.159 28.159 31.698 -3.539 18792 8155 1 11 . 1 1 20 20 LYS H H 20 8.224 8.224 7.959 0.265 18792 8156 1 11 . 1 1 21 21 LEU N N 21 118.092 118.092 120.719 -2.627 18792 8157 1 11 . 1 1 21 21 LEU C C 21 179.989 179.989 178.569 1.420 18792 8158 1 11 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.712 -0.586 18792 8159 1 11 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.913 -2.305 18792 8160 1 11 . 1 1 21 21 LEU H H 21 8.586 8.586 7.923 0.663 18792 8161 1 11 . 1 1 22 22 SER N N 22 117.304 117.304 113.198 4.106 18792 8162 1 11 . 1 1 22 22 SER C C 22 180.152 180.152 177.116 3.036 18792 8163 1 11 . 1 1 22 22 SER CA C 22 61.287 61.287 61.623 -0.336 18792 8164 1 11 . 1 1 22 22 SER H H 22 8.266 8.266 7.482 0.784 18792 8165 1 11 . 1 1 23 23 GLN N N 23 122.497 122.497 121.096 1.401 18792 8166 1 11 . 1 1 23 23 GLN C C 23 177.297 177.297 177.689 -0.392 18792 8167 1 11 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.287 -0.345 18792 8168 1 11 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.508 -0.696 18792 8169 1 11 . 1 1 23 23 GLN H H 23 7.571 7.571 8.114 -0.543 18792 8170 1 11 . 1 1 24 24 LYS N N 24 116.038 116.038 116.238 -0.200 18792 8171 1 11 . 1 1 24 24 LYS C C 24 175.704 175.704 176.884 -1.180 18792 8172 1 11 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.676 -3.181 18792 8173 1 11 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.159 -1.930 18792 8174 1 11 . 1 1 24 24 LYS H H 24 7.134 7.134 7.699 -0.565 18792 8175 1 11 . 1 1 25 25 GLY N N 25 105.283 105.283 105.522 -0.239 18792 8176 1 11 . 1 1 25 25 GLY C C 25 174.013 174.013 173.511 0.502 18792 8177 1 11 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.778 0.001 18792 8178 1 11 . 1 1 25 25 GLY H H 25 7.483 7.483 7.869 -0.386 18792 8179 1 11 . 1 1 26 26 TYR N N 26 119.547 119.547 119.579 -0.032 18792 8180 1 11 . 1 1 26 26 TYR C C 26 175.122 175.122 173.786 1.336 18792 8181 1 11 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.767 -1.635 18792 8182 1 11 . 1 1 26 26 TYR CB C 26 40.080 40.080 40.213 -0.133 18792 8183 1 11 . 1 1 26 26 TYR H H 26 7.788 7.788 7.659 0.129 18792 8184 1 11 . 1 1 27 27 SER N N 27 115.088 115.088 116.320 -1.232 18792 8185 1 11 . 1 1 27 27 SER C C 27 174.452 174.452 176.048 -1.596 18792 8186 1 11 . 1 1 27 27 SER CA C 27 56.306 56.306 56.475 -0.169 18792 8187 1 11 . 1 1 27 27 SER CB C 27 63.921 63.921 65.618 -1.697 18792 8188 1 11 . 1 1 27 27 SER H H 27 8.473 8.473 8.109 0.364 18792 8189 1 11 . 1 1 28 28 TRP N N 28 127.014 127.014 122.565 4.449 18792 8190 1 11 . 1 1 28 28 TRP C C 28 177.002 177.002 178.171 -1.169 18792 8191 1 11 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.397 0.075 18792 8192 1 11 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.725 1.105 18792 8193 1 11 . 1 1 28 28 TRP H H 28 8.897 8.897 8.809 0.088 18792 8194 1 11 . 1 1 29 29 SER N N 29 112.044 112.044 113.866 -1.822 18792 8195 1 11 . 1 1 29 29 SER C C 29 175.106 175.106 176.673 -1.567 18792 8196 1 11 . 1 1 29 29 SER CA C 29 59.472 59.472 59.887 -0.415 18792 8197 1 11 . 1 1 29 29 SER CB C 29 62.226 62.226 63.523 -1.297 18792 8198 1 11 . 1 1 29 29 SER H H 29 8.129 8.129 7.791 0.338 18792 8199 1 11 . 1 1 30 30 GLN N N 30 119.160 119.160 122.238 -3.078 18792 8200 1 11 . 1 1 30 30 GLN C C 30 176.218 176.218 178.180 -1.962 18792 8201 1 11 . 1 1 30 30 GLN CA C 30 56.412 56.412 58.671 -2.259 18792 8202 1 11 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.640 -1.062 18792 8203 1 11 . 1 1 30 30 GLN H H 30 7.370 7.370 8.228 -0.858 18792 8204 1 11 . 1 1 31 31 PHE N N 31 116.277 116.277 117.794 -1.517 18792 8205 1 11 . 1 1 31 31 PHE C C 31 175.217 175.217 175.426 -0.209 18792 8206 1 11 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.725 -3.491 18792 8207 1 11 . 1 1 31 31 PHE CB C 31 39.066 39.066 40.706 -1.640 18792 8208 1 11 . 1 1 31 31 PHE H H 31 7.248 7.248 8.149 -0.901 18792 8209 1 11 . 1 1 32 32 SER N N 32 113.683 113.683 115.897 -2.214 18792 8210 1 11 . 1 1 32 32 SER C C 32 173.793 173.793 174.115 -0.322 18792 8211 1 11 . 1 1 32 32 SER CA C 32 57.124 57.124 57.128 -0.004 18792 8212 1 11 . 1 1 32 32 SER CB C 32 63.081 63.081 63.583 -0.502 18792 8213 1 11 . 1 1 32 32 SER H H 32 7.242 7.242 7.771 -0.529 18792 8214 1 11 . 1 1 33 33 ASP N N 33 122.195 122.195 125.883 -3.688 18792 8215 1 11 . 1 1 33 33 ASP C C 33 176.394 176.394 176.618 -0.224 18792 8216 1 11 . 1 1 33 33 ASP CA C 33 53.748 53.748 56.391 -2.643 18792 8217 1 11 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.901 -0.503 18792 8218 1 11 . 1 1 33 33 ASP H H 33 8.257 8.257 8.727 -0.470 18792 8219 1 11 . 1 1 34 34 VAL N N 34 118.913 118.913 118.485 0.428 18792 8220 1 11 . 1 1 34 34 VAL C C 34 176.328 176.328 176.047 0.281 18792 8221 1 11 . 1 1 34 34 VAL CA C 34 61.891 61.891 63.837 -1.946 18792 8222 1 11 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.330 -0.315 18792 8223 1 11 . 1 1 34 34 VAL H H 34 7.852 7.852 7.776 0.076 18792 8224 1 11 . 1 1 35 35 GLU N N 35 124.205 124.205 120.778 3.427 18792 8225 1 11 . 1 1 35 35 GLU C C 35 176.586 176.586 174.546 2.040 18792 8226 1 11 . 1 1 35 35 GLU CA C 35 56.057 56.057 55.977 0.080 18792 8227 1 11 . 1 1 35 35 GLU CB C 35 28.898 28.898 29.268 -0.370 18792 8228 1 11 . 1 1 35 35 GLU H H 35 8.401 8.401 7.894 0.507 18792 8229 1 11 . 1 1 36 36 GLU N N 36 121.670 121.670 122.669 -0.999 18792 8230 1 11 . 1 1 36 36 GLU C C 36 176.218 176.218 174.900 1.318 18792 8231 1 11 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.574 -0.586 18792 8232 1 11 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.559 -1.117 18792 8233 1 11 . 1 1 36 36 GLU H H 36 8.239 8.239 8.418 -0.179 18792 8234 1 11 . 1 1 37 37 ASN N N 37 119.252 119.252 117.744 1.508 18792 8235 1 11 . 1 1 37 37 ASN C C 37 175.003 175.003 174.870 0.133 18792 8236 1 11 . 1 1 37 37 ASN CA C 37 52.655 52.655 52.647 0.008 18792 8237 1 11 . 1 1 37 37 ASN CB C 37 38.212 38.212 40.389 -2.177 18792 8238 1 11 . 1 1 37 37 ASN H H 37 8.412 8.412 8.174 0.238 18792 8239 1 11 . 1 1 38 38 ARG N N 38 121.622 121.622 122.151 -0.529 18792 8240 1 11 . 1 1 38 38 ARG C C 38 176.610 176.610 175.702 0.908 18792 8241 1 11 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.447 -1.083 18792 8242 1 11 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.084 -1.665 18792 8243 1 11 . 1 1 38 38 ARG H H 38 8.227 8.227 8.579 -0.352 18792 8244 1 11 . 1 1 39 39 THR N N 39 115.681 115.681 112.750 2.931 18792 8245 1 11 . 1 1 39 39 THR C C 39 174.500 174.500 173.902 0.598 18792 8246 1 11 . 1 1 39 39 THR CA C 39 61.606 61.606 62.389 -0.783 18792 8247 1 11 . 1 1 39 39 THR CB C 39 69.163 69.163 69.995 -0.832 18792 8248 1 11 . 1 1 39 39 THR H H 39 8.173 8.173 8.731 -0.558 18792 8249 1 11 . 1 1 40 40 GLU N N 40 122.708 122.708 121.269 1.439 18792 8250 1 11 . 1 1 40 40 GLU C C 40 175.728 175.728 175.182 0.546 18792 8251 1 11 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.208 -0.436 18792 8252 1 11 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.665 -0.611 18792 8253 1 11 . 1 1 40 40 GLU H H 40 8.298 8.298 8.057 0.241 18792 8254 1 11 . 1 1 41 41 ALA N N 41 125.922 125.922 124.429 1.493 18792 8255 1 11 . 1 1 41 41 ALA C C 41 175.557 175.557 176.869 -1.312 18792 8256 1 11 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.172 -1.199 18792 8257 1 11 . 1 1 41 41 ALA CB C 41 17.245 17.245 18.942 -1.697 18792 8258 1 11 . 1 1 41 41 ALA H H 41 8.212 8.212 8.098 0.114 18792 8259 1 11 . 1 1 43 43 GLU N N 43 120.783 120.783 120.976 -0.193 18792 8260 1 11 . 1 1 43 43 GLU C C 43 177.174 177.174 177.192 -0.018 18792 8261 1 11 . 1 1 43 43 GLU CA C 43 56.341 56.341 57.245 -0.904 18792 8262 1 11 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.053 -0.766 18792 8263 1 11 . 1 1 43 43 GLU H H 43 8.519 8.519 8.616 -0.097 18792 8264 1 11 . 1 1 44 44 GLY N N 44 110.022 110.022 108.982 1.040 18792 8265 1 11 . 1 1 44 44 GLY C C 44 174.773 174.773 175.090 -0.317 18792 8266 1 11 . 1 1 44 44 GLY CA C 44 45.028 45.028 44.968 0.060 18792 8267 1 11 . 1 1 44 44 GLY H H 44 8.429 8.429 8.557 -0.128 18792 8268 1 11 . 1 1 45 45 THR N N 45 112.790 112.790 113.402 -0.612 18792 8269 1 11 . 1 1 45 45 THR C C 45 175.726 175.726 175.620 0.106 18792 8270 1 11 . 1 1 45 45 THR CA C 45 61.987 61.987 62.531 -0.544 18792 8271 1 11 . 1 1 45 45 THR CB C 45 69.304 69.304 69.445 -0.141 18792 8272 1 11 . 1 1 45 45 THR H H 45 8.125 8.125 8.093 0.032 18792 8273 1 11 . 1 1 46 46 GLU N N 46 122.752 122.752 120.515 2.237 18792 8274 1 11 . 1 1 46 46 GLU C C 46 177.419 177.419 176.598 0.821 18792 8275 1 11 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.513 0.718 18792 8276 1 11 . 1 1 46 46 GLU CB C 46 28.199 28.199 30.018 -1.819 18792 8277 1 11 . 1 1 46 46 GLU H H 46 8.765 8.765 8.682 0.083 18792 8278 1 11 . 1 1 47 47 SER N N 47 114.895 114.895 114.554 0.341 18792 8279 1 11 . 1 1 47 47 SER C C 47 175.826 175.826 175.590 0.236 18792 8280 1 11 . 1 1 47 47 SER CA C 47 58.582 58.582 58.854 -0.272 18792 8281 1 11 . 1 1 47 47 SER CB C 47 62.537 62.537 63.721 -1.184 18792 8282 1 11 . 1 1 47 47 SER H H 47 8.355 8.355 8.018 0.337 18792 8283 1 11 . 1 1 48 48 GLU N N 48 122.429 122.429 123.157 -0.728 18792 8284 1 11 . 1 1 48 48 GLU C C 48 178.099 178.099 177.926 0.173 18792 8285 1 11 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.736 -1.119 18792 8286 1 11 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.505 -1.030 18792 8287 1 11 . 1 1 48 48 GLU H H 48 8.139 8.139 8.476 -0.337 18792 8288 1 11 . 1 1 49 49 ALA N N 49 120.374 120.374 120.536 -0.162 18792 8289 1 11 . 1 1 49 49 ALA C C 49 180.843 180.843 179.342 1.501 18792 8290 1 11 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.248 -0.765 18792 8291 1 11 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.282 -0.847 18792 8292 1 11 . 1 1 49 49 ALA H H 49 8.079 8.079 8.553 -0.474 18792 8293 1 11 . 1 1 50 50 VAL N N 50 118.599 118.599 118.756 -0.157 18792 8294 1 11 . 1 1 50 50 VAL C C 50 176.921 176.921 177.974 -1.053 18792 8295 1 11 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.556 -0.997 18792 8296 1 11 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.428 -1.131 18792 8297 1 11 . 1 1 50 50 VAL H H 50 7.419 7.419 7.275 0.144 18792 8298 1 11 . 1 1 51 51 LYS N N 51 117.469 117.469 119.597 -2.128 18792 8299 1 11 . 1 1 51 51 LYS C C 51 179.061 179.061 179.194 -0.133 18792 8300 1 11 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.920 -0.697 18792 8301 1 11 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.827 -0.831 18792 8302 1 11 . 1 1 51 51 LYS H H 51 7.359 7.359 8.117 -0.758 18792 8303 1 11 . 1 1 52 52 GLN N N 52 115.930 115.930 118.203 -2.273 18792 8304 1 11 . 1 1 52 52 GLN C C 52 177.713 177.713 178.112 -0.399 18792 8305 1 11 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.427 0.049 18792 8306 1 11 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.090 -1.522 18792 8307 1 11 . 1 1 52 52 GLN H H 52 8.025 8.025 8.003 0.022 18792 8308 1 11 . 1 1 53 53 ALA N N 53 119.782 119.782 122.434 -2.652 18792 8309 1 11 . 1 1 53 53 ALA C C 53 180.008 180.008 179.247 0.761 18792 8310 1 11 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.751 -0.366 18792 8311 1 11 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.380 -0.865 18792 8312 1 11 . 1 1 53 53 ALA H H 53 7.655 7.655 7.896 -0.241 18792 8313 1 11 . 1 1 54 54 LEU N N 54 120.443 120.443 119.655 0.788 18792 8314 1 11 . 1 1 54 54 LEU C C 54 179.330 179.330 178.791 0.539 18792 8315 1 11 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.726 0.287 18792 8316 1 11 . 1 1 54 54 LEU CB C 54 40.862 40.862 42.192 -1.330 18792 8317 1 11 . 1 1 54 54 LEU H H 54 8.419 8.419 8.287 0.132 18792 8318 1 11 . 1 1 55 55 ARG N N 55 118.423 118.423 118.886 -0.463 18792 8319 1 11 . 1 1 55 55 ARG C C 55 178.767 178.767 178.402 0.365 18792 8320 1 11 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.335 1.062 18792 8321 1 11 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.398 -0.655 18792 8322 1 11 . 1 1 55 55 ARG H H 55 8.062 8.062 8.269 -0.207 18792 8323 1 11 . 1 1 56 56 GLU N N 56 115.988 115.988 120.440 -4.452 18792 8324 1 11 . 1 1 56 56 GLU C C 56 180.090 180.090 178.524 1.566 18792 8325 1 11 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.036 -0.276 18792 8326 1 11 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.774 -1.420 18792 8327 1 11 . 1 1 56 56 GLU H H 56 7.772 7.772 7.968 -0.196 18792 8328 1 11 . 1 1 57 57 ALA N N 57 122.837 122.837 121.257 1.580 18792 8329 1 11 . 1 1 57 57 ALA C C 57 181.861 181.861 179.731 2.130 18792 8330 1 11 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.776 -0.142 18792 8331 1 11 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.482 -0.009 18792 8332 1 11 . 1 1 57 57 ALA H H 57 8.774 8.774 8.299 0.475 18792 8333 1 11 . 1 1 58 58 GLY N N 58 108.409 108.409 106.442 1.967 18792 8334 1 11 . 1 1 58 58 GLY C C 58 175.331 175.331 175.958 -0.627 18792 8335 1 11 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.960 -0.292 18792 8336 1 11 . 1 1 58 58 GLY H H 58 9.073 9.073 8.568 0.505 18792 8337 1 11 . 1 1 59 59 ASP N N 59 122.074 122.074 122.421 -0.347 18792 8338 1 11 . 1 1 59 59 ASP C C 59 179.023 179.023 178.302 0.721 18792 8339 1 11 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.300 0.002 18792 8340 1 11 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.548 -1.706 18792 8341 1 11 . 1 1 59 59 ASP H H 59 8.049 8.049 8.295 -0.246 18792 8342 1 11 . 1 1 60 60 GLU N N 60 120.131 120.131 120.426 -0.295 18792 8343 1 11 . 1 1 60 60 GLU C C 60 178.522 178.522 178.645 -0.123 18792 8344 1 11 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.331 -0.322 18792 8345 1 11 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.995 -1.796 18792 8346 1 11 . 1 1 60 60 GLU H H 60 8.136 8.136 8.219 -0.083 18792 8347 1 11 . 1 1 61 61 PHE N N 61 121.309 121.309 120.837 0.472 18792 8348 1 11 . 1 1 61 61 PHE C C 61 176.904 176.904 177.563 -0.659 18792 8349 1 11 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.481 -0.159 18792 8350 1 11 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.642 -1.033 18792 8351 1 11 . 1 1 61 61 PHE H H 61 8.523 8.523 8.225 0.298 18792 8352 1 11 . 1 1 62 62 GLU N N 62 115.971 115.971 119.248 -3.277 18792 8353 1 11 . 1 1 62 62 GLU C C 62 177.713 177.713 177.671 0.042 18792 8354 1 11 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.535 -1.345 18792 8355 1 11 . 1 1 62 62 GLU CB C 62 28.277 28.277 30.049 -1.772 18792 8356 1 11 . 1 1 62 62 GLU H H 62 7.969 7.969 8.409 -0.440 18792 8357 1 11 . 1 1 63 63 LEU N N 63 116.703 116.703 118.269 -1.566 18792 8358 1 11 . 1 1 63 63 LEU C C 63 178.963 178.963 178.508 0.455 18792 8359 1 11 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.675 -0.263 18792 8360 1 11 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.309 -0.903 18792 8361 1 11 . 1 1 63 63 LEU H H 63 7.347 7.347 7.757 -0.410 18792 8362 1 11 . 1 1 64 64 ARG N N 64 117.453 117.453 117.795 -0.342 18792 8363 1 11 . 1 1 64 64 ARG C C 64 177.297 177.297 175.861 1.436 18792 8364 1 11 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.853 0.484 18792 8365 1 11 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.345 -1.748 18792 8366 1 11 . 1 1 64 64 ARG H H 64 7.995 7.995 7.937 0.058 18792 8367 1 11 . 1 1 65 65 TYR N N 65 118.956 118.956 117.515 1.441 18792 8368 1 11 . 1 1 65 65 TYR C C 65 175.278 175.278 174.385 0.893 18792 8369 1 11 . 1 1 65 65 TYR CA C 65 55.701 55.701 56.222 -0.521 18792 8370 1 11 . 1 1 65 65 TYR CB C 65 35.986 35.986 37.990 -2.004 18792 8371 1 11 . 1 1 65 65 TYR H H 65 7.909 7.909 7.872 0.037 18792 8372 1 11 . 1 1 66 66 ARG N N 66 119.438 119.438 120.609 -1.171 18792 8373 1 11 . 1 1 66 66 ARG C C 66 178.424 178.424 176.805 1.619 18792 8374 1 11 . 1 1 66 66 ARG CA C 66 58.476 58.476 57.508 0.968 18792 8375 1 11 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.182 -1.361 18792 8376 1 11 . 1 1 66 66 ARG H H 66 7.244 7.244 8.382 -1.138 18792 8377 1 11 . 1 1 67 67 ARG N N 67 118.936 118.936 120.064 -1.128 18792 8378 1 11 . 1 1 67 67 ARG C C 67 177.542 177.542 178.078 -0.536 18792 8379 1 11 . 1 1 67 67 ARG CA C 67 57.444 57.444 58.771 -1.327 18792 8380 1 11 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.539 -1.418 18792 8381 1 11 . 1 1 67 67 ARG H H 67 8.417 8.417 8.172 0.245 18792 8382 1 11 . 1 1 68 68 ALA N N 68 121.797 121.797 122.746 -0.949 18792 8383 1 11 . 1 1 68 68 ALA C C 68 180.337 180.337 178.001 2.336 18792 8384 1 11 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.370 -0.234 18792 8385 1 11 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.854 -0.387 18792 8386 1 11 . 1 1 68 68 ALA H H 68 7.827 7.827 8.289 -0.462 18792 8387 1 11 . 1 1 69 69 PHE N N 69 115.986 115.986 118.257 -2.271 18792 8388 1 11 . 1 1 69 69 PHE C C 69 177.468 177.468 177.044 0.424 18792 8389 1 11 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.490 -1.441 18792 8390 1 11 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.539 -0.941 18792 8391 1 11 . 1 1 69 69 PHE H H 69 8.517 8.517 8.339 0.178 18792 8392 1 11 . 1 1 70 70 SER N N 70 116.526 116.526 114.890 1.636 18792 8393 1 11 . 1 1 70 70 SER C C 70 177.640 177.640 176.408 1.232 18792 8394 1 11 . 1 1 70 70 SER CA C 70 61.073 61.073 61.784 -0.711 18792 8395 1 11 . 1 1 70 70 SER CB C 70 61.993 61.993 62.911 -0.918 18792 8396 1 11 . 1 1 70 70 SER H H 70 8.152 8.152 7.893 0.259 18792 8397 1 11 . 1 1 71 71 ASP N N 71 121.181 121.181 122.108 -0.927 18792 8398 1 11 . 1 1 71 71 ASP C C 71 178.546 178.546 178.677 -0.131 18792 8399 1 11 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.169 -0.721 18792 8400 1 11 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.640 -1.409 18792 8401 1 11 . 1 1 71 71 ASP H H 71 8.356 8.356 7.512 0.844 18792 8402 1 11 . 1 1 72 72 LEU N N 72 120.747 120.747 120.277 0.470 18792 8403 1 11 . 1 1 72 72 LEU C C 72 178.963 178.963 179.048 -0.085 18792 8404 1 11 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.316 -0.873 18792 8405 1 11 . 1 1 72 72 LEU CB C 72 41.017 41.017 41.526 -0.509 18792 8406 1 11 . 1 1 72 72 LEU H H 72 7.738 7.738 8.454 -0.716 18792 8407 1 11 . 1 1 73 73 THR N N 73 109.432 109.432 113.977 -4.545 18792 8408 1 11 . 1 1 73 73 THR C C 73 177.481 177.481 175.863 1.618 18792 8409 1 11 . 1 1 73 73 THR CA C 73 65.128 65.128 65.851 -0.723 18792 8410 1 11 . 1 1 73 73 THR CB C 73 67.720 67.720 68.598 -0.878 18792 8411 1 11 . 1 1 73 73 THR H H 73 8.296 8.296 7.943 0.353 18792 8412 1 11 . 1 1 74 74 SER N N 74 115.862 115.862 115.897 -0.035 18792 8413 1 11 . 1 1 74 74 SER C C 74 175.361 175.361 175.916 -0.555 18792 8414 1 11 . 1 1 74 74 SER CA C 74 60.112 60.112 60.638 -0.526 18792 8415 1 11 . 1 1 74 74 SER CB C 74 62.537 62.537 63.243 -0.706 18792 8416 1 11 . 1 1 74 74 SER H H 74 7.629 7.629 8.133 -0.504 18792 8417 1 11 . 1 1 75 75 GLN N N 75 118.551 118.551 119.588 -1.037 18792 8418 1 11 . 1 1 75 75 GLN C C 75 176.316 176.316 176.541 -0.225 18792 8419 1 11 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.926 -0.122 18792 8420 1 11 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.608 -1.331 18792 8421 1 11 . 1 1 75 75 GLN H H 75 7.640 7.640 7.421 0.219 18792 8422 1 11 . 1 1 76 76 LEU N N 76 118.313 118.313 116.873 1.440 18792 8423 1 11 . 1 1 76 76 LEU C C 76 174.160 174.160 175.583 -1.423 18792 8424 1 11 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.445 -0.705 18792 8425 1 11 . 1 1 76 76 LEU CB C 76 42.727 42.727 41.171 1.556 18792 8426 1 11 . 1 1 76 76 LEU H H 76 7.411 7.411 7.468 -0.057 18792 8427 1 11 . 1 1 77 77 HIS N N 77 120.104 120.104 119.196 0.908 18792 8428 1 11 . 1 1 77 77 HIS C C 77 174.528 174.528 173.649 0.879 18792 8429 1 11 . 1 1 77 77 HIS CA C 77 54.207 54.207 56.986 -2.779 18792 8430 1 11 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.272 -0.306 18792 8431 1 11 . 1 1 77 77 HIS H H 77 8.117 8.117 8.418 -0.301 18792 8432 1 11 . 1 1 78 78 ILE N N 78 122.298 122.298 122.602 -0.304 18792 8433 1 11 . 1 1 78 78 ILE C C 78 174.240 174.240 174.973 -0.733 18792 8434 1 11 . 1 1 78 78 ILE CA C 78 61.402 61.402 60.077 1.325 18792 8435 1 11 . 1 1 78 78 ILE CB C 78 37.591 37.591 39.224 -1.633 18792 8436 1 11 . 1 1 78 78 ILE H H 78 8.655 8.655 8.000 0.655 18792 8437 1 11 . 1 1 79 79 THR N N 79 116.442 116.442 118.991 -2.549 18792 8438 1 11 . 1 1 79 79 THR C C 79 174.291 174.291 174.321 -0.030 18792 8439 1 11 . 1 1 79 79 THR CA C 79 61.632 61.632 61.339 0.293 18792 8440 1 11 . 1 1 79 79 THR CB C 79 68.704 68.704 69.436 -0.732 18792 8441 1 11 . 1 1 79 79 THR H H 79 8.245 8.245 8.007 0.238 18792 8442 1 11 . 1 1 84 84 TYR N N 84 120.888 120.888 121.936 -1.048 18792 8443 1 11 . 1 1 84 84 TYR C C 84 176.708 176.708 177.244 -0.536 18792 8444 1 11 . 1 1 84 84 TYR CA C 84 60.432 60.432 62.528 -2.096 18792 8445 1 11 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.504 -1.759 18792 8446 1 11 . 1 1 84 84 TYR H H 84 8.733 8.733 8.516 0.217 18792 8447 1 11 . 1 1 85 85 GLN N N 85 114.530 114.530 118.680 -4.150 18792 8448 1 11 . 1 1 85 85 GLN C C 85 178.473 178.473 178.479 -0.006 18792 8449 1 11 . 1 1 85 85 GLN CA C 85 59.294 59.294 58.862 0.432 18792 8450 1 11 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.267 -1.466 18792 8451 1 11 . 1 1 85 85 GLN H H 85 8.413 8.413 8.777 -0.364 18792 8452 1 11 . 1 1 86 86 SER N N 86 114.032 114.032 115.103 -1.071 18792 8453 1 11 . 1 1 86 86 SER C C 86 178.473 178.473 176.343 2.130 18792 8454 1 11 . 1 1 86 86 SER CA C 86 62.175 62.175 61.848 0.327 18792 8455 1 11 . 1 1 86 86 SER CB C 86 63.252 63.252 62.901 0.351 18792 8456 1 11 . 1 1 86 86 SER H H 86 7.258 7.258 8.229 -0.971 18792 8457 1 11 . 1 1 88 88 GLU N N 88 119.386 119.386 119.728 -0.342 18792 8458 1 11 . 1 1 88 88 GLU C C 88 177.199 177.199 178.908 -1.709 18792 8459 1 11 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.834 -1.252 18792 8460 1 11 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.109 -0.133 18792 8461 1 11 . 1 1 88 88 GLU H H 88 8.534 8.534 8.286 0.248 18792 8462 1 11 . 1 1 89 89 GLN N N 89 114.678 114.678 118.466 -3.788 18792 8463 1 11 . 1 1 89 89 GLN C C 89 178.669 178.669 178.735 -0.066 18792 8464 1 11 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.050 -0.468 18792 8465 1 11 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.884 -1.462 18792 8466 1 11 . 1 1 89 89 GLN H H 89 7.500 7.500 8.048 -0.548 18792 8467 1 11 . 1 1 90 90 VAL N N 90 118.174 118.174 116.427 1.747 18792 8468 1 11 . 1 1 90 90 VAL C C 90 178.081 178.081 178.052 0.029 18792 8469 1 11 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.291 0.264 18792 8470 1 11 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.727 -0.120 18792 8471 1 11 . 1 1 90 90 VAL H H 90 7.017 7.017 7.586 -0.569 18792 8472 1 11 . 1 1 91 91 VAL N N 91 119.489 119.489 122.457 -2.968 18792 8473 1 11 . 1 1 91 91 VAL C C 91 177.914 177.914 178.197 -0.283 18792 8474 1 11 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.569 -0.800 18792 8475 1 11 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.848 -0.557 18792 8476 1 11 . 1 1 91 91 VAL H H 91 7.833 7.833 8.635 -0.802 18792 8477 1 11 . 1 1 92 92 ASN N N 92 117.180 117.180 117.678 -0.498 18792 8478 1 11 . 1 1 92 92 ASN C C 92 179.110 179.110 176.800 2.310 18792 8479 1 11 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.288 -1.370 18792 8480 1 11 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.764 -2.796 18792 8481 1 11 . 1 1 92 92 ASN H H 92 8.368 8.368 8.406 -0.038 18792 8482 1 11 . 1 1 93 93 GLU N N 93 118.476 118.476 119.332 -0.856 18792 8483 1 11 . 1 1 93 93 GLU C C 93 179.355 179.355 179.134 0.221 18792 8484 1 11 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.142 -0.737 18792 8485 1 11 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.765 -2.032 18792 8486 1 11 . 1 1 93 93 GLU H H 93 7.213 7.213 7.863 -0.650 18792 8487 1 11 . 1 1 94 94 LEU N N 94 120.889 120.889 118.542 2.347 18792 8488 1 11 . 1 1 94 94 LEU C C 94 178.473 178.473 176.949 1.524 18792 8489 1 11 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.031 -0.014 18792 8490 1 11 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.123 -2.193 18792 8491 1 11 . 1 1 94 94 LEU H H 94 7.446 7.446 7.605 -0.159 18792 8492 1 11 . 1 1 95 95 PHE N N 95 112.902 112.902 116.030 -3.128 18792 8493 1 11 . 1 1 95 95 PHE C C 95 176.586 176.586 176.652 -0.066 18792 8494 1 11 . 1 1 95 95 PHE CA C 95 57.159 57.159 55.516 1.643 18792 8495 1 11 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.465 -0.244 18792 8496 1 11 . 1 1 95 95 PHE H H 95 6.916 6.916 7.394 -0.478 18792 8497 1 11 . 1 1 96 96 ARG N N 96 123.729 123.729 121.603 2.126 18792 8498 1 11 . 1 1 96 96 ARG C C 96 177.272 177.272 176.431 0.841 18792 8499 1 11 . 1 1 96 96 ARG CA C 96 59.223 59.223 59.091 0.132 18792 8500 1 11 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.335 -1.903 18792 8501 1 11 . 1 1 96 96 ARG H H 96 7.126 7.126 7.576 -0.450 18792 8502 1 11 . 1 1 97 97 ASP N N 97 116.576 116.576 116.100 0.476 18792 8503 1 11 . 1 1 97 97 ASP C C 97 175.687 175.687 174.981 0.706 18792 8504 1 11 . 1 1 97 97 ASP CA C 97 53.673 53.673 53.951 -0.278 18792 8505 1 11 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.047 -2.002 18792 8506 1 11 . 1 1 97 97 ASP H H 97 8.644 8.644 8.244 0.400 18792 8507 1 11 . 1 1 98 98 GLY N N 98 108.551 108.551 106.971 1.580 18792 8508 1 11 . 1 1 98 98 GLY C C 98 172.690 172.690 172.496 0.194 18792 8509 1 11 . 1 1 98 98 GLY CA C 98 43.250 43.250 44.357 -1.107 18792 8510 1 11 . 1 1 98 98 GLY H H 98 7.463 7.463 7.842 -0.379 18792 8511 1 11 . 1 1 99 99 VAL N N 99 120.630 120.630 121.020 -0.390 18792 8512 1 11 . 1 1 99 99 VAL C C 99 174.503 174.503 175.336 -0.833 18792 8513 1 11 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.335 -1.017 18792 8514 1 11 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.612 -1.849 18792 8515 1 11 . 1 1 99 99 VAL H H 99 8.184 8.184 8.495 -0.311 18792 8516 1 11 . 1 1 100 100 ASN N N 100 115.485 115.485 114.957 0.528 18792 8517 1 11 . 1 1 100 100 ASN C C 100 175.239 175.239 176.574 -1.335 18792 8518 1 11 . 1 1 100 100 ASN CA C 100 51.361 51.361 53.974 -2.614 18792 8519 1 11 . 1 1 100 100 ASN CB C 100 38.920 38.920 37.975 0.945 18792 8520 1 11 . 1 1 100 100 ASN H H 100 6.241 6.241 7.869 -1.628 18792 8521 1 11 . 1 1 101 101 TRP N N 101 118.266 118.266 121.176 -2.910 18792 8522 1 11 . 1 1 101 101 TRP C C 101 178.301 178.301 176.348 1.953 18792 8523 1 11 . 1 1 101 101 TRP CA C 101 60.539 60.539 60.163 0.376 18792 8524 1 11 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.439 1.391 18792 8525 1 11 . 1 1 101 101 TRP H H 101 8.409 8.409 8.424 -0.015 18792 8526 1 11 . 1 1 102 102 GLY N N 102 106.147 106.147 104.189 1.958 18792 8527 1 11 . 1 1 102 102 GLY C C 102 177.640 177.640 174.355 3.285 18792 8528 1 11 . 1 1 102 102 GLY CA C 102 46.914 46.914 43.868 3.046 18792 8529 1 11 . 1 1 102 102 GLY H H 102 8.504 8.504 7.002 1.502 18792 8530 1 11 . 1 1 103 103 ARG N N 103 121.347 121.347 121.191 0.156 18792 8531 1 11 . 1 1 103 103 ARG C C 103 177.738 177.738 176.814 0.924 18792 8532 1 11 . 1 1 103 103 ARG CA C 103 57.942 57.942 57.735 0.207 18792 8533 1 11 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.147 1.072 18792 8534 1 11 . 1 1 103 103 ARG H H 103 8.099 8.099 7.181 0.918 18792 8535 1 11 . 1 1 104 104 ILE N N 104 120.930 120.930 118.626 2.304 18792 8536 1 11 . 1 1 104 104 ILE C C 104 178.197 178.197 177.684 0.513 18792 8537 1 11 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.651 1.884 18792 8538 1 11 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.726 -1.681 18792 8539 1 11 . 1 1 104 104 ILE H H 104 7.690 7.690 7.368 0.322 18792 8540 1 11 . 1 1 105 105 VAL N N 105 120.938 120.938 119.862 1.076 18792 8541 1 11 . 1 1 105 105 VAL C C 105 177.854 177.854 177.153 0.701 18792 8542 1 11 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.901 0.557 18792 8543 1 11 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.673 -0.299 18792 8544 1 11 . 1 1 105 105 VAL H H 105 8.245 8.245 7.276 0.969 18792 8545 1 11 . 1 1 106 106 ALA N N 106 121.165 121.165 122.317 -1.152 18792 8546 1 11 . 1 1 106 106 ALA C C 106 178.284 178.284 179.084 -0.800 18792 8547 1 11 . 1 1 106 106 ALA CA C 106 54.598 54.598 53.816 0.782 18792 8548 1 11 . 1 1 106 106 ALA CB C 106 17.515 17.515 19.023 -1.508 18792 8549 1 11 . 1 1 106 106 ALA H H 106 7.529 7.529 7.785 -0.256 18792 8550 1 11 . 1 1 107 107 PHE N N 107 119.242 119.242 120.703 -1.461 18792 8551 1 11 . 1 1 107 107 PHE C C 107 176.390 176.390 177.313 -0.923 18792 8552 1 11 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.310 -0.137 18792 8553 1 11 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.996 -1.909 18792 8554 1 11 . 1 1 107 107 PHE H H 107 7.974 7.974 8.456 -0.482 18792 8555 1 11 . 1 1 108 108 PHE N N 108 120.009 120.009 118.474 1.535 18792 8556 1 11 . 1 1 108 108 PHE C C 108 177.640 177.640 176.838 0.802 18792 8557 1 11 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.677 0.747 18792 8558 1 11 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.274 -2.928 18792 8559 1 11 . 1 1 108 108 PHE H H 108 7.946 7.946 8.308 -0.362 18792 8560 1 11 . 1 1 109 109 SER N N 109 114.631 114.631 115.447 -0.816 18792 8561 1 11 . 1 1 109 109 SER C C 109 177.770 177.770 176.778 0.992 18792 8562 1 11 . 1 1 109 109 SER CA C 109 63.349 63.349 61.576 1.773 18792 8563 1 11 . 1 1 109 109 SER H H 109 8.424 8.424 7.266 1.158 18792 8564 1 11 . 1 1 110 110 PHE N N 110 124.230 124.230 122.639 1.591 18792 8565 1 11 . 1 1 110 110 PHE C C 110 176.708 176.708 178.801 -2.093 18792 8566 1 11 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.323 0.291 18792 8567 1 11 . 1 1 110 110 PHE CB C 110 37.444 37.444 37.880 -0.436 18792 8568 1 11 . 1 1 110 110 PHE H H 110 9.052 9.052 8.593 0.459 18792 8569 1 11 . 1 1 111 111 GLY N N 111 105.893 105.893 106.540 -0.647 18792 8570 1 11 . 1 1 111 111 GLY C C 111 176.795 176.795 175.953 0.842 18792 8571 1 11 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.668 0.708 18792 8572 1 11 . 1 1 111 111 GLY H H 111 7.926 7.926 8.498 -0.572 18792 8573 1 11 . 1 1 112 112 GLY N N 112 107.410 107.410 109.495 -2.085 18792 8574 1 11 . 1 1 112 112 GLY C C 112 174.650 174.650 175.873 -1.223 18792 8575 1 11 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.372 0.933 18792 8576 1 11 . 1 1 112 112 GLY H H 112 8.799 8.799 7.833 0.966 18792 8577 1 11 . 1 1 113 113 ALA N N 113 124.313 124.313 125.029 -0.716 18792 8578 1 11 . 1 1 113 113 ALA C C 113 181.300 181.300 178.828 2.472 18792 8579 1 11 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.804 -0.277 18792 8580 1 11 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.680 -1.197 18792 8581 1 11 . 1 1 113 113 ALA H H 113 8.212 8.212 7.994 0.218 18792 8582 1 11 . 1 1 114 114 LEU N N 114 118.878 118.878 120.232 -1.354 18792 8583 1 11 . 1 1 114 114 LEU C C 114 180.286 180.286 178.324 1.962 18792 8584 1 11 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.848 -0.866 18792 8585 1 11 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.826 -0.809 18792 8586 1 11 . 1 1 114 114 LEU H H 114 8.161 8.161 8.073 0.088 18792 8587 1 11 . 1 1 115 115 CYS N N 115 119.002 119.002 118.135 0.867 18792 8588 1 11 . 1 1 115 115 CYS C C 115 176.087 176.087 177.375 -1.288 18792 8589 1 11 . 1 1 115 115 CYS CA C 115 63.944 63.944 61.084 2.860 18792 8590 1 11 . 1 1 115 115 CYS CB C 115 25.635 25.635 26.396 -0.761 18792 8591 1 11 . 1 1 115 115 CYS H H 115 8.070 8.070 8.256 -0.186 18792 8592 1 11 . 1 1 116 116 VAL N N 116 118.737 118.737 122.008 -3.271 18792 8593 1 11 . 1 1 116 116 VAL C C 116 177.494 177.494 178.162 -0.668 18792 8594 1 11 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.675 0.087 18792 8595 1 11 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.626 -0.863 18792 8596 1 11 . 1 1 116 116 VAL H H 116 7.995 7.995 7.811 0.184 18792 8597 1 11 . 1 1 117 117 GLU N N 117 118.886 118.886 119.825 -0.939 18792 8598 1 11 . 1 1 117 117 GLU C C 117 178.424 178.424 179.199 -0.775 18792 8599 1 11 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.422 -0.662 18792 8600 1 11 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.629 -1.575 18792 8601 1 11 . 1 1 117 117 GLU H H 117 8.059 8.059 8.056 0.003 18792 8602 1 11 . 1 1 118 118 SER N N 118 113.417 113.417 115.668 -2.251 18792 8603 1 11 . 1 1 118 118 SER C C 118 175.607 175.607 176.528 -0.921 18792 8604 1 11 . 1 1 118 118 SER CA C 118 62.638 62.638 61.237 1.401 18792 8605 1 11 . 1 1 118 118 SER CB C 118 61.061 61.061 63.175 -2.114 18792 8606 1 11 . 1 1 118 118 SER H H 118 7.626 7.626 7.833 -0.207 18792 8607 1 11 . 1 1 119 119 VAL N N 119 120.612 120.612 122.057 -1.445 18792 8608 1 11 . 1 1 119 119 VAL C C 119 179.713 179.713 177.492 2.221 18792 8609 1 11 . 1 1 119 119 VAL CA C 119 66.225 66.225 64.519 1.706 18792 8610 1 11 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.832 -1.753 18792 8611 1 11 . 1 1 119 119 VAL H H 119 7.297 7.297 7.647 -0.350 18792 8612 1 11 . 1 1 120 120 ASP N N 120 122.546 122.546 121.598 0.948 18792 8613 1 11 . 1 1 120 120 ASP C C 120 178.057 178.057 177.244 0.813 18792 8614 1 11 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.503 0.486 18792 8615 1 11 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.630 -0.707 18792 8616 1 11 . 1 1 120 120 ASP H H 120 8.264 8.264 8.206 0.058 18792 8617 1 11 . 1 1 121 121 LYS N N 121 115.636 115.636 116.769 -1.133 18792 8618 1 11 . 1 1 121 121 LYS C C 121 175.159 175.159 175.544 -0.385 18792 8619 1 11 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.361 -1.101 18792 8620 1 11 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.212 -2.437 18792 8621 1 11 . 1 1 121 121 LYS H H 121 7.558 7.558 7.315 0.243 18792 8622 1 11 . 1 1 122 122 GLU N N 122 113.915 113.915 116.712 -2.797 18792 8623 1 11 . 1 1 122 122 GLU C C 122 176.109 176.109 176.299 -0.190 18792 8624 1 11 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.710 -0.403 18792 8625 1 11 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.392 -3.059 18792 8626 1 11 . 1 1 122 122 GLU H H 122 7.826 7.826 7.719 0.107 18792 8627 1 11 . 1 1 124 124 GLN N N 124 119.233 119.233 118.893 0.340 18792 8628 1 11 . 1 1 124 124 GLN C C 124 177.640 177.640 177.170 0.470 18792 8629 1 11 . 1 1 124 124 GLN CA C 124 59.472 59.472 56.991 2.481 18792 8630 1 11 . 1 1 124 124 GLN CB C 124 26.490 26.490 29.480 -2.990 18792 8631 1 11 . 1 1 124 124 GLN H H 124 8.626 8.626 7.933 0.693 18792 8632 1 11 . 1 1 125 125 VAL N N 125 117.011 117.011 116.066 0.945 18792 8633 1 11 . 1 1 125 125 VAL C C 125 175.826 175.826 175.155 0.671 18792 8634 1 11 . 1 1 125 125 VAL CA C 125 63.136 63.136 62.675 0.461 18792 8635 1 11 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.766 -1.469 18792 8636 1 11 . 1 1 125 125 VAL H H 125 7.870 7.870 8.443 -0.573 18792 8637 1 11 . 1 1 126 126 LEU N N 126 117.058 117.058 112.982 4.076 18792 8638 1 11 . 1 1 126 126 LEU C C 126 178.096 178.096 178.160 -0.064 18792 8639 1 11 . 1 1 126 126 LEU CA C 126 55.085 55.085 56.278 -1.193 18792 8640 1 11 . 1 1 126 126 LEU CB C 126 40.273 40.273 43.003 -2.730 18792 8641 1 11 . 1 1 126 126 LEU H H 126 7.747 7.747 7.855 -0.108 18792 8642 1 11 . 1 1 127 127 VAL N N 127 119.457 119.457 122.163 -2.706 18792 8643 1 11 . 1 1 127 127 VAL C C 127 177.150 177.150 178.150 -1.000 18792 8644 1 11 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.298 0.858 18792 8645 1 11 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.905 -1.152 18792 8646 1 11 . 1 1 127 127 VAL H H 127 7.306 7.306 8.147 -0.841 18792 8647 1 11 . 1 1 128 128 SER N N 128 110.647 110.647 114.443 -3.796 18792 8648 1 11 . 1 1 128 128 SER C C 128 177.222 177.222 176.939 0.283 18792 8649 1 11 . 1 1 128 128 SER CA C 128 60.752 60.752 61.515 -0.763 18792 8650 1 11 . 1 1 128 128 SER CB C 128 61.605 61.605 62.691 -1.085 18792 8651 1 11 . 1 1 128 128 SER H H 128 8.237 8.237 8.541 -0.304 18792 8652 1 11 . 1 1 129 129 ARG N N 129 123.100 123.100 122.576 0.524 18792 8653 1 11 . 1 1 129 129 ARG C C 129 175.802 175.802 178.891 -3.089 18792 8654 1 11 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.556 -1.329 18792 8655 1 11 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.461 -2.262 18792 8656 1 11 . 1 1 129 129 ARG H H 129 6.564 6.564 7.784 -1.220 18792 8657 1 11 . 1 1 130 130 ILE N N 130 118.182 118.182 118.076 0.106 18792 8658 1 11 . 1 1 130 130 ILE C C 130 178.156 178.156 177.678 0.478 18792 8659 1 11 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.098 -0.752 18792 8660 1 11 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.829 -1.147 18792 8661 1 11 . 1 1 130 130 ILE H H 130 7.955 7.955 8.662 -0.707 18792 8662 1 11 . 1 1 131 131 ALA N N 131 119.029 119.029 123.012 -3.983 18792 8663 1 11 . 1 1 131 131 ALA C C 131 179.593 179.593 179.149 0.444 18792 8664 1 11 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.161 -0.563 18792 8665 1 11 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.402 -1.014 18792 8666 1 11 . 1 1 131 131 ALA H H 131 7.582 7.582 8.727 -1.145 18792 8667 1 11 . 1 1 132 132 ALA N N 132 120.336 120.336 121.597 -1.261 18792 8668 1 11 . 1 1 132 132 ALA C C 132 181.095 181.095 179.373 1.722 18792 8669 1 11 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.622 -0.024 18792 8670 1 11 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.518 -1.817 18792 8671 1 11 . 1 1 132 132 ALA H H 132 7.224 7.224 7.877 -0.653 18792 8672 1 11 . 1 1 133 133 TRP N N 133 121.194 121.194 121.123 0.071 18792 8673 1 11 . 1 1 133 133 TRP C C 133 179.698 179.698 178.107 1.591 18792 8674 1 11 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.431 -3.128 18792 8675 1 11 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.871 -2.216 18792 8676 1 11 . 1 1 133 133 TRP H H 133 8.925 8.925 8.520 0.405 18792 8677 1 11 . 1 1 134 134 MET N N 134 116.987 116.987 117.606 -0.619 18792 8678 1 11 . 1 1 134 134 MET C C 134 178.277 178.277 178.209 0.068 18792 8679 1 11 . 1 1 134 134 MET CA C 134 59.578 59.578 59.216 0.362 18792 8680 1 11 . 1 1 134 134 MET CB C 134 33.559 33.559 32.571 0.988 18792 8681 1 11 . 1 1 134 134 MET H H 134 8.863 8.863 8.550 0.313 18792 8682 1 11 . 1 1 135 135 ALA N N 135 120.523 120.523 120.861 -0.338 18792 8683 1 11 . 1 1 135 135 ALA C C 135 179.298 179.298 179.421 -0.123 18792 8684 1 11 . 1 1 135 135 ALA CA C 135 55.433 55.433 54.987 0.445 18792 8685 1 11 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.044 -1.407 18792 8686 1 11 . 1 1 135 135 ALA H H 135 8.152 8.152 8.209 -0.057 18792 8687 1 11 . 1 1 136 136 THR N N 136 116.715 116.715 117.117 -0.402 18792 8688 1 11 . 1 1 136 136 THR C C 136 175.106 175.106 175.994 -0.888 18792 8689 1 11 . 1 1 136 136 THR CA C 136 66.729 66.729 67.627 -0.898 18792 8690 1 11 . 1 1 136 136 THR CB C 136 68.441 68.441 69.069 -0.628 18792 8691 1 11 . 1 1 136 136 THR H H 136 8.532 8.532 8.001 0.531 18792 8692 1 11 . 1 1 137 137 TYR N N 137 123.204 123.204 122.008 1.196 18792 8693 1 11 . 1 1 137 137 TYR C C 137 179.592 179.592 176.977 2.615 18792 8694 1 11 . 1 1 137 137 TYR CA C 137 63.065 63.065 60.472 2.592 18792 8695 1 11 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.998 -0.010 18792 8696 1 11 . 1 1 137 137 TYR H H 137 8.809 8.809 7.498 1.311 18792 8697 1 11 . 1 1 138 138 LEU N N 138 119.247 119.247 120.335 -1.088 18792 8698 1 11 . 1 1 138 138 LEU C C 138 178.385 178.385 177.851 0.534 18792 8699 1 11 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.118 0.820 18792 8700 1 11 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.936 -0.228 18792 8701 1 11 . 1 1 138 138 LEU H H 138 8.742 8.742 8.181 0.561 18792 8702 1 11 . 1 1 139 139 ASN N N 139 117.122 117.122 115.329 1.793 18792 8703 1 11 . 1 1 139 139 ASN C C 139 176.417 176.417 177.457 -1.040 18792 8704 1 11 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.445 1.003 18792 8705 1 11 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.039 0.613 18792 8706 1 11 . 1 1 139 139 ASN H H 139 8.307 8.307 7.839 0.468 18792 8707 1 11 . 1 1 140 140 ASP N N 140 115.394 115.394 118.928 -3.534 18792 8708 1 11 . 1 1 140 140 ASP C C 140 177.919 177.919 176.916 1.003 18792 8709 1 11 . 1 1 140 140 ASP CA C 140 55.953 55.953 57.025 -1.072 18792 8710 1 11 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.921 -1.535 18792 8711 1 11 . 1 1 140 140 ASP H H 140 8.439 8.439 7.489 0.950 18792 8712 1 11 . 1 1 141 141 HIS N N 141 111.695 111.695 113.578 -1.883 18792 8713 1 11 . 1 1 141 141 HIS C C 141 175.949 175.949 175.661 0.288 18792 8714 1 11 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.685 -0.629 18792 8715 1 11 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.406 -2.498 18792 8716 1 11 . 1 1 141 141 HIS H H 141 8.043 8.043 7.164 0.879 18792 8717 1 11 . 1 1 142 142 LEU N N 142 117.054 117.054 121.659 -4.605 18792 8718 1 11 . 1 1 142 142 LEU C C 142 176.530 176.530 177.666 -1.136 18792 8719 1 11 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.716 -2.407 18792 8720 1 11 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.395 0.943 18792 8721 1 11 . 1 1 142 142 LEU H H 142 7.198 7.198 7.582 -0.384 18792 8722 1 11 . 1 1 143 143 GLU N N 143 121.335 121.335 119.309 2.026 18792 8723 1 11 . 1 1 143 143 GLU C C 143 173.964 173.964 175.772 -1.808 18792 8724 1 11 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.535 -0.281 18792 8725 1 11 . 1 1 143 143 GLU CB C 143 26.257 26.257 27.596 -1.339 18792 8726 1 11 . 1 1 143 143 GLU H H 143 8.565 8.565 7.548 1.017 18792 8727 1 11 . 1 1 145 145 TRP N N 145 117.973 117.973 120.280 -2.307 18792 8728 1 11 . 1 1 145 145 TRP C C 145 179.526 179.526 177.565 1.961 18792 8729 1 11 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.487 1.119 18792 8730 1 11 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.350 -1.462 18792 8731 1 11 . 1 1 145 145 TRP H H 145 7.078 7.078 8.528 -1.450 18792 8732 1 11 . 1 1 146 146 ILE N N 146 122.101 122.101 111.584 10.517 18792 8733 1 11 . 1 1 146 146 ILE C C 146 179.110 179.110 177.313 1.797 18792 8734 1 11 . 1 1 146 146 ILE CA C 146 65.334 65.334 60.889 4.445 18792 8735 1 11 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.704 -0.882 18792 8736 1 11 . 1 1 146 146 ILE H H 146 8.389 8.389 7.552 0.837 18792 8737 1 11 . 1 1 147 147 GLN N N 147 116.344 116.344 120.889 -4.545 18792 8738 1 11 . 1 1 147 147 GLN C C 147 179.526 179.526 177.432 2.094 18792 8739 1 11 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.495 -0.482 18792 8740 1 11 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.797 -1.074 18792 8741 1 11 . 1 1 147 147 GLN H H 147 8.376 8.376 7.979 0.397 18792 8742 1 11 . 1 1 148 148 GLU N N 148 118.913 118.913 120.236 -1.323 18792 8743 1 11 . 1 1 148 148 GLU C C 148 176.880 176.880 178.107 -1.227 18792 8744 1 11 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.590 -3.216 18792 8745 1 11 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.676 -1.244 18792 8746 1 11 . 1 1 148 148 GLU H H 148 7.504 7.504 7.901 -0.397 18792 8747 1 11 . 1 1 149 149 ASN N N 149 116.616 116.616 113.714 2.902 18792 8748 1 11 . 1 1 149 149 ASN C C 149 173.964 173.964 177.278 -3.314 18792 8749 1 11 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.720 -0.474 18792 8750 1 11 . 1 1 149 149 ASN CB C 149 37.133 37.133 38.586 -1.453 18792 8751 1 11 . 1 1 149 149 ASN H H 149 7.070 7.070 8.200 -1.130 18792 8752 1 11 . 1 1 150 150 GLY N N 150 104.750 104.750 106.793 -2.043 18792 8753 1 11 . 1 1 150 150 GLY C C 150 176.022 176.022 174.151 1.871 18792 8754 1 11 . 1 1 150 150 GLY CA C 150 45.242 45.242 44.998 0.244 18792 8755 1 11 . 1 1 150 150 GLY H H 150 7.313 7.313 7.878 -0.565 18792 8756 1 11 . 1 1 151 151 GLY N N 151 108.385 108.385 107.753 0.632 18792 8757 1 11 . 1 1 151 151 GLY C C 151 173.449 173.449 175.052 -1.603 18792 8758 1 11 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.687 -0.655 18792 8759 1 11 . 1 1 151 151 GLY H H 151 8.452 8.452 7.223 1.229 18792 8760 1 11 . 1 1 152 152 TRP N N 152 118.092 118.092 121.396 -3.304 18792 8761 1 11 . 1 1 152 152 TRP C C 152 178.571 178.571 178.247 0.324 18792 8762 1 11 . 1 1 152 152 TRP CA C 152 60.077 60.077 59.533 0.543 18792 8763 1 11 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.857 -1.269 18792 8764 1 11 . 1 1 152 152 TRP H H 152 8.644 8.644 7.776 0.868 18792 8765 1 11 . 1 1 153 153 ASP N N 153 117.758 117.758 119.134 -1.376 18792 8766 1 11 . 1 1 153 153 ASP C C 153 179.796 179.796 178.630 1.166 18792 8767 1 11 . 1 1 153 153 ASP CA C 153 57.302 57.302 58.070 -0.768 18792 8768 1 11 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.558 -1.327 18792 8769 1 11 . 1 1 153 153 ASP H H 153 8.827 8.827 8.286 0.541 18792 8770 1 11 . 1 1 154 154 THR N N 154 116.817 116.817 116.723 0.094 18792 8771 1 11 . 1 1 154 154 THR C C 154 175.352 175.352 177.002 -1.650 18792 8772 1 11 . 1 1 154 154 THR CA C 154 65.910 65.910 66.375 -0.465 18792 8773 1 11 . 1 1 154 154 THR CB C 154 67.712 67.712 69.028 -1.316 18792 8774 1 11 . 1 1 154 154 THR H H 154 7.494 7.494 7.671 -0.177 18792 8775 1 11 . 1 1 155 155 PHE N N 155 122.196 122.196 121.679 0.517 18792 8776 1 11 . 1 1 155 155 PHE C C 155 176.831 176.831 177.722 -0.891 18792 8777 1 11 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.926 0.360 18792 8778 1 11 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.437 -1.770 18792 8779 1 11 . 1 1 155 155 PHE H H 155 6.477 6.477 8.310 -1.833 18792 8780 1 11 . 1 1 156 156 VAL N N 156 117.387 117.387 116.734 0.653 18792 8781 1 11 . 1 1 156 156 VAL C C 156 178.497 178.497 177.956 0.541 18792 8782 1 11 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.706 -0.475 18792 8783 1 11 . 1 1 156 156 VAL CB C 156 30.685 30.685 30.736 -0.051 18792 8784 1 11 . 1 1 156 156 VAL H H 156 7.788 7.788 8.988 -1.200 18792 8785 1 11 . 1 1 157 157 GLU N N 157 119.876 119.876 120.354 -0.478 18792 8786 1 11 . 1 1 157 157 GLU C C 157 178.399 178.399 179.230 -0.831 18792 8787 1 11 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.459 -0.700 18792 8788 1 11 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.617 -1.341 18792 8789 1 11 . 1 1 157 157 GLU H H 157 7.409 7.409 8.014 -0.605 18792 8790 1 11 . 1 1 158 158 LEU N N 158 117.194 117.194 121.072 -3.878 18792 8791 1 11 . 1 1 158 158 LEU C C 158 178.595 178.595 179.173 -0.578 18792 8792 1 11 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.940 -1.563 18792 8793 1 11 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.213 0.358 18792 8794 1 11 . 1 1 158 158 LEU H H 158 7.584 7.584 8.112 -0.528 18792 8795 1 11 . 1 1 159 159 TYR N N 159 115.549 115.549 119.008 -3.459 18792 8796 1 11 . 1 1 159 159 TYR C C 159 177.032 177.032 176.876 0.156 18792 8797 1 11 . 1 1 159 159 TYR CA C 159 59.116 59.116 60.033 -0.917 18792 8798 1 11 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.861 -1.262 18792 8799 1 11 . 1 1 159 159 TYR H H 159 8.099 8.099 8.360 -0.261 18792 8800 1 11 . 1 1 160 160 GLY N N 160 108.334 108.334 106.160 2.174 18792 8801 1 11 . 1 1 160 160 GLY C C 160 173.973 173.973 174.393 -0.420 18792 8802 1 11 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.918 0.146 18792 8803 1 11 . 1 1 160 160 GLY H H 160 8.020 8.020 8.056 -0.036 18792 8804 1 11 . 1 1 161 161 ASN N N 161 118.189 118.189 117.994 0.195 18792 8805 1 11 . 1 1 161 161 ASN C C 161 175.513 175.513 174.409 1.104 18792 8806 1 11 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.356 -1.252 18792 8807 1 11 . 1 1 161 161 ASN CB C 161 38.203 38.203 39.091 -0.888 18792 8808 1 11 . 1 1 161 161 ASN H H 161 8.327 8.327 7.454 0.873 18792 8809 1 11 . 1 1 162 162 ASN N N 162 119.022 119.022 118.356 0.666 18792 8810 1 11 . 1 1 162 162 ASN C C 162 175.690 175.690 174.061 1.629 18792 8811 1 11 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.053 0.371 18792 8812 1 11 . 1 1 162 162 ASN CB C 162 38.203 38.203 40.422 -2.219 18792 8813 1 11 . 1 1 162 162 ASN H H 162 8.363 8.363 8.580 -0.217 18792 8814 1 11 . 1 1 163 163 ALA N N 163 123.275 123.275 125.900 -2.625 18792 8815 1 11 . 1 1 163 163 ALA C C 163 178.598 178.598 178.683 -0.085 18792 8816 1 11 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.588 0.650 18792 8817 1 11 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.312 -1.702 18792 8818 1 11 . 1 1 163 163 ALA H H 163 8.103 8.103 8.534 -0.431 18792 8819 1 11 . 1 1 164 164 ALA N N 164 121.521 121.521 122.834 -1.313 18792 8820 1 11 . 1 1 164 164 ALA C C 164 178.642 178.642 178.157 0.485 18792 8821 1 11 . 1 1 164 164 ALA CA C 164 52.584 52.584 53.862 -1.278 18792 8822 1 11 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.118 -0.299 18792 8823 1 11 . 1 1 164 164 ALA H H 164 8.053 8.053 8.613 -0.560 18792 8824 1 11 . 1 1 165 165 ALA N N 165 122.101 122.101 119.666 2.435 18792 8825 1 11 . 1 1 165 165 ALA C C 165 179.124 179.124 178.114 1.010 18792 8826 1 11 . 1 1 165 165 ALA CA C 165 53.139 53.139 51.043 2.096 18792 8827 1 11 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.528 -0.550 18792 8828 1 11 . 1 1 165 165 ALA H H 165 7.949 7.949 8.213 -0.264 18792 8829 1 11 . 1 1 166 166 GLU N N 166 118.381 118.381 120.136 -1.755 18792 8830 1 11 . 1 1 166 166 GLU C C 166 177.664 177.664 177.550 0.114 18792 8831 1 11 . 1 1 166 166 GLU CA C 166 57.088 57.088 58.859 -1.772 18792 8832 1 11 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.543 -1.188 18792 8833 1 11 . 1 1 166 166 GLU H H 166 8.202 8.202 7.700 0.502 18792 8834 1 11 . 1 1 167 167 SER N N 167 115.193 115.193 113.569 1.624 18792 8835 1 11 . 1 1 167 167 SER C C 167 175.312 175.312 175.646 -0.334 18792 8836 1 11 . 1 1 167 167 SER CA C 167 58.831 58.831 60.429 -1.598 18792 8837 1 11 . 1 1 167 167 SER CB C 167 62.537 62.537 63.596 -1.059 18792 8838 1 11 . 1 1 167 167 SER H H 167 8.029 8.029 8.594 -0.565 18792 8839 1 11 . 1 1 168 168 ARG N N 168 121.696 121.696 115.620 6.076 18792 8840 1 11 . 1 1 168 168 ARG C C 168 176.880 176.880 175.342 1.538 18792 8841 1 11 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.520 -0.357 18792 8842 1 11 . 1 1 168 168 ARG CB C 168 29.209 29.209 30.877 -1.668 18792 8843 1 11 . 1 1 168 168 ARG H H 168 7.967 7.967 7.898 0.069 18792 8844 1 11 . 1 1 169 169 LYS N N 169 120.917 120.917 121.909 -0.992 18792 8845 1 11 . 1 1 169 169 LYS C C 169 177.640 177.640 174.993 2.647 18792 8846 1 11 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.523 0.174 18792 8847 1 11 . 1 1 169 169 LYS CB C 169 31.462 31.462 31.647 -0.185 18792 8848 1 11 . 1 1 169 169 LYS H H 169 8.011 8.011 8.309 -0.298 18792 8849 1 11 . 1 1 170 170 GLY N N 170 109.155 109.155 106.052 3.103 18792 8850 1 11 . 1 1 170 170 GLY C C 170 174.479 174.479 172.456 2.023 18792 8851 1 11 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.218 -0.154 18792 8852 1 11 . 1 1 170 170 GLY H H 170 8.329 8.329 7.788 0.541 18792 8853 1 11 . 1 1 171 171 GLN N N 171 119.292 119.292 119.623 -0.331 18792 8854 1 11 . 1 1 171 171 GLN C C 171 176.463 176.463 175.650 0.813 18792 8855 1 11 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.175 0.491 18792 8856 1 11 . 1 1 171 171 GLN CB C 171 28.199 28.199 30.117 -1.918 18792 8857 1 11 . 1 1 171 171 GLN H H 171 8.035 8.035 8.399 -0.364 18792 8858 1 11 . 1 1 172 172 GLU N N 172 121.703 121.703 121.695 0.008 18792 8859 1 11 . 1 1 172 172 GLU C C 172 176.414 176.414 175.909 0.505 18792 8860 1 11 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.735 0.606 18792 8861 1 11 . 1 1 172 172 GLU CB C 172 28.821 28.821 31.284 -2.463 18792 8862 1 11 . 1 1 172 172 GLU H H 172 8.405 8.405 8.672 -0.267 18792 8863 1 11 . 1 1 173 173 ARG N N 173 121.852 121.852 121.477 0.375 18792 8864 1 11 . 1 1 173 173 ARG C C 173 176.365 176.365 175.591 0.774 18792 8865 1 11 . 1 1 173 173 ARG CA C 173 56.199 56.199 56.273 -0.074 18792 8866 1 11 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.000 -1.869 18792 8867 1 11 . 1 1 173 173 ARG H H 173 8.335 8.335 8.480 -0.145 18792 8868 1 11 . 1 1 174 174 LEU N N 174 122.640 122.640 123.584 -0.944 18792 8869 1 11 . 1 1 174 174 LEU C C 174 176.523 176.523 176.501 0.022 18792 8870 1 11 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.352 -0.584 18792 8871 1 11 . 1 1 174 174 LEU CB C 174 40.784 40.784 42.679 -1.895 18792 8872 1 11 . 1 1 174 174 LEU H H 174 8.082 8.082 8.452 -0.370 18792 8873 1 11 . 1 1 175 175 GLU N N 175 125.909 125.909 118.348 7.561 18792 8874 1 11 . 1 1 175 175 GLU C C 175 181.029 181.029 175.130 5.899 18792 8875 1 11 . 1 1 175 175 GLU CA C 175 57.398 57.398 57.201 0.197 18792 8876 1 11 . 1 1 175 175 GLU CB C 175 30.050 30.050 29.999 0.051 18792 8877 1 11 . 1 1 175 175 GLU H H 175 7.785 7.785 8.179 -0.394 18792 8878 1 12 . 1 1 4 4 ALA N N 4 124.786 124.786 125.554 -0.768 18792 8879 1 12 . 1 1 4 4 ALA C C 4 178.272 178.272 178.362 -0.090 18792 8880 1 12 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.911 -2.345 18792 8881 1 12 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.753 -0.519 18792 8882 1 12 . 1 1 4 4 ALA H H 4 8.414 8.414 7.849 0.565 18792 8883 1 12 . 1 1 5 5 MET N N 5 119.681 119.681 115.513 4.168 18792 8884 1 12 . 1 1 5 5 MET C C 5 176.929 176.929 178.025 -1.096 18792 8885 1 12 . 1 1 5 5 MET CA C 5 55.594 55.594 57.058 -1.464 18792 8886 1 12 . 1 1 5 5 MET CB C 5 31.540 31.540 32.840 -1.300 18792 8887 1 12 . 1 1 5 5 MET H H 5 8.336 8.336 8.356 -0.020 18792 8888 1 12 . 1 1 6 6 SER N N 6 116.162 116.162 116.692 -0.530 18792 8889 1 12 . 1 1 6 6 SER C C 6 175.924 175.924 175.944 -0.020 18792 8890 1 12 . 1 1 6 6 SER CA C 6 59.009 59.009 61.164 -2.155 18792 8891 1 12 . 1 1 6 6 SER CB C 6 62.537 62.537 62.539 -0.002 18792 8892 1 12 . 1 1 6 6 SER H H 6 8.272 8.272 8.478 -0.206 18792 8893 1 12 . 1 1 7 7 GLN N N 7 122.263 122.263 121.549 0.714 18792 8894 1 12 . 1 1 7 7 GLN C C 7 177.027 177.027 178.195 -1.168 18792 8895 1 12 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.491 -2.221 18792 8896 1 12 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.075 -0.336 18792 8897 1 12 . 1 1 7 7 GLN H H 7 8.314 8.314 7.980 0.334 18792 8898 1 12 . 1 1 8 8 SER N N 8 116.625 116.625 114.774 1.851 18792 8899 1 12 . 1 1 8 8 SER C C 8 176.457 176.457 176.541 -0.084 18792 8900 1 12 . 1 1 8 8 SER CA C 8 59.650 59.650 61.614 -1.964 18792 8901 1 12 . 1 1 8 8 SER CB C 8 62.226 62.226 63.099 -0.873 18792 8902 1 12 . 1 1 8 8 SER H H 8 8.333 8.333 8.410 -0.077 18792 8903 1 12 . 1 1 9 9 ASN N N 9 121.307 121.307 119.887 1.420 18792 8904 1 12 . 1 1 9 9 ASN C C 9 177.419 177.419 177.486 -0.067 18792 8905 1 12 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.034 -0.547 18792 8906 1 12 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.727 -1.594 18792 8907 1 12 . 1 1 9 9 ASN H H 9 8.611 8.611 8.060 0.551 18792 8908 1 12 . 1 1 10 10 ARG N N 10 119.830 119.830 120.374 -0.544 18792 8909 1 12 . 1 1 10 10 ARG C C 10 177.615 177.615 178.636 -1.021 18792 8910 1 12 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.437 -0.179 18792 8911 1 12 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.302 -2.103 18792 8912 1 12 . 1 1 10 10 ARG H H 10 7.996 7.996 8.636 -0.640 18792 8913 1 12 . 1 1 11 11 GLU N N 11 117.270 117.270 120.059 -2.789 18792 8914 1 12 . 1 1 11 11 GLU C C 11 179.649 179.649 178.627 1.022 18792 8915 1 12 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.285 -0.276 18792 8916 1 12 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.415 -1.294 18792 8917 1 12 . 1 1 11 11 GLU H H 11 7.885 7.885 8.403 -0.518 18792 8918 1 12 . 1 1 12 12 LEU N N 12 119.900 119.900 121.040 -1.140 18792 8919 1 12 . 1 1 12 12 LEU C C 12 178.473 178.473 179.226 -0.753 18792 8920 1 12 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.123 -0.430 18792 8921 1 12 . 1 1 12 12 LEU CB C 12 40.629 40.629 42.146 -1.517 18792 8922 1 12 . 1 1 12 12 LEU H H 12 7.691 7.691 8.126 -0.435 18792 8923 1 12 . 1 1 13 13 VAL N N 13 117.320 117.320 118.636 -1.316 18792 8924 1 12 . 1 1 13 13 VAL C C 13 177.272 177.272 177.821 -0.549 18792 8925 1 12 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.607 0.549 18792 8926 1 12 . 1 1 13 13 VAL CB C 13 31.229 31.229 32.007 -0.778 18792 8927 1 12 . 1 1 13 13 VAL H H 13 7.629 7.629 7.676 -0.047 18792 8928 1 12 . 1 1 14 14 VAL N N 14 116.659 116.659 120.186 -3.527 18792 8929 1 12 . 1 1 14 14 VAL C C 14 178.718 178.718 178.040 0.678 18792 8930 1 12 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.238 0.278 18792 8931 1 12 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.608 -1.234 18792 8932 1 12 . 1 1 14 14 VAL H H 14 8.210 8.210 7.584 0.626 18792 8933 1 12 . 1 1 15 15 ASP N N 15 120.374 120.374 120.845 -0.471 18792 8934 1 12 . 1 1 15 15 ASP C C 15 177.557 177.557 178.198 -0.641 18792 8935 1 12 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.135 1.341 18792 8936 1 12 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.689 1.864 18792 8937 1 12 . 1 1 15 15 ASP H H 15 7.967 7.967 8.919 -0.952 18792 8938 1 12 . 1 1 16 16 PHE N N 16 119.864 119.864 122.014 -2.150 18792 8939 1 12 . 1 1 16 16 PHE C C 16 178.252 178.252 176.835 1.417 18792 8940 1 12 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.581 2.199 18792 8941 1 12 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.915 0.145 18792 8942 1 12 . 1 1 16 16 PHE H H 16 8.228 8.228 8.142 0.086 18792 8943 1 12 . 1 1 17 17 LEU N N 17 116.312 116.312 117.901 -1.589 18792 8944 1 12 . 1 1 17 17 LEU C C 17 179.649 179.649 178.405 1.244 18792 8945 1 12 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.594 -0.830 18792 8946 1 12 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.250 -1.165 18792 8947 1 12 . 1 1 17 17 LEU H H 17 8.766 8.766 7.813 0.953 18792 8948 1 12 . 1 1 18 18 SER N N 18 113.715 113.715 115.529 -1.814 18792 8949 1 12 . 1 1 18 18 SER C C 18 177.362 177.362 176.511 0.851 18792 8950 1 12 . 1 1 18 18 SER CA C 18 61.948 61.948 61.600 0.348 18792 8951 1 12 . 1 1 18 18 SER CB C 18 63.003 63.003 63.421 -0.418 18792 8952 1 12 . 1 1 18 18 SER H H 18 8.384 8.384 7.920 0.464 18792 8953 1 12 . 1 1 19 19 TYR N N 19 124.570 124.570 122.806 1.764 18792 8954 1 12 . 1 1 19 19 TYR C C 19 178.415 178.415 177.209 1.206 18792 8955 1 12 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.058 -1.294 18792 8956 1 12 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.733 -1.717 18792 8957 1 12 . 1 1 19 19 TYR H H 19 8.155 8.155 8.886 -0.731 18792 8958 1 12 . 1 1 20 20 LYS N N 20 119.739 119.739 120.454 -0.715 18792 8959 1 12 . 1 1 20 20 LYS C C 20 180.456 180.456 179.093 1.363 18792 8960 1 12 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.122 -2.634 18792 8961 1 12 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.169 -4.010 18792 8962 1 12 . 1 1 20 20 LYS H H 20 8.224 8.224 7.871 0.353 18792 8963 1 12 . 1 1 21 21 LEU N N 21 118.092 118.092 120.569 -2.477 18792 8964 1 12 . 1 1 21 21 LEU C C 21 179.989 179.989 178.385 1.604 18792 8965 1 12 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.231 -0.105 18792 8966 1 12 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.776 -2.168 18792 8967 1 12 . 1 1 21 21 LEU H H 21 8.586 8.586 7.977 0.609 18792 8968 1 12 . 1 1 22 22 SER N N 22 117.304 117.304 113.241 4.063 18792 8969 1 12 . 1 1 22 22 SER C C 22 180.152 180.152 177.141 3.011 18792 8970 1 12 . 1 1 22 22 SER CA C 22 61.287 61.287 61.535 -0.249 18792 8971 1 12 . 1 1 22 22 SER H H 22 8.266 8.266 7.462 0.804 18792 8972 1 12 . 1 1 23 23 GLN N N 23 122.497 122.497 120.112 2.385 18792 8973 1 12 . 1 1 23 23 GLN C C 23 177.297 177.297 177.472 -0.175 18792 8974 1 12 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.123 -0.181 18792 8975 1 12 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.288 -0.477 18792 8976 1 12 . 1 1 23 23 GLN H H 23 7.571 7.571 8.154 -0.583 18792 8977 1 12 . 1 1 24 24 LYS N N 24 116.038 116.038 118.215 -2.177 18792 8978 1 12 . 1 1 24 24 LYS C C 24 175.704 175.704 176.864 -1.160 18792 8979 1 12 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.612 -3.118 18792 8980 1 12 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.445 -2.216 18792 8981 1 12 . 1 1 24 24 LYS H H 24 7.134 7.134 7.660 -0.526 18792 8982 1 12 . 1 1 25 25 GLY N N 25 105.283 105.283 105.812 -0.529 18792 8983 1 12 . 1 1 25 25 GLY C C 25 174.013 174.013 173.154 0.859 18792 8984 1 12 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.606 0.173 18792 8985 1 12 . 1 1 25 25 GLY H H 25 7.483 7.483 7.916 -0.433 18792 8986 1 12 . 1 1 26 26 TYR N N 26 119.547 119.547 119.370 0.177 18792 8987 1 12 . 1 1 26 26 TYR C C 26 175.122 175.122 173.722 1.400 18792 8988 1 12 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.864 -1.732 18792 8989 1 12 . 1 1 26 26 TYR CB C 26 40.080 40.080 40.341 -0.261 18792 8990 1 12 . 1 1 26 26 TYR H H 26 7.788 7.788 7.627 0.161 18792 8991 1 12 . 1 1 27 27 SER N N 27 115.088 115.088 115.975 -0.887 18792 8992 1 12 . 1 1 27 27 SER C C 27 174.452 174.452 175.573 -1.121 18792 8993 1 12 . 1 1 27 27 SER CA C 27 56.306 56.306 56.064 0.242 18792 8994 1 12 . 1 1 27 27 SER CB C 27 63.921 63.921 65.015 -1.094 18792 8995 1 12 . 1 1 27 27 SER H H 27 8.473 8.473 8.175 0.298 18792 8996 1 12 . 1 1 28 28 TRP N N 28 127.014 127.014 124.065 2.949 18792 8997 1 12 . 1 1 28 28 TRP C C 28 177.002 177.002 178.507 -1.505 18792 8998 1 12 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.597 -0.126 18792 8999 1 12 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.728 0.102 18792 9000 1 12 . 1 1 28 28 TRP H H 28 8.897 8.897 8.588 0.309 18792 9001 1 12 . 1 1 29 29 SER N N 29 112.044 112.044 112.781 -0.737 18792 9002 1 12 . 1 1 29 29 SER C C 29 175.106 175.106 177.128 -2.022 18792 9003 1 12 . 1 1 29 29 SER CA C 29 59.472 59.472 59.782 -0.310 18792 9004 1 12 . 1 1 29 29 SER CB C 29 62.226 62.226 62.758 -0.532 18792 9005 1 12 . 1 1 29 29 SER H H 29 8.129 8.129 8.148 -0.019 18792 9006 1 12 . 1 1 30 30 GLN N N 30 119.160 119.160 122.815 -3.655 18792 9007 1 12 . 1 1 30 30 GLN C C 30 176.218 176.218 177.622 -1.404 18792 9008 1 12 . 1 1 30 30 GLN CA C 30 56.412 56.412 58.657 -2.245 18792 9009 1 12 . 1 1 30 30 GLN CB C 30 27.578 27.578 29.109 -1.531 18792 9010 1 12 . 1 1 30 30 GLN H H 30 7.370 7.370 7.860 -0.490 18792 9011 1 12 . 1 1 31 31 PHE N N 31 116.277 116.277 118.230 -1.953 18792 9012 1 12 . 1 1 31 31 PHE C C 31 175.217 175.217 174.418 0.799 18792 9013 1 12 . 1 1 31 31 PHE CA C 31 56.234 56.234 56.102 0.132 18792 9014 1 12 . 1 1 31 31 PHE CB C 31 39.066 39.066 39.801 -0.735 18792 9015 1 12 . 1 1 31 31 PHE H H 31 7.248 7.248 8.416 -1.168 18792 9016 1 12 . 1 1 32 32 SER N N 32 113.683 113.683 116.278 -2.595 18792 9017 1 12 . 1 1 32 32 SER C C 32 173.793 173.793 174.913 -1.120 18792 9018 1 12 . 1 1 32 32 SER CA C 32 57.124 57.124 60.365 -3.241 18792 9019 1 12 . 1 1 32 32 SER CB C 32 63.081 63.081 63.998 -0.917 18792 9020 1 12 . 1 1 32 32 SER H H 32 7.242 7.242 7.371 -0.129 18792 9021 1 12 . 1 1 33 33 ASP N N 33 122.195 122.195 118.105 4.090 18792 9022 1 12 . 1 1 33 33 ASP C C 33 176.394 176.394 174.961 1.433 18792 9023 1 12 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.730 -1.982 18792 9024 1 12 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.455 -0.057 18792 9025 1 12 . 1 1 33 33 ASP H H 33 8.257 8.257 8.824 -0.567 18792 9026 1 12 . 1 1 34 34 VAL N N 34 118.913 118.913 115.539 3.374 18792 9027 1 12 . 1 1 34 34 VAL C C 34 176.328 176.328 175.707 0.621 18792 9028 1 12 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.740 -0.849 18792 9029 1 12 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.211 -0.196 18792 9030 1 12 . 1 1 34 34 VAL H H 34 7.852 7.852 7.338 0.514 18792 9031 1 12 . 1 1 35 35 GLU N N 35 124.205 124.205 121.353 2.852 18792 9032 1 12 . 1 1 35 35 GLU C C 35 176.586 176.586 175.949 0.637 18792 9033 1 12 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.715 -1.658 18792 9034 1 12 . 1 1 35 35 GLU CB C 35 28.898 28.898 30.623 -1.725 18792 9035 1 12 . 1 1 35 35 GLU H H 35 8.401 8.401 7.417 0.984 18792 9036 1 12 . 1 1 36 36 GLU N N 36 121.670 121.670 117.712 3.958 18792 9037 1 12 . 1 1 36 36 GLU C C 36 176.218 176.218 174.390 1.828 18792 9038 1 12 . 1 1 36 36 GLU CA C 36 55.988 55.988 57.280 -1.292 18792 9039 1 12 . 1 1 36 36 GLU CB C 36 29.442 29.442 28.603 0.839 18792 9040 1 12 . 1 1 36 36 GLU H H 36 8.239 8.239 8.325 -0.086 18792 9041 1 12 . 1 1 37 37 ASN N N 37 119.252 119.252 121.127 -1.875 18792 9042 1 12 . 1 1 37 37 ASN C C 37 175.003 175.003 173.934 1.069 18792 9043 1 12 . 1 1 37 37 ASN CA C 37 52.655 52.655 52.722 -0.067 18792 9044 1 12 . 1 1 37 37 ASN CB C 37 38.212 38.212 40.027 -1.815 18792 9045 1 12 . 1 1 37 37 ASN H H 37 8.412 8.412 8.528 -0.116 18792 9046 1 12 . 1 1 38 38 ARG N N 38 121.622 121.622 123.683 -2.061 18792 9047 1 12 . 1 1 38 38 ARG C C 38 176.610 176.610 174.750 1.860 18792 9048 1 12 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.702 -1.338 18792 9049 1 12 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.858 -2.439 18792 9050 1 12 . 1 1 38 38 ARG H H 38 8.227 8.227 8.617 -0.390 18792 9051 1 12 . 1 1 39 39 THR N N 39 115.681 115.681 116.151 -0.470 18792 9052 1 12 . 1 1 39 39 THR C C 39 174.500 174.500 174.489 0.011 18792 9053 1 12 . 1 1 39 39 THR CA C 39 61.606 61.606 62.409 -0.803 18792 9054 1 12 . 1 1 39 39 THR CB C 39 69.163 69.163 69.004 0.159 18792 9055 1 12 . 1 1 39 39 THR H H 39 8.173 8.173 8.505 -0.332 18792 9056 1 12 . 1 1 40 40 GLU N N 40 122.708 122.708 121.063 1.645 18792 9057 1 12 . 1 1 40 40 GLU C C 40 175.728 175.728 175.062 0.666 18792 9058 1 12 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.746 -0.974 18792 9059 1 12 . 1 1 40 40 GLU CB C 40 29.054 29.054 30.478 -1.424 18792 9060 1 12 . 1 1 40 40 GLU H H 40 8.298 8.298 8.327 -0.029 18792 9061 1 12 . 1 1 41 41 ALA N N 41 125.922 125.922 124.971 0.951 18792 9062 1 12 . 1 1 41 41 ALA C C 41 175.557 175.557 175.887 -0.330 18792 9063 1 12 . 1 1 41 41 ALA CA C 41 49.973 49.973 52.013 -2.040 18792 9064 1 12 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.541 -0.296 18792 9065 1 12 . 1 1 41 41 ALA H H 41 8.212 8.212 8.096 0.116 18792 9066 1 12 . 1 1 43 43 GLU N N 43 120.783 120.783 120.428 0.355 18792 9067 1 12 . 1 1 43 43 GLU C C 43 177.174 177.174 176.828 0.346 18792 9068 1 12 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.956 -0.615 18792 9069 1 12 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.607 -1.320 18792 9070 1 12 . 1 1 43 43 GLU H H 43 8.519 8.519 8.594 -0.075 18792 9071 1 12 . 1 1 44 44 GLY N N 44 110.022 110.022 108.289 1.733 18792 9072 1 12 . 1 1 44 44 GLY C C 44 174.773 174.773 175.162 -0.389 18792 9073 1 12 . 1 1 44 44 GLY CA C 44 45.028 45.028 44.757 0.271 18792 9074 1 12 . 1 1 44 44 GLY H H 44 8.429 8.429 8.230 0.199 18792 9075 1 12 . 1 1 45 45 THR N N 45 112.790 112.790 112.164 0.626 18792 9076 1 12 . 1 1 45 45 THR C C 45 175.726 175.726 175.716 0.010 18792 9077 1 12 . 1 1 45 45 THR CA C 45 61.987 61.987 62.884 -0.897 18792 9078 1 12 . 1 1 45 45 THR CB C 45 69.304 69.304 69.198 0.106 18792 9079 1 12 . 1 1 45 45 THR H H 45 8.125 8.125 8.343 -0.218 18792 9080 1 12 . 1 1 46 46 GLU N N 46 122.752 122.752 120.885 1.867 18792 9081 1 12 . 1 1 46 46 GLU C C 46 177.419 177.419 175.182 2.237 18792 9082 1 12 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.059 1.172 18792 9083 1 12 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.701 -1.502 18792 9084 1 12 . 1 1 46 46 GLU H H 46 8.765 8.765 8.655 0.110 18792 9085 1 12 . 1 1 47 47 SER N N 47 114.895 114.895 112.380 2.515 18792 9086 1 12 . 1 1 47 47 SER C C 47 175.826 175.826 174.836 0.990 18792 9087 1 12 . 1 1 47 47 SER CA C 47 58.582 58.582 57.991 0.591 18792 9088 1 12 . 1 1 47 47 SER CB C 47 62.537 62.537 64.318 -1.781 18792 9089 1 12 . 1 1 47 47 SER H H 47 8.355 8.355 7.903 0.452 18792 9090 1 12 . 1 1 48 48 GLU N N 48 122.429 122.429 123.245 -0.816 18792 9091 1 12 . 1 1 48 48 GLU C C 48 178.099 178.099 177.666 0.433 18792 9092 1 12 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.152 -0.534 18792 9093 1 12 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.667 -1.192 18792 9094 1 12 . 1 1 48 48 GLU H H 48 8.139 8.139 8.819 -0.680 18792 9095 1 12 . 1 1 49 49 ALA N N 49 120.374 120.374 121.542 -1.168 18792 9096 1 12 . 1 1 49 49 ALA C C 49 180.843 180.843 179.076 1.767 18792 9097 1 12 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.151 -0.668 18792 9098 1 12 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.429 -0.994 18792 9099 1 12 . 1 1 49 49 ALA H H 49 8.079 8.079 7.836 0.243 18792 9100 1 12 . 1 1 50 50 VAL N N 50 118.599 118.599 116.541 2.058 18792 9101 1 12 . 1 1 50 50 VAL C C 50 176.921 176.921 177.307 -0.386 18792 9102 1 12 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.391 0.169 18792 9103 1 12 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.282 0.015 18792 9104 1 12 . 1 1 50 50 VAL H H 50 7.419 7.419 7.545 -0.126 18792 9105 1 12 . 1 1 51 51 LYS N N 51 117.469 117.469 120.730 -3.261 18792 9106 1 12 . 1 1 51 51 LYS C C 51 179.061 179.061 178.947 0.114 18792 9107 1 12 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.753 -0.530 18792 9108 1 12 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.898 -0.902 18792 9109 1 12 . 1 1 51 51 LYS H H 51 7.359 7.359 7.870 -0.511 18792 9110 1 12 . 1 1 52 52 GLN N N 52 115.930 115.930 118.702 -2.772 18792 9111 1 12 . 1 1 52 52 GLN C C 52 177.713 177.713 177.997 -0.284 18792 9112 1 12 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.870 -0.394 18792 9113 1 12 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.489 -1.921 18792 9114 1 12 . 1 1 52 52 GLN H H 52 8.025 8.025 8.013 0.012 18792 9115 1 12 . 1 1 53 53 ALA N N 53 119.782 119.782 122.595 -2.813 18792 9116 1 12 . 1 1 53 53 ALA C C 53 180.008 180.008 179.188 0.820 18792 9117 1 12 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.779 -0.394 18792 9118 1 12 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.639 -1.124 18792 9119 1 12 . 1 1 53 53 ALA H H 53 7.655 7.655 8.007 -0.352 18792 9120 1 12 . 1 1 54 54 LEU N N 54 120.443 120.443 119.631 0.812 18792 9121 1 12 . 1 1 54 54 LEU C C 54 179.330 179.330 177.857 1.473 18792 9122 1 12 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.890 1.123 18792 9123 1 12 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.106 -0.244 18792 9124 1 12 . 1 1 54 54 LEU H H 54 8.419 8.419 7.808 0.611 18792 9125 1 12 . 1 1 55 55 ARG N N 55 118.423 118.423 119.320 -0.897 18792 9126 1 12 . 1 1 55 55 ARG C C 55 178.767 178.767 178.111 0.656 18792 9127 1 12 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.257 1.140 18792 9128 1 12 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.730 -0.987 18792 9129 1 12 . 1 1 55 55 ARG H H 55 8.062 8.062 7.767 0.295 18792 9130 1 12 . 1 1 56 56 GLU N N 56 115.988 115.988 118.845 -2.857 18792 9131 1 12 . 1 1 56 56 GLU C C 56 180.090 180.090 178.362 1.728 18792 9132 1 12 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.365 -0.605 18792 9133 1 12 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.488 -1.133 18792 9134 1 12 . 1 1 56 56 GLU H H 56 7.772 7.772 8.423 -0.651 18792 9135 1 12 . 1 1 57 57 ALA N N 57 122.837 122.837 120.703 2.134 18792 9136 1 12 . 1 1 57 57 ALA C C 57 181.861 181.861 179.853 2.008 18792 9137 1 12 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.671 -0.037 18792 9138 1 12 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.328 0.145 18792 9139 1 12 . 1 1 57 57 ALA H H 57 8.774 8.774 7.880 0.894 18792 9140 1 12 . 1 1 58 58 GLY N N 58 108.409 108.409 106.237 2.172 18792 9141 1 12 . 1 1 58 58 GLY C C 58 175.331 175.331 175.832 -0.501 18792 9142 1 12 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.571 0.097 18792 9143 1 12 . 1 1 58 58 GLY H H 58 9.073 9.073 8.263 0.810 18792 9144 1 12 . 1 1 59 59 ASP N N 59 122.074 122.074 121.903 0.171 18792 9145 1 12 . 1 1 59 59 ASP C C 59 179.023 179.023 178.315 0.708 18792 9146 1 12 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.658 -0.357 18792 9147 1 12 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.279 -2.437 18792 9148 1 12 . 1 1 59 59 ASP H H 59 8.049 8.049 8.081 -0.032 18792 9149 1 12 . 1 1 60 60 GLU N N 60 120.131 120.131 119.998 0.133 18792 9150 1 12 . 1 1 60 60 GLU C C 60 178.522 178.522 179.249 -0.727 18792 9151 1 12 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.304 -0.295 18792 9152 1 12 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.832 -1.633 18792 9153 1 12 . 1 1 60 60 GLU H H 60 8.136 8.136 7.983 0.153 18792 9154 1 12 . 1 1 61 61 PHE N N 61 121.309 121.309 119.243 2.066 18792 9155 1 12 . 1 1 61 61 PHE C C 61 176.904 176.904 178.465 -1.561 18792 9156 1 12 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.110 0.212 18792 9157 1 12 . 1 1 61 61 PHE CB C 61 38.609 38.609 38.997 -0.388 18792 9158 1 12 . 1 1 61 61 PHE H H 61 8.523 8.523 8.396 0.127 18792 9159 1 12 . 1 1 62 62 GLU N N 62 115.971 115.971 119.945 -3.974 18792 9160 1 12 . 1 1 62 62 GLU C C 62 177.713 177.713 178.824 -1.111 18792 9161 1 12 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.374 -1.183 18792 9162 1 12 . 1 1 62 62 GLU CB C 62 28.277 28.277 30.010 -1.733 18792 9163 1 12 . 1 1 62 62 GLU H H 62 7.969 7.969 8.239 -0.270 18792 9164 1 12 . 1 1 63 63 LEU N N 63 116.703 116.703 120.447 -3.744 18792 9165 1 12 . 1 1 63 63 LEU C C 63 178.963 178.963 178.702 0.261 18792 9166 1 12 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.159 -0.747 18792 9167 1 12 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.424 -1.018 18792 9168 1 12 . 1 1 63 63 LEU H H 63 7.347 7.347 8.127 -0.780 18792 9169 1 12 . 1 1 64 64 ARG N N 64 117.453 117.453 117.146 0.307 18792 9170 1 12 . 1 1 64 64 ARG C C 64 177.297 177.297 175.975 1.322 18792 9171 1 12 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.701 0.636 18792 9172 1 12 . 1 1 64 64 ARG CB C 64 29.597 29.597 32.043 -2.446 18792 9173 1 12 . 1 1 64 64 ARG H H 64 7.995 7.995 8.109 -0.114 18792 9174 1 12 . 1 1 65 65 TYR N N 65 118.956 118.956 118.406 0.550 18792 9175 1 12 . 1 1 65 65 TYR C C 65 175.278 175.278 174.433 0.845 18792 9176 1 12 . 1 1 65 65 TYR CA C 65 55.701 55.701 57.357 -1.656 18792 9177 1 12 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.410 -3.424 18792 9178 1 12 . 1 1 65 65 TYR H H 65 7.909 7.909 7.727 0.182 18792 9179 1 12 . 1 1 66 66 ARG N N 66 119.438 119.438 120.796 -1.358 18792 9180 1 12 . 1 1 66 66 ARG C C 66 178.424 178.424 177.081 1.343 18792 9181 1 12 . 1 1 66 66 ARG CA C 66 58.476 58.476 56.464 2.012 18792 9182 1 12 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.247 -1.427 18792 9183 1 12 . 1 1 66 66 ARG H H 66 7.244 7.244 8.524 -1.280 18792 9184 1 12 . 1 1 67 67 ARG N N 67 118.936 118.936 119.375 -0.439 18792 9185 1 12 . 1 1 67 67 ARG C C 67 177.542 177.542 177.627 -0.085 18792 9186 1 12 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.364 -1.920 18792 9187 1 12 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.779 -1.658 18792 9188 1 12 . 1 1 67 67 ARG H H 67 8.417 8.417 8.063 0.354 18792 9189 1 12 . 1 1 68 68 ALA N N 68 121.797 121.797 121.495 0.302 18792 9190 1 12 . 1 1 68 68 ALA C C 68 180.337 180.337 178.653 1.684 18792 9191 1 12 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.179 -0.043 18792 9192 1 12 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.194 -0.727 18792 9193 1 12 . 1 1 68 68 ALA H H 68 7.827 7.827 8.212 -0.385 18792 9194 1 12 . 1 1 69 69 PHE N N 69 115.986 115.986 119.222 -3.236 18792 9195 1 12 . 1 1 69 69 PHE C C 69 177.468 177.468 176.972 0.496 18792 9196 1 12 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.313 -1.264 18792 9197 1 12 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.560 -0.961 18792 9198 1 12 . 1 1 69 69 PHE H H 69 8.517 8.517 8.458 0.059 18792 9199 1 12 . 1 1 70 70 SER N N 70 116.526 116.526 114.485 2.041 18792 9200 1 12 . 1 1 70 70 SER C C 70 177.640 177.640 176.367 1.273 18792 9201 1 12 . 1 1 70 70 SER CA C 70 61.073 61.073 61.272 -0.198 18792 9202 1 12 . 1 1 70 70 SER CB C 70 61.993 61.993 62.907 -0.914 18792 9203 1 12 . 1 1 70 70 SER H H 70 8.152 8.152 7.681 0.471 18792 9204 1 12 . 1 1 71 71 ASP N N 71 121.181 121.181 122.639 -1.458 18792 9205 1 12 . 1 1 71 71 ASP C C 71 178.546 178.546 178.613 -0.067 18792 9206 1 12 . 1 1 71 71 ASP CA C 71 56.448 56.448 56.877 -0.429 18792 9207 1 12 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.387 -1.156 18792 9208 1 12 . 1 1 71 71 ASP H H 71 8.356 8.356 7.635 0.721 18792 9209 1 12 . 1 1 72 72 LEU N N 72 120.747 120.747 120.856 -0.109 18792 9210 1 12 . 1 1 72 72 LEU C C 72 178.963 178.963 178.501 0.462 18792 9211 1 12 . 1 1 72 72 LEU CA C 72 57.444 57.444 57.993 -0.549 18792 9212 1 12 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.227 -1.210 18792 9213 1 12 . 1 1 72 72 LEU H H 72 7.738 7.738 8.559 -0.821 18792 9214 1 12 . 1 1 73 73 THR N N 73 109.432 109.432 113.444 -4.012 18792 9215 1 12 . 1 1 73 73 THR C C 73 177.481 177.481 176.386 1.095 18792 9216 1 12 . 1 1 73 73 THR CA C 73 65.128 65.128 66.094 -0.966 18792 9217 1 12 . 1 1 73 73 THR CB C 73 67.720 67.720 68.264 -0.544 18792 9218 1 12 . 1 1 73 73 THR H H 73 8.296 8.296 7.508 0.788 18792 9219 1 12 . 1 1 74 74 SER N N 74 115.862 115.862 115.186 0.676 18792 9220 1 12 . 1 1 74 74 SER C C 74 175.361 175.361 176.371 -1.010 18792 9221 1 12 . 1 1 74 74 SER CA C 74 60.112 60.112 60.485 -0.373 18792 9222 1 12 . 1 1 74 74 SER CB C 74 62.537 62.537 62.734 -0.197 18792 9223 1 12 . 1 1 74 74 SER H H 74 7.629 7.629 8.478 -0.849 18792 9224 1 12 . 1 1 75 75 GLN N N 75 118.551 118.551 119.282 -0.731 18792 9225 1 12 . 1 1 75 75 GLN C C 75 176.316 176.316 177.193 -0.877 18792 9226 1 12 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.696 -0.891 18792 9227 1 12 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.790 -1.513 18792 9228 1 12 . 1 1 75 75 GLN H H 75 7.640 7.640 7.848 -0.208 18792 9229 1 12 . 1 1 76 76 LEU N N 76 118.313 118.313 120.217 -1.904 18792 9230 1 12 . 1 1 76 76 LEU C C 76 174.160 174.160 175.626 -1.466 18792 9231 1 12 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.334 -0.594 18792 9232 1 12 . 1 1 76 76 LEU CB C 76 42.727 42.727 43.536 -0.809 18792 9233 1 12 . 1 1 76 76 LEU H H 76 7.411 7.411 7.508 -0.097 18792 9234 1 12 . 1 1 77 77 HIS N N 77 120.104 120.104 113.187 6.917 18792 9235 1 12 . 1 1 77 77 HIS C C 77 174.528 174.528 174.795 -0.267 18792 9236 1 12 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.838 -1.631 18792 9237 1 12 . 1 1 77 77 HIS CB C 77 27.966 27.966 26.314 1.652 18792 9238 1 12 . 1 1 77 77 HIS H H 77 8.117 8.117 8.125 -0.008 18792 9239 1 12 . 1 1 78 78 ILE N N 78 122.298 122.298 120.018 2.280 18792 9240 1 12 . 1 1 78 78 ILE C C 78 174.240 174.240 176.240 -2.000 18792 9241 1 12 . 1 1 78 78 ILE CA C 78 61.402 61.402 63.354 -1.952 18792 9242 1 12 . 1 1 78 78 ILE CB C 78 37.591 37.591 37.968 -0.377 18792 9243 1 12 . 1 1 78 78 ILE H H 78 8.655 8.655 7.736 0.919 18792 9244 1 12 . 1 1 79 79 THR N N 79 116.442 116.442 117.296 -0.854 18792 9245 1 12 . 1 1 79 79 THR C C 79 174.291 174.291 173.174 1.117 18792 9246 1 12 . 1 1 79 79 THR CA C 79 61.632 61.632 62.059 -0.427 18792 9247 1 12 . 1 1 79 79 THR CB C 79 68.704 68.704 68.421 0.283 18792 9248 1 12 . 1 1 79 79 THR H H 79 8.245 8.245 8.523 -0.278 18792 9249 1 12 . 1 1 84 84 TYR N N 84 120.888 120.888 121.445 -0.557 18792 9250 1 12 . 1 1 84 84 TYR C C 84 176.708 176.708 177.065 -0.357 18792 9251 1 12 . 1 1 84 84 TYR CA C 84 60.432 60.432 59.898 0.534 18792 9252 1 12 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.801 -1.056 18792 9253 1 12 . 1 1 84 84 TYR H H 84 8.733 8.733 8.447 0.286 18792 9254 1 12 . 1 1 85 85 GLN N N 85 114.530 114.530 118.187 -3.657 18792 9255 1 12 . 1 1 85 85 GLN C C 85 178.473 178.473 178.506 -0.033 18792 9256 1 12 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.641 -0.346 18792 9257 1 12 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.981 -1.180 18792 9258 1 12 . 1 1 85 85 GLN H H 85 8.413 8.413 8.593 -0.180 18792 9259 1 12 . 1 1 86 86 SER N N 86 114.032 114.032 116.159 -2.127 18792 9260 1 12 . 1 1 86 86 SER C C 86 178.473 178.473 176.348 2.125 18792 9261 1 12 . 1 1 86 86 SER CA C 86 62.175 62.175 61.775 0.400 18792 9262 1 12 . 1 1 86 86 SER CB C 86 63.252 63.252 62.987 0.265 18792 9263 1 12 . 1 1 86 86 SER H H 86 7.258 7.258 7.706 -0.448 18792 9264 1 12 . 1 1 88 88 GLU N N 88 119.386 119.386 118.510 0.876 18792 9265 1 12 . 1 1 88 88 GLU C C 88 177.199 177.199 178.867 -1.668 18792 9266 1 12 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.490 -0.908 18792 9267 1 12 . 1 1 88 88 GLU CB C 88 28.976 28.976 28.885 0.091 18792 9268 1 12 . 1 1 88 88 GLU H H 88 8.534 8.534 7.907 0.627 18792 9269 1 12 . 1 1 89 89 GLN N N 89 114.678 114.678 119.942 -5.264 18792 9270 1 12 . 1 1 89 89 GLN C C 89 178.669 178.669 178.423 0.246 18792 9271 1 12 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.986 -0.404 18792 9272 1 12 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.913 -1.491 18792 9273 1 12 . 1 1 89 89 GLN H H 89 7.500 7.500 7.464 0.036 18792 9274 1 12 . 1 1 90 90 VAL N N 90 118.174 118.174 119.699 -1.525 18792 9275 1 12 . 1 1 90 90 VAL C C 90 178.081 178.081 177.496 0.585 18792 9276 1 12 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.521 0.034 18792 9277 1 12 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.123 -0.516 18792 9278 1 12 . 1 1 90 90 VAL H H 90 7.017 7.017 8.126 -1.109 18792 9279 1 12 . 1 1 91 91 VAL N N 91 119.489 119.489 119.548 -0.059 18792 9280 1 12 . 1 1 91 91 VAL C C 91 177.914 177.914 177.567 0.347 18792 9281 1 12 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.062 -0.293 18792 9282 1 12 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.525 -0.234 18792 9283 1 12 . 1 1 91 91 VAL H H 91 7.833 7.833 7.597 0.236 18792 9284 1 12 . 1 1 92 92 ASN N N 92 117.180 117.180 117.673 -0.493 18792 9285 1 12 . 1 1 92 92 ASN C C 92 179.110 179.110 176.627 2.483 18792 9286 1 12 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.428 -1.510 18792 9287 1 12 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.520 -2.552 18792 9288 1 12 . 1 1 92 92 ASN H H 92 8.368 8.368 8.326 0.042 18792 9289 1 12 . 1 1 93 93 GLU N N 93 118.476 118.476 118.982 -0.506 18792 9290 1 12 . 1 1 93 93 GLU C C 93 179.355 179.355 179.328 0.027 18792 9291 1 12 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.719 -0.314 18792 9292 1 12 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.191 -2.458 18792 9293 1 12 . 1 1 93 93 GLU H H 93 7.213 7.213 7.766 -0.553 18792 9294 1 12 . 1 1 94 94 LEU N N 94 120.889 120.889 120.934 -0.045 18792 9295 1 12 . 1 1 94 94 LEU C C 94 178.473 178.473 178.442 0.031 18792 9296 1 12 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.085 -0.068 18792 9297 1 12 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.807 -1.877 18792 9298 1 12 . 1 1 94 94 LEU H H 94 7.446 7.446 7.903 -0.457 18792 9299 1 12 . 1 1 95 95 PHE N N 95 112.902 112.902 117.405 -4.503 18792 9300 1 12 . 1 1 95 95 PHE C C 95 176.586 176.586 176.703 -0.117 18792 9301 1 12 . 1 1 95 95 PHE CA C 95 57.159 57.159 58.132 -0.973 18792 9302 1 12 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.019 -0.798 18792 9303 1 12 . 1 1 95 95 PHE H H 95 6.916 6.916 8.295 -1.379 18792 9304 1 12 . 1 1 96 96 ARG N N 96 123.729 123.729 118.581 5.148 18792 9305 1 12 . 1 1 96 96 ARG C C 96 177.272 177.272 176.509 0.763 18792 9306 1 12 . 1 1 96 96 ARG CA C 96 59.223 59.223 57.960 1.263 18792 9307 1 12 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.459 -2.027 18792 9308 1 12 . 1 1 96 96 ARG H H 96 7.126 7.126 7.491 -0.365 18792 9309 1 12 . 1 1 97 97 ASP N N 97 116.576 116.576 115.779 0.797 18792 9310 1 12 . 1 1 97 97 ASP C C 97 175.687 175.687 174.339 1.348 18792 9311 1 12 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.341 -0.668 18792 9312 1 12 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.064 -3.019 18792 9313 1 12 . 1 1 97 97 ASP H H 97 8.644 8.644 7.592 1.052 18792 9314 1 12 . 1 1 98 98 GLY N N 98 108.551 108.551 106.562 1.989 18792 9315 1 12 . 1 1 98 98 GLY C C 98 172.690 172.690 172.347 0.343 18792 9316 1 12 . 1 1 98 98 GLY CA C 98 43.250 43.250 44.956 -1.706 18792 9317 1 12 . 1 1 98 98 GLY H H 98 7.463 7.463 7.547 -0.084 18792 9318 1 12 . 1 1 99 99 VAL N N 99 120.630 120.630 122.730 -2.100 18792 9319 1 12 . 1 1 99 99 VAL C C 99 174.503 174.503 174.512 -0.009 18792 9320 1 12 . 1 1 99 99 VAL CA C 99 62.318 62.318 62.135 0.183 18792 9321 1 12 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.585 -1.822 18792 9322 1 12 . 1 1 99 99 VAL H H 99 8.184 8.184 8.033 0.151 18792 9323 1 12 . 1 1 100 100 ASN N N 100 115.485 115.485 116.771 -1.286 18792 9324 1 12 . 1 1 100 100 ASN C C 100 175.239 175.239 176.656 -1.417 18792 9325 1 12 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.381 -3.020 18792 9326 1 12 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.839 0.081 18792 9327 1 12 . 1 1 100 100 ASN H H 100 6.241 6.241 7.510 -1.269 18792 9328 1 12 . 1 1 101 101 TRP N N 101 118.266 118.266 118.330 -0.064 18792 9329 1 12 . 1 1 101 101 TRP C C 101 178.301 178.301 176.281 2.020 18792 9330 1 12 . 1 1 101 101 TRP CA C 101 60.539 60.539 58.566 1.973 18792 9331 1 12 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.943 0.887 18792 9332 1 12 . 1 1 101 101 TRP H H 101 8.409 8.409 8.334 0.075 18792 9333 1 12 . 1 1 102 102 GLY N N 102 106.147 106.147 107.528 -1.381 18792 9334 1 12 . 1 1 102 102 GLY C C 102 177.640 177.640 175.222 2.418 18792 9335 1 12 . 1 1 102 102 GLY CA C 102 46.914 46.914 45.050 1.864 18792 9336 1 12 . 1 1 102 102 GLY H H 102 8.504 8.504 7.376 1.128 18792 9337 1 12 . 1 1 103 103 ARG N N 103 121.347 121.347 121.978 -0.631 18792 9338 1 12 . 1 1 103 103 ARG C C 103 177.738 177.738 178.442 -0.704 18792 9339 1 12 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.257 -0.315 18792 9340 1 12 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.100 0.119 18792 9341 1 12 . 1 1 103 103 ARG H H 103 8.099 8.099 8.194 -0.095 18792 9342 1 12 . 1 1 104 104 ILE N N 104 120.930 120.930 120.376 0.554 18792 9343 1 12 . 1 1 104 104 ILE C C 104 178.197 178.197 178.136 0.061 18792 9344 1 12 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.844 1.691 18792 9345 1 12 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.192 -2.147 18792 9346 1 12 . 1 1 104 104 ILE H H 104 7.690 7.690 8.189 -0.499 18792 9347 1 12 . 1 1 105 105 VAL N N 105 120.938 120.938 119.791 1.147 18792 9348 1 12 . 1 1 105 105 VAL C C 105 177.854 177.854 178.294 -0.440 18792 9349 1 12 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.344 1.114 18792 9350 1 12 . 1 1 105 105 VAL CB C 105 30.374 30.374 31.093 -0.720 18792 9351 1 12 . 1 1 105 105 VAL H H 105 8.245 8.245 7.715 0.530 18792 9352 1 12 . 1 1 106 106 ALA N N 106 121.165 121.165 121.957 -0.792 18792 9353 1 12 . 1 1 106 106 ALA C C 106 178.284 178.284 179.134 -0.850 18792 9354 1 12 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.664 -0.066 18792 9355 1 12 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.598 -1.083 18792 9356 1 12 . 1 1 106 106 ALA H H 106 7.529 7.529 7.966 -0.437 18792 9357 1 12 . 1 1 107 107 PHE N N 107 119.242 119.242 121.221 -1.979 18792 9358 1 12 . 1 1 107 107 PHE C C 107 176.390 176.390 176.559 -0.169 18792 9359 1 12 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.622 -0.449 18792 9360 1 12 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.100 -2.013 18792 9361 1 12 . 1 1 107 107 PHE H H 107 7.974 7.974 7.949 0.025 18792 9362 1 12 . 1 1 108 108 PHE N N 108 120.009 120.009 119.804 0.205 18792 9363 1 12 . 1 1 108 108 PHE C C 108 177.640 177.640 176.814 0.826 18792 9364 1 12 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.126 2.298 18792 9365 1 12 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.950 -3.604 18792 9366 1 12 . 1 1 108 108 PHE H H 108 7.946 7.946 8.585 -0.639 18792 9367 1 12 . 1 1 109 109 SER N N 109 114.631 114.631 116.736 -2.105 18792 9368 1 12 . 1 1 109 109 SER C C 109 177.770 177.770 176.483 1.287 18792 9369 1 12 . 1 1 109 109 SER CA C 109 63.349 63.349 61.635 1.714 18792 9370 1 12 . 1 1 109 109 SER H H 109 8.424 8.424 7.574 0.850 18792 9371 1 12 . 1 1 110 110 PHE N N 110 124.230 124.230 124.208 0.022 18792 9372 1 12 . 1 1 110 110 PHE C C 110 176.708 176.708 177.310 -0.602 18792 9373 1 12 . 1 1 110 110 PHE CA C 110 59.614 59.614 60.562 -0.948 18792 9374 1 12 . 1 1 110 110 PHE CB C 110 37.444 37.444 39.132 -1.688 18792 9375 1 12 . 1 1 110 110 PHE H H 110 9.052 9.052 8.088 0.964 18792 9376 1 12 . 1 1 111 111 GLY N N 111 105.893 105.893 106.127 -0.234 18792 9377 1 12 . 1 1 111 111 GLY C C 111 176.795 176.795 175.925 0.870 18792 9378 1 12 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.600 0.776 18792 9379 1 12 . 1 1 111 111 GLY H H 111 7.926 7.926 8.563 -0.637 18792 9380 1 12 . 1 1 112 112 GLY N N 112 107.410 107.410 109.061 -1.651 18792 9381 1 12 . 1 1 112 112 GLY C C 112 174.650 174.650 175.393 -0.743 18792 9382 1 12 . 1 1 112 112 GLY CA C 112 47.305 47.305 45.878 1.427 18792 9383 1 12 . 1 1 112 112 GLY H H 112 8.799 8.799 7.892 0.907 18792 9384 1 12 . 1 1 113 113 ALA N N 113 124.313 124.313 125.210 -0.897 18792 9385 1 12 . 1 1 113 113 ALA C C 113 181.300 181.300 179.474 1.826 18792 9386 1 12 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.852 -0.325 18792 9387 1 12 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.370 -0.887 18792 9388 1 12 . 1 1 113 113 ALA H H 113 8.212 8.212 7.856 0.356 18792 9389 1 12 . 1 1 114 114 LEU N N 114 118.878 118.878 118.238 0.640 18792 9390 1 12 . 1 1 114 114 LEU C C 114 180.286 180.286 179.175 1.111 18792 9391 1 12 . 1 1 114 114 LEU CA C 114 56.982 56.982 56.979 0.003 18792 9392 1 12 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.317 -0.300 18792 9393 1 12 . 1 1 114 114 LEU H H 114 8.161 8.161 7.754 0.407 18792 9394 1 12 . 1 1 115 115 CYS N N 115 119.002 119.002 118.112 0.890 18792 9395 1 12 . 1 1 115 115 CYS C C 115 176.087 176.087 176.433 -0.346 18792 9396 1 12 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.239 0.705 18792 9397 1 12 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.277 -1.642 18792 9398 1 12 . 1 1 115 115 CYS H H 115 8.070 8.070 8.006 0.064 18792 9399 1 12 . 1 1 116 116 VAL N N 116 118.737 118.737 119.507 -0.770 18792 9400 1 12 . 1 1 116 116 VAL C C 116 177.494 177.494 178.167 -0.673 18792 9401 1 12 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.076 0.686 18792 9402 1 12 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.282 -0.519 18792 9403 1 12 . 1 1 116 116 VAL H H 116 7.995 7.995 7.385 0.610 18792 9404 1 12 . 1 1 117 117 GLU N N 117 118.886 118.886 119.534 -0.648 18792 9405 1 12 . 1 1 117 117 GLU C C 117 178.424 178.424 179.178 -0.754 18792 9406 1 12 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.452 -0.692 18792 9407 1 12 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.391 -1.337 18792 9408 1 12 . 1 1 117 117 GLU H H 117 8.059 8.059 7.817 0.242 18792 9409 1 12 . 1 1 118 118 SER N N 118 113.417 113.417 115.739 -2.322 18792 9410 1 12 . 1 1 118 118 SER C C 118 175.607 175.607 176.475 -0.868 18792 9411 1 12 . 1 1 118 118 SER CA C 118 62.638 62.638 61.660 0.978 18792 9412 1 12 . 1 1 118 118 SER CB C 118 61.061 61.061 62.862 -1.801 18792 9413 1 12 . 1 1 118 118 SER H H 118 7.626 7.626 7.584 0.042 18792 9414 1 12 . 1 1 119 119 VAL N N 119 120.612 120.612 122.494 -1.882 18792 9415 1 12 . 1 1 119 119 VAL C C 119 179.713 179.713 178.196 1.517 18792 9416 1 12 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.892 0.333 18792 9417 1 12 . 1 1 119 119 VAL CB C 119 30.079 30.079 30.617 -0.538 18792 9418 1 12 . 1 1 119 119 VAL H H 119 7.297 7.297 7.877 -0.580 18792 9419 1 12 . 1 1 120 120 ASP N N 120 122.546 122.546 119.745 2.801 18792 9420 1 12 . 1 1 120 120 ASP C C 120 178.057 178.057 177.694 0.363 18792 9421 1 12 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.765 0.224 18792 9422 1 12 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.360 -0.437 18792 9423 1 12 . 1 1 120 120 ASP H H 120 8.264 8.264 7.581 0.683 18792 9424 1 12 . 1 1 121 121 LYS N N 121 115.636 115.636 117.394 -1.758 18792 9425 1 12 . 1 1 121 121 LYS C C 121 175.159 175.159 175.309 -0.150 18792 9426 1 12 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.806 -1.546 18792 9427 1 12 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.092 -2.317 18792 9428 1 12 . 1 1 121 121 LYS H H 121 7.558 7.558 7.396 0.162 18792 9429 1 12 . 1 1 122 122 GLU N N 122 113.915 113.915 115.935 -2.020 18792 9430 1 12 . 1 1 122 122 GLU C C 122 176.109 176.109 175.527 0.582 18792 9431 1 12 . 1 1 122 122 GLU CA C 122 57.307 57.307 56.698 0.609 18792 9432 1 12 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.497 -2.165 18792 9433 1 12 . 1 1 122 122 GLU H H 122 7.826 7.826 7.726 0.100 18792 9434 1 12 . 1 1 124 124 GLN N N 124 119.233 119.233 118.982 0.251 18792 9435 1 12 . 1 1 124 124 GLN C C 124 177.640 177.640 176.072 1.568 18792 9436 1 12 . 1 1 124 124 GLN CA C 124 59.472 59.472 56.444 3.028 18792 9437 1 12 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.960 -2.470 18792 9438 1 12 . 1 1 124 124 GLN H H 124 8.626 8.626 8.356 0.270 18792 9439 1 12 . 1 1 125 125 VAL N N 125 117.011 117.011 112.222 4.789 18792 9440 1 12 . 1 1 125 125 VAL C C 125 175.826 175.826 176.549 -0.723 18792 9441 1 12 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.442 -0.306 18792 9442 1 12 . 1 1 125 125 VAL CB C 125 30.297 30.297 29.291 1.006 18792 9443 1 12 . 1 1 125 125 VAL H H 125 7.870 7.870 8.178 -0.308 18792 9444 1 12 . 1 1 126 126 LEU N N 126 117.058 117.058 118.361 -1.303 18792 9445 1 12 . 1 1 126 126 LEU C C 126 178.096 178.096 178.402 -0.306 18792 9446 1 12 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.365 -2.280 18792 9447 1 12 . 1 1 126 126 LEU CB C 126 40.273 40.273 41.926 -1.653 18792 9448 1 12 . 1 1 126 126 LEU H H 126 7.747 7.747 7.504 0.243 18792 9449 1 12 . 1 1 127 127 VAL N N 127 119.457 119.457 120.038 -0.581 18792 9450 1 12 . 1 1 127 127 VAL C C 127 177.150 177.150 177.243 -0.093 18792 9451 1 12 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.575 0.581 18792 9452 1 12 . 1 1 127 127 VAL CB C 127 29.753 29.753 31.866 -2.113 18792 9453 1 12 . 1 1 127 127 VAL H H 127 7.306 7.306 7.747 -0.441 18792 9454 1 12 . 1 1 128 128 SER N N 128 110.647 110.647 113.000 -2.353 18792 9455 1 12 . 1 1 128 128 SER C C 128 177.222 177.222 176.780 0.442 18792 9456 1 12 . 1 1 128 128 SER CA C 128 60.752 60.752 61.186 -0.434 18792 9457 1 12 . 1 1 128 128 SER CB C 128 61.605 61.605 62.867 -1.262 18792 9458 1 12 . 1 1 128 128 SER H H 128 8.237 8.237 8.601 -0.364 18792 9459 1 12 . 1 1 129 129 ARG N N 129 123.100 123.100 122.292 0.808 18792 9460 1 12 . 1 1 129 129 ARG C C 129 175.802 175.802 178.841 -3.039 18792 9461 1 12 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.382 -0.155 18792 9462 1 12 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.240 -2.041 18792 9463 1 12 . 1 1 129 129 ARG H H 129 6.564 6.564 7.710 -1.146 18792 9464 1 12 . 1 1 130 130 ILE N N 130 118.182 118.182 117.813 0.369 18792 9465 1 12 . 1 1 130 130 ILE C C 130 178.156 178.156 177.961 0.195 18792 9466 1 12 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.559 -1.213 18792 9467 1 12 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.185 -0.503 18792 9468 1 12 . 1 1 130 130 ILE H H 130 7.955 7.955 8.689 -0.734 18792 9469 1 12 . 1 1 131 131 ALA N N 131 119.029 119.029 122.070 -3.041 18792 9470 1 12 . 1 1 131 131 ALA C C 131 179.593 179.593 179.418 0.175 18792 9471 1 12 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.246 -0.648 18792 9472 1 12 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.179 -0.791 18792 9473 1 12 . 1 1 131 131 ALA H H 131 7.582 7.582 8.602 -1.020 18792 9474 1 12 . 1 1 132 132 ALA N N 132 120.336 120.336 121.917 -1.581 18792 9475 1 12 . 1 1 132 132 ALA C C 132 181.095 181.095 179.563 1.532 18792 9476 1 12 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.681 -0.083 18792 9477 1 12 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.272 -1.571 18792 9478 1 12 . 1 1 132 132 ALA H H 132 7.224 7.224 7.785 -0.561 18792 9479 1 12 . 1 1 133 133 TRP N N 133 121.194 121.194 120.176 1.018 18792 9480 1 12 . 1 1 133 133 TRP C C 133 179.698 179.698 179.031 0.667 18792 9481 1 12 . 1 1 133 133 TRP CA C 133 57.302 57.302 59.655 -2.353 18792 9482 1 12 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.888 -2.233 18792 9483 1 12 . 1 1 133 133 TRP H H 133 8.925 8.925 8.565 0.360 18792 9484 1 12 . 1 1 134 134 MET N N 134 116.987 116.987 118.955 -1.968 18792 9485 1 12 . 1 1 134 134 MET C C 134 178.277 178.277 178.384 -0.107 18792 9486 1 12 . 1 1 134 134 MET CA C 134 59.578 59.578 59.620 -0.042 18792 9487 1 12 . 1 1 134 134 MET CB C 134 33.559 33.559 32.921 0.638 18792 9488 1 12 . 1 1 134 134 MET H H 134 8.863 8.863 8.932 -0.069 18792 9489 1 12 . 1 1 135 135 ALA N N 135 120.523 120.523 120.630 -0.107 18792 9490 1 12 . 1 1 135 135 ALA C C 135 179.298 179.298 179.485 -0.187 18792 9491 1 12 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.658 -0.226 18792 9492 1 12 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.161 -1.524 18792 9493 1 12 . 1 1 135 135 ALA H H 135 8.152 8.152 8.492 -0.340 18792 9494 1 12 . 1 1 136 136 THR N N 136 116.715 116.715 114.431 2.284 18792 9495 1 12 . 1 1 136 136 THR C C 136 175.106 175.106 176.227 -1.121 18792 9496 1 12 . 1 1 136 136 THR CA C 136 66.729 66.729 66.549 0.180 18792 9497 1 12 . 1 1 136 136 THR CB C 136 68.441 68.441 68.787 -0.346 18792 9498 1 12 . 1 1 136 136 THR H H 136 8.532 8.532 7.945 0.587 18792 9499 1 12 . 1 1 137 137 TYR N N 137 123.204 123.204 123.098 0.106 18792 9500 1 12 . 1 1 137 137 TYR C C 137 179.592 179.592 177.924 1.668 18792 9501 1 12 . 1 1 137 137 TYR CA C 137 63.065 63.065 62.191 0.874 18792 9502 1 12 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.381 -0.393 18792 9503 1 12 . 1 1 137 137 TYR H H 137 8.809 8.809 8.014 0.795 18792 9504 1 12 . 1 1 138 138 LEU N N 138 119.247 119.247 120.810 -1.563 18792 9505 1 12 . 1 1 138 138 LEU C C 138 178.385 178.385 178.106 0.279 18792 9506 1 12 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.549 0.389 18792 9507 1 12 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.154 -0.446 18792 9508 1 12 . 1 1 138 138 LEU H H 138 8.742 8.742 8.688 0.054 18792 9509 1 12 . 1 1 139 139 ASN N N 139 117.122 117.122 115.586 1.536 18792 9510 1 12 . 1 1 139 139 ASN C C 139 176.417 176.417 177.218 -0.801 18792 9511 1 12 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.370 1.078 18792 9512 1 12 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.085 0.567 18792 9513 1 12 . 1 1 139 139 ASN H H 139 8.307 8.307 7.979 0.328 18792 9514 1 12 . 1 1 140 140 ASP N N 140 115.394 115.394 119.859 -4.465 18792 9515 1 12 . 1 1 140 140 ASP C C 140 177.919 177.919 177.279 0.640 18792 9516 1 12 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.934 -0.981 18792 9517 1 12 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.079 -1.693 18792 9518 1 12 . 1 1 140 140 ASP H H 140 8.439 8.439 8.260 0.179 18792 9519 1 12 . 1 1 141 141 HIS N N 141 111.695 111.695 113.927 -2.232 18792 9520 1 12 . 1 1 141 141 HIS C C 141 175.949 175.949 175.828 0.121 18792 9521 1 12 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.796 -0.739 18792 9522 1 12 . 1 1 141 141 HIS CB C 141 29.908 29.908 31.969 -2.061 18792 9523 1 12 . 1 1 141 141 HIS H H 141 8.043 8.043 7.487 0.556 18792 9524 1 12 . 1 1 142 142 LEU N N 142 117.054 117.054 122.256 -5.202 18792 9525 1 12 . 1 1 142 142 LEU C C 142 176.530 176.530 177.800 -1.270 18792 9526 1 12 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.309 -3.000 18792 9527 1 12 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.971 0.367 18792 9528 1 12 . 1 1 142 142 LEU H H 142 7.198 7.198 8.113 -0.915 18792 9529 1 12 . 1 1 143 143 GLU N N 143 121.335 121.335 119.859 1.476 18792 9530 1 12 . 1 1 143 143 GLU C C 143 173.964 173.964 176.091 -2.127 18792 9531 1 12 . 1 1 143 143 GLU CA C 143 60.254 60.254 61.077 -0.823 18792 9532 1 12 . 1 1 143 143 GLU CB C 143 26.257 26.257 27.894 -1.637 18792 9533 1 12 . 1 1 143 143 GLU H H 143 8.565 8.565 7.842 0.723 18792 9534 1 12 . 1 1 145 145 TRP N N 145 117.973 117.973 119.998 -2.025 18792 9535 1 12 . 1 1 145 145 TRP C C 145 179.526 179.526 178.180 1.346 18792 9536 1 12 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.402 1.204 18792 9537 1 12 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.413 -1.525 18792 9538 1 12 . 1 1 145 145 TRP H H 145 7.078 7.078 8.434 -1.356 18792 9539 1 12 . 1 1 146 146 ILE N N 146 122.101 122.101 111.301 10.800 18792 9540 1 12 . 1 1 146 146 ILE C C 146 179.110 179.110 177.474 1.636 18792 9541 1 12 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.724 3.610 18792 9542 1 12 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.461 -1.639 18792 9543 1 12 . 1 1 146 146 ILE H H 146 8.389 8.389 7.728 0.661 18792 9544 1 12 . 1 1 147 147 GLN N N 147 116.344 116.344 121.991 -5.647 18792 9545 1 12 . 1 1 147 147 GLN C C 147 179.526 179.526 177.830 1.696 18792 9546 1 12 . 1 1 147 147 GLN CA C 147 58.013 58.013 59.453 -1.440 18792 9547 1 12 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.307 -1.584 18792 9548 1 12 . 1 1 147 147 GLN H H 147 8.376 8.376 8.345 0.031 18792 9549 1 12 . 1 1 148 148 GLU N N 148 118.913 118.913 120.347 -1.434 18792 9550 1 12 . 1 1 148 148 GLU C C 148 176.880 176.880 177.960 -1.080 18792 9551 1 12 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.690 -3.317 18792 9552 1 12 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.637 -1.205 18792 9553 1 12 . 1 1 148 148 GLU H H 148 7.504 7.504 8.286 -0.782 18792 9554 1 12 . 1 1 149 149 ASN N N 149 116.616 116.616 112.835 3.781 18792 9555 1 12 . 1 1 149 149 ASN C C 149 173.964 173.964 177.089 -3.125 18792 9556 1 12 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.690 -0.444 18792 9557 1 12 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.273 -2.140 18792 9558 1 12 . 1 1 149 149 ASN H H 149 7.070 7.070 8.123 -1.053 18792 9559 1 12 . 1 1 150 150 GLY N N 150 104.750 104.750 107.711 -2.961 18792 9560 1 12 . 1 1 150 150 GLY C C 150 176.022 176.022 173.952 2.070 18792 9561 1 12 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.602 -0.360 18792 9562 1 12 . 1 1 150 150 GLY H H 150 7.313 7.313 8.467 -1.154 18792 9563 1 12 . 1 1 151 151 GLY N N 151 108.385 108.385 108.415 -0.030 18792 9564 1 12 . 1 1 151 151 GLY C C 151 173.449 173.449 174.869 -1.420 18792 9565 1 12 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.849 -0.817 18792 9566 1 12 . 1 1 151 151 GLY H H 151 8.452 8.452 7.559 0.893 18792 9567 1 12 . 1 1 152 152 TRP N N 152 118.092 118.092 122.383 -4.291 18792 9568 1 12 . 1 1 152 152 TRP C C 152 178.571 178.571 178.126 0.445 18792 9569 1 12 . 1 1 152 152 TRP CA C 152 60.077 60.077 61.989 -1.912 18792 9570 1 12 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.684 -1.096 18792 9571 1 12 . 1 1 152 152 TRP H H 152 8.644 8.644 9.286 -0.642 18792 9572 1 12 . 1 1 153 153 ASP N N 153 117.758 117.758 117.940 -0.182 18792 9573 1 12 . 1 1 153 153 ASP C C 153 179.796 179.796 178.693 1.103 18792 9574 1 12 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.632 -0.330 18792 9575 1 12 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.967 -1.736 18792 9576 1 12 . 1 1 153 153 ASP H H 153 8.827 8.827 8.509 0.318 18792 9577 1 12 . 1 1 154 154 THR N N 154 116.817 116.817 117.234 -0.417 18792 9578 1 12 . 1 1 154 154 THR C C 154 175.352 175.352 176.294 -0.942 18792 9579 1 12 . 1 1 154 154 THR CA C 154 65.910 65.910 66.697 -0.787 18792 9580 1 12 . 1 1 154 154 THR CB C 154 67.712 67.712 68.822 -1.110 18792 9581 1 12 . 1 1 154 154 THR H H 154 7.494 7.494 7.480 0.014 18792 9582 1 12 . 1 1 155 155 PHE N N 155 122.196 122.196 121.802 0.394 18792 9583 1 12 . 1 1 155 155 PHE C C 155 176.831 176.831 177.584 -0.753 18792 9584 1 12 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.122 0.164 18792 9585 1 12 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.185 -1.518 18792 9586 1 12 . 1 1 155 155 PHE H H 155 6.477 6.477 8.630 -2.153 18792 9587 1 12 . 1 1 156 156 VAL N N 156 117.387 117.387 118.816 -1.429 18792 9588 1 12 . 1 1 156 156 VAL C C 156 178.497 178.497 178.352 0.145 18792 9589 1 12 . 1 1 156 156 VAL CA C 156 66.231 66.231 67.184 -0.953 18792 9590 1 12 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.547 -0.862 18792 9591 1 12 . 1 1 156 156 VAL H H 156 7.788 7.788 8.276 -0.488 18792 9592 1 12 . 1 1 157 157 GLU N N 157 119.876 119.876 119.796 0.080 18792 9593 1 12 . 1 1 157 157 GLU C C 157 178.399 178.399 178.687 -0.288 18792 9594 1 12 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.099 -0.339 18792 9595 1 12 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.803 -1.526 18792 9596 1 12 . 1 1 157 157 GLU H H 157 7.409 7.409 8.067 -0.658 18792 9597 1 12 . 1 1 158 158 LEU N N 158 117.194 117.194 119.643 -2.449 18792 9598 1 12 . 1 1 158 158 LEU C C 158 178.595 178.595 177.418 1.177 18792 9599 1 12 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.372 -0.995 18792 9600 1 12 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.725 -0.154 18792 9601 1 12 . 1 1 158 158 LEU H H 158 7.584 7.584 7.872 -0.288 18792 9602 1 12 . 1 1 159 159 TYR N N 159 115.549 115.549 112.923 2.626 18792 9603 1 12 . 1 1 159 159 TYR C C 159 177.032 177.032 176.596 0.436 18792 9604 1 12 . 1 1 159 159 TYR CA C 159 59.116 59.116 58.782 0.334 18792 9605 1 12 . 1 1 159 159 TYR CB C 159 37.599 37.599 40.310 -2.711 18792 9606 1 12 . 1 1 159 159 TYR H H 159 8.099 8.099 8.028 0.071 18792 9607 1 12 . 1 1 160 160 GLY N N 160 108.334 108.334 108.135 0.199 18792 9608 1 12 . 1 1 160 160 GLY C C 160 173.973 173.973 174.544 -0.571 18792 9609 1 12 . 1 1 160 160 GLY CA C 160 45.064 45.064 45.881 -0.817 18792 9610 1 12 . 1 1 160 160 GLY H H 160 8.020 8.020 8.422 -0.402 18792 9611 1 12 . 1 1 161 161 ASN N N 161 118.189 118.189 119.792 -1.603 18792 9612 1 12 . 1 1 161 161 ASN C C 161 175.513 175.513 174.501 1.012 18792 9613 1 12 . 1 1 161 161 ASN CA C 161 53.104 53.104 53.877 -0.773 18792 9614 1 12 . 1 1 161 161 ASN CB C 161 38.203 38.203 39.266 -1.063 18792 9615 1 12 . 1 1 161 161 ASN H H 161 8.327 8.327 8.018 0.309 18792 9616 1 12 . 1 1 162 162 ASN N N 162 119.022 119.022 121.751 -2.729 18792 9617 1 12 . 1 1 162 162 ASN C C 162 175.690 175.690 173.809 1.881 18792 9618 1 12 . 1 1 162 162 ASN CA C 162 53.424 53.424 52.636 0.788 18792 9619 1 12 . 1 1 162 162 ASN CB C 162 38.203 38.203 37.355 0.848 18792 9620 1 12 . 1 1 162 162 ASN H H 162 8.363 8.363 8.641 -0.278 18792 9621 1 12 . 1 1 163 163 ALA N N 163 123.275 123.275 124.462 -1.187 18792 9622 1 12 . 1 1 163 163 ALA C C 163 178.598 178.598 178.050 0.548 18792 9623 1 12 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.675 -0.437 18792 9624 1 12 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.211 -1.600 18792 9625 1 12 . 1 1 163 163 ALA H H 163 8.103 8.103 7.789 0.314 18792 9626 1 12 . 1 1 164 164 ALA N N 164 121.521 121.521 121.972 -0.451 18792 9627 1 12 . 1 1 164 164 ALA C C 164 178.642 178.642 178.357 0.285 18792 9628 1 12 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.142 -1.558 18792 9629 1 12 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.201 -0.382 18792 9630 1 12 . 1 1 164 164 ALA H H 164 8.053 8.053 8.487 -0.434 18792 9631 1 12 . 1 1 165 165 ALA N N 165 122.101 122.101 119.214 2.887 18792 9632 1 12 . 1 1 165 165 ALA C C 165 179.124 179.124 178.418 0.706 18792 9633 1 12 . 1 1 165 165 ALA CA C 165 53.139 53.139 52.976 0.163 18792 9634 1 12 . 1 1 165 165 ALA CB C 165 17.978 17.978 19.326 -1.348 18792 9635 1 12 . 1 1 165 165 ALA H H 165 7.949 7.949 7.820 0.129 18792 9636 1 12 . 1 1 166 166 GLU N N 166 118.381 118.381 118.501 -0.120 18792 9637 1 12 . 1 1 166 166 GLU C C 166 177.664 177.664 177.397 0.267 18792 9638 1 12 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.530 0.558 18792 9639 1 12 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.584 -1.230 18792 9640 1 12 . 1 1 166 166 GLU H H 166 8.202 8.202 7.971 0.231 18792 9641 1 12 . 1 1 167 167 SER N N 167 115.193 115.193 115.899 -0.706 18792 9642 1 12 . 1 1 167 167 SER C C 167 175.312 175.312 175.282 0.030 18792 9643 1 12 . 1 1 167 167 SER CA C 167 58.831 58.831 60.259 -1.428 18792 9644 1 12 . 1 1 167 167 SER CB C 167 62.537 62.537 63.220 -0.683 18792 9645 1 12 . 1 1 167 167 SER H H 167 8.029 8.029 7.621 0.408 18792 9646 1 12 . 1 1 168 168 ARG N N 168 121.696 121.696 120.260 1.436 18792 9647 1 12 . 1 1 168 168 ARG C C 168 176.880 176.880 175.156 1.724 18792 9648 1 12 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.104 0.059 18792 9649 1 12 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.311 -0.102 18792 9650 1 12 . 1 1 168 168 ARG H H 168 7.967 7.967 8.509 -0.542 18792 9651 1 12 . 1 1 169 169 LYS N N 169 120.917 120.917 120.154 0.763 18792 9652 1 12 . 1 1 169 169 LYS C C 169 177.640 177.640 177.111 0.529 18792 9653 1 12 . 1 1 169 169 LYS CA C 169 56.697 56.697 57.478 -0.781 18792 9654 1 12 . 1 1 169 169 LYS CB C 169 31.462 31.462 33.010 -1.548 18792 9655 1 12 . 1 1 169 169 LYS H H 169 8.011 8.011 8.159 -0.148 18792 9656 1 12 . 1 1 170 170 GLY N N 170 109.155 109.155 111.957 -2.802 18792 9657 1 12 . 1 1 170 170 GLY C C 170 174.479 174.479 173.027 1.452 18792 9658 1 12 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.586 -0.522 18792 9659 1 12 . 1 1 170 170 GLY H H 170 8.329 8.329 8.559 -0.230 18792 9660 1 12 . 1 1 171 171 GLN N N 171 119.292 119.292 118.075 1.217 18792 9661 1 12 . 1 1 171 171 GLN C C 171 176.463 176.463 173.972 2.491 18792 9662 1 12 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.748 -0.082 18792 9663 1 12 . 1 1 171 171 GLN CB C 171 28.199 28.199 31.456 -3.257 18792 9664 1 12 . 1 1 171 171 GLN H H 171 8.035 8.035 8.118 -0.083 18792 9665 1 12 . 1 1 172 172 GLU N N 172 121.703 121.703 120.695 1.008 18792 9666 1 12 . 1 1 172 172 GLU C C 172 176.414 176.414 174.392 2.022 18792 9667 1 12 . 1 1 172 172 GLU CA C 172 56.341 56.341 56.083 0.258 18792 9668 1 12 . 1 1 172 172 GLU CB C 172 28.821 28.821 31.517 -2.696 18792 9669 1 12 . 1 1 172 172 GLU H H 172 8.405 8.405 8.497 -0.092 18792 9670 1 12 . 1 1 173 173 ARG N N 173 121.852 121.852 124.189 -2.337 18792 9671 1 12 . 1 1 173 173 ARG C C 173 176.365 176.365 174.115 2.250 18792 9672 1 12 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.536 0.663 18792 9673 1 12 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.702 -2.571 18792 9674 1 12 . 1 1 173 173 ARG H H 173 8.335 8.335 8.724 -0.389 18792 9675 1 12 . 1 1 174 174 LEU N N 174 122.640 122.640 122.630 0.010 18792 9676 1 12 . 1 1 174 174 LEU C C 174 176.523 176.523 175.213 1.310 18792 9677 1 12 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.346 0.422 18792 9678 1 12 . 1 1 174 174 LEU CB C 174 40.784 40.784 45.107 -4.323 18792 9679 1 12 . 1 1 174 174 LEU H H 174 8.082 8.082 8.624 -0.542 18792 9680 1 12 . 1 1 175 175 GLU N N 175 125.909 125.909 119.291 6.618 18792 9681 1 12 . 1 1 175 175 GLU C C 175 181.029 181.029 174.508 6.521 18792 9682 1 12 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.819 1.579 18792 9683 1 12 . 1 1 175 175 GLU CB C 175 30.050 30.050 32.050 -2.000 18792 9684 1 12 . 1 1 175 175 GLU H H 175 7.785 7.785 8.829 -1.044 18792 9685 1 13 . 1 1 4 4 ALA N N 4 124.786 124.786 123.778 1.008 18792 9686 1 13 . 1 1 4 4 ALA C C 4 178.272 178.272 178.546 -0.274 18792 9687 1 13 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.115 -1.549 18792 9688 1 13 . 1 1 4 4 ALA CB C 4 18.234 18.234 19.038 -0.804 18792 9689 1 13 . 1 1 4 4 ALA H H 4 8.414 8.414 8.508 -0.094 18792 9690 1 13 . 1 1 5 5 MET N N 5 119.681 119.681 117.124 2.557 18792 9691 1 13 . 1 1 5 5 MET C C 5 176.929 176.929 176.052 0.877 18792 9692 1 13 . 1 1 5 5 MET CA C 5 55.594 55.594 54.235 1.359 18792 9693 1 13 . 1 1 5 5 MET CB C 5 31.540 31.540 32.318 -0.778 18792 9694 1 13 . 1 1 5 5 MET H H 5 8.336 8.336 8.327 0.009 18792 9695 1 13 . 1 1 6 6 SER N N 6 116.162 116.162 116.172 -0.010 18792 9696 1 13 . 1 1 6 6 SER C C 6 175.924 175.924 176.189 -0.265 18792 9697 1 13 . 1 1 6 6 SER CA C 6 59.009 59.009 60.735 -1.726 18792 9698 1 13 . 1 1 6 6 SER CB C 6 62.537 62.537 62.345 0.192 18792 9699 1 13 . 1 1 6 6 SER H H 6 8.272 8.272 8.302 -0.030 18792 9700 1 13 . 1 1 7 7 GLN N N 7 122.263 122.263 120.910 1.353 18792 9701 1 13 . 1 1 7 7 GLN C C 7 177.027 177.027 177.837 -0.810 18792 9702 1 13 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.761 -2.491 18792 9703 1 13 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.017 -0.278 18792 9704 1 13 . 1 1 7 7 GLN H H 7 8.314 8.314 8.285 0.029 18792 9705 1 13 . 1 1 8 8 SER N N 8 116.625 116.625 116.400 0.225 18792 9706 1 13 . 1 1 8 8 SER C C 8 176.457 176.457 176.668 -0.211 18792 9707 1 13 . 1 1 8 8 SER CA C 8 59.650 59.650 62.464 -2.814 18792 9708 1 13 . 1 1 8 8 SER CB C 8 62.226 62.226 62.589 -0.363 18792 9709 1 13 . 1 1 8 8 SER H H 8 8.333 8.333 8.118 0.215 18792 9710 1 13 . 1 1 9 9 ASN N N 9 121.307 121.307 120.137 1.170 18792 9711 1 13 . 1 1 9 9 ASN C C 9 177.419 177.419 177.618 -0.199 18792 9712 1 13 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.277 -0.790 18792 9713 1 13 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.592 -1.458 18792 9714 1 13 . 1 1 9 9 ASN H H 9 8.611 8.611 7.964 0.647 18792 9715 1 13 . 1 1 10 10 ARG N N 10 119.830 119.830 120.300 -0.470 18792 9716 1 13 . 1 1 10 10 ARG C C 10 177.615 177.615 178.285 -0.670 18792 9717 1 13 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.550 -0.292 18792 9718 1 13 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.321 -2.122 18792 9719 1 13 . 1 1 10 10 ARG H H 10 7.996 7.996 7.589 0.407 18792 9720 1 13 . 1 1 11 11 GLU N N 11 117.270 117.270 119.996 -2.726 18792 9721 1 13 . 1 1 11 11 GLU C C 11 179.649 179.649 178.609 1.040 18792 9722 1 13 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.143 -0.134 18792 9723 1 13 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.610 -1.489 18792 9724 1 13 . 1 1 11 11 GLU H H 11 7.885 7.885 8.448 -0.563 18792 9725 1 13 . 1 1 12 12 LEU N N 12 119.900 119.900 120.448 -0.548 18792 9726 1 13 . 1 1 12 12 LEU C C 12 178.473 178.473 178.901 -0.428 18792 9727 1 13 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.797 -1.104 18792 9728 1 13 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.843 -1.214 18792 9729 1 13 . 1 1 12 12 LEU H H 12 7.691 7.691 7.949 -0.258 18792 9730 1 13 . 1 1 13 13 VAL N N 13 117.320 117.320 116.663 0.657 18792 9731 1 13 . 1 1 13 13 VAL C C 13 177.272 177.272 178.129 -0.857 18792 9732 1 13 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.584 0.572 18792 9733 1 13 . 1 1 13 13 VAL CB C 13 31.229 31.229 30.709 0.520 18792 9734 1 13 . 1 1 13 13 VAL H H 13 7.629 7.629 7.597 0.032 18792 9735 1 13 . 1 1 14 14 VAL N N 14 116.659 116.659 121.351 -4.692 18792 9736 1 13 . 1 1 14 14 VAL C C 14 178.718 178.718 177.904 0.814 18792 9737 1 13 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.424 0.092 18792 9738 1 13 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.231 -0.857 18792 9739 1 13 . 1 1 14 14 VAL H H 14 8.210 8.210 7.627 0.583 18792 9740 1 13 . 1 1 15 15 ASP N N 15 120.374 120.374 121.611 -1.237 18792 9741 1 13 . 1 1 15 15 ASP C C 15 177.557 177.557 178.052 -0.495 18792 9742 1 13 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.553 0.923 18792 9743 1 13 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.843 1.710 18792 9744 1 13 . 1 1 15 15 ASP H H 15 7.967 7.967 8.459 -0.492 18792 9745 1 13 . 1 1 16 16 PHE N N 16 119.864 119.864 120.078 -0.214 18792 9746 1 13 . 1 1 16 16 PHE C C 16 178.252 178.252 177.941 0.311 18792 9747 1 13 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.897 1.883 18792 9748 1 13 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.083 -0.023 18792 9749 1 13 . 1 1 16 16 PHE H H 16 8.228 8.228 7.820 0.408 18792 9750 1 13 . 1 1 17 17 LEU N N 17 116.312 116.312 119.959 -3.647 18792 9751 1 13 . 1 1 17 17 LEU C C 17 179.649 179.649 179.130 0.519 18792 9752 1 13 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.209 -0.445 18792 9753 1 13 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.712 -1.627 18792 9754 1 13 . 1 1 17 17 LEU H H 17 8.766 8.766 8.861 -0.095 18792 9755 1 13 . 1 1 18 18 SER N N 18 113.715 113.715 114.881 -1.166 18792 9756 1 13 . 1 1 18 18 SER C C 18 177.362 177.362 176.493 0.869 18792 9757 1 13 . 1 1 18 18 SER CA C 18 61.948 61.948 61.330 0.618 18792 9758 1 13 . 1 1 18 18 SER CB C 18 63.003 63.003 63.213 -0.210 18792 9759 1 13 . 1 1 18 18 SER H H 18 8.384 8.384 8.209 0.175 18792 9760 1 13 . 1 1 19 19 TYR N N 19 124.570 124.570 122.656 1.914 18792 9761 1 13 . 1 1 19 19 TYR C C 19 178.415 178.415 178.313 0.102 18792 9762 1 13 . 1 1 19 19 TYR CA C 19 59.764 59.764 62.023 -2.259 18792 9763 1 13 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.612 -1.596 18792 9764 1 13 . 1 1 19 19 TYR H H 19 8.155 8.155 8.609 -0.454 18792 9765 1 13 . 1 1 20 20 LYS N N 20 119.739 119.739 120.156 -0.417 18792 9766 1 13 . 1 1 20 20 LYS C C 20 180.456 180.456 179.216 1.240 18792 9767 1 13 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.563 -3.075 18792 9768 1 13 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.512 -4.353 18792 9769 1 13 . 1 1 20 20 LYS H H 20 8.224 8.224 8.565 -0.341 18792 9770 1 13 . 1 1 21 21 LEU N N 21 118.092 118.092 120.417 -2.325 18792 9771 1 13 . 1 1 21 21 LEU C C 21 179.989 179.989 178.787 1.202 18792 9772 1 13 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.371 -0.245 18792 9773 1 13 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.904 -2.296 18792 9774 1 13 . 1 1 21 21 LEU H H 21 8.586 8.586 8.231 0.355 18792 9775 1 13 . 1 1 22 22 SER N N 22 117.304 117.304 113.604 3.700 18792 9776 1 13 . 1 1 22 22 SER C C 22 180.152 180.152 177.335 2.817 18792 9777 1 13 . 1 1 22 22 SER CA C 22 61.287 61.287 61.781 -0.494 18792 9778 1 13 . 1 1 22 22 SER H H 22 8.266 8.266 7.884 0.382 18792 9779 1 13 . 1 1 23 23 GLN N N 23 122.497 122.497 122.393 0.104 18792 9780 1 13 . 1 1 23 23 GLN C C 23 177.297 177.297 177.668 -0.371 18792 9781 1 13 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.411 -0.469 18792 9782 1 13 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.695 -0.884 18792 9783 1 13 . 1 1 23 23 GLN H H 23 7.571 7.571 8.452 -0.881 18792 9784 1 13 . 1 1 24 24 LYS N N 24 116.038 116.038 117.997 -1.959 18792 9785 1 13 . 1 1 24 24 LYS C C 24 175.704 175.704 176.995 -1.291 18792 9786 1 13 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.446 -2.951 18792 9787 1 13 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.223 -1.994 18792 9788 1 13 . 1 1 24 24 LYS H H 24 7.134 7.134 7.769 -0.635 18792 9789 1 13 . 1 1 25 25 GLY N N 25 105.283 105.283 104.720 0.563 18792 9790 1 13 . 1 1 25 25 GLY C C 25 174.013 174.013 173.315 0.698 18792 9791 1 13 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.734 0.045 18792 9792 1 13 . 1 1 25 25 GLY H H 25 7.483 7.483 7.944 -0.461 18792 9793 1 13 . 1 1 26 26 TYR N N 26 119.547 119.547 120.538 -0.991 18792 9794 1 13 . 1 1 26 26 TYR C C 26 175.122 175.122 173.328 1.794 18792 9795 1 13 . 1 1 26 26 TYR CA C 26 55.132 55.132 57.112 -1.980 18792 9796 1 13 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.744 0.336 18792 9797 1 13 . 1 1 26 26 TYR H H 26 7.788 7.788 7.825 -0.037 18792 9798 1 13 . 1 1 27 27 SER N N 27 115.088 115.088 118.358 -3.270 18792 9799 1 13 . 1 1 27 27 SER C C 27 174.452 174.452 175.361 -0.909 18792 9800 1 13 . 1 1 27 27 SER CA C 27 56.306 56.306 56.437 -0.131 18792 9801 1 13 . 1 1 27 27 SER CB C 27 63.921 63.921 65.044 -1.123 18792 9802 1 13 . 1 1 27 27 SER H H 27 8.473 8.473 8.016 0.457 18792 9803 1 13 . 1 1 28 28 TRP N N 28 127.014 127.014 125.074 1.940 18792 9804 1 13 . 1 1 28 28 TRP C C 28 177.002 177.002 177.223 -0.221 18792 9805 1 13 . 1 1 28 28 TRP CA C 28 59.472 59.472 60.920 -1.448 18792 9806 1 13 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.613 0.218 18792 9807 1 13 . 1 1 28 28 TRP H H 28 8.897 8.897 9.180 -0.283 18792 9808 1 13 . 1 1 29 29 SER N N 29 112.044 112.044 113.397 -1.353 18792 9809 1 13 . 1 1 29 29 SER C C 29 175.106 175.106 176.646 -1.540 18792 9810 1 13 . 1 1 29 29 SER CA C 29 59.472 59.472 60.240 -0.768 18792 9811 1 13 . 1 1 29 29 SER CB C 29 62.226 62.226 63.288 -1.062 18792 9812 1 13 . 1 1 29 29 SER H H 29 8.129 8.129 7.613 0.516 18792 9813 1 13 . 1 1 30 30 GLN N N 30 119.160 119.160 121.392 -2.232 18792 9814 1 13 . 1 1 30 30 GLN C C 30 176.218 176.218 177.257 -1.039 18792 9815 1 13 . 1 1 30 30 GLN CA C 30 56.412 56.412 58.327 -1.915 18792 9816 1 13 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.350 -0.772 18792 9817 1 13 . 1 1 30 30 GLN H H 30 7.370 7.370 8.317 -0.947 18792 9818 1 13 . 1 1 31 31 PHE N N 31 116.277 116.277 117.994 -1.717 18792 9819 1 13 . 1 1 31 31 PHE C C 31 175.217 175.217 175.003 0.214 18792 9820 1 13 . 1 1 31 31 PHE CA C 31 56.234 56.234 59.454 -3.220 18792 9821 1 13 . 1 1 31 31 PHE CB C 31 39.066 39.066 39.223 -0.157 18792 9822 1 13 . 1 1 31 31 PHE H H 31 7.248 7.248 7.656 -0.408 18792 9823 1 13 . 1 1 32 32 SER N N 32 113.683 113.683 114.429 -0.746 18792 9824 1 13 . 1 1 32 32 SER C C 32 173.793 173.793 174.080 -0.287 18792 9825 1 13 . 1 1 32 32 SER CA C 32 57.124 57.124 58.636 -1.512 18792 9826 1 13 . 1 1 32 32 SER CB C 32 63.081 63.081 64.183 -1.102 18792 9827 1 13 . 1 1 32 32 SER H H 32 7.242 7.242 7.199 0.043 18792 9828 1 13 . 1 1 33 33 ASP N N 33 122.195 122.195 120.607 1.588 18792 9829 1 13 . 1 1 33 33 ASP C C 33 176.394 176.394 176.533 -0.139 18792 9830 1 13 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.575 -1.827 18792 9831 1 13 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.934 -0.536 18792 9832 1 13 . 1 1 33 33 ASP H H 33 8.257 8.257 8.355 -0.098 18792 9833 1 13 . 1 1 34 34 VAL N N 34 118.913 118.913 118.100 0.813 18792 9834 1 13 . 1 1 34 34 VAL C C 34 176.328 176.328 175.167 1.161 18792 9835 1 13 . 1 1 34 34 VAL CA C 34 61.891 61.891 61.193 0.698 18792 9836 1 13 . 1 1 34 34 VAL CB C 34 32.015 32.015 30.808 1.207 18792 9837 1 13 . 1 1 34 34 VAL H H 34 7.852 7.852 7.674 0.178 18792 9838 1 13 . 1 1 35 35 GLU N N 35 124.205 124.205 122.158 2.047 18792 9839 1 13 . 1 1 35 35 GLU C C 35 176.586 176.586 175.245 1.341 18792 9840 1 13 . 1 1 35 35 GLU CA C 35 56.057 56.057 55.830 0.227 18792 9841 1 13 . 1 1 35 35 GLU CB C 35 28.898 28.898 31.616 -2.718 18792 9842 1 13 . 1 1 35 35 GLU H H 35 8.401 8.401 8.373 0.028 18792 9843 1 13 . 1 1 36 36 GLU N N 36 121.670 121.670 119.130 2.540 18792 9844 1 13 . 1 1 36 36 GLU C C 36 176.218 176.218 175.378 0.840 18792 9845 1 13 . 1 1 36 36 GLU CA C 36 55.988 55.988 57.599 -1.611 18792 9846 1 13 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.936 -1.494 18792 9847 1 13 . 1 1 36 36 GLU H H 36 8.239 8.239 8.695 -0.456 18792 9848 1 13 . 1 1 37 37 ASN N N 37 119.252 119.252 116.926 2.326 18792 9849 1 13 . 1 1 37 37 ASN C C 37 175.003 175.003 175.111 -0.108 18792 9850 1 13 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.180 -0.525 18792 9851 1 13 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.413 -1.201 18792 9852 1 13 . 1 1 37 37 ASN H H 37 8.412 8.412 8.270 0.142 18792 9853 1 13 . 1 1 38 38 ARG N N 38 121.622 121.622 118.059 3.563 18792 9854 1 13 . 1 1 38 38 ARG C C 38 176.610 176.610 175.890 0.720 18792 9855 1 13 . 1 1 38 38 ARG CA C 38 55.364 55.364 55.777 -0.413 18792 9856 1 13 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.171 -1.752 18792 9857 1 13 . 1 1 38 38 ARG H H 38 8.227 8.227 8.547 -0.320 18792 9858 1 13 . 1 1 39 39 THR N N 39 115.681 115.681 115.428 0.253 18792 9859 1 13 . 1 1 39 39 THR C C 39 174.500 174.500 174.100 0.400 18792 9860 1 13 . 1 1 39 39 THR CA C 39 61.606 61.606 62.501 -0.895 18792 9861 1 13 . 1 1 39 39 THR CB C 39 69.163 69.163 68.925 0.238 18792 9862 1 13 . 1 1 39 39 THR H H 39 8.173 8.173 7.907 0.266 18792 9863 1 13 . 1 1 40 40 GLU N N 40 122.708 122.708 122.497 0.211 18792 9864 1 13 . 1 1 40 40 GLU C C 40 175.728 175.728 176.708 -0.980 18792 9865 1 13 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.977 -1.205 18792 9866 1 13 . 1 1 40 40 GLU CB C 40 29.054 29.054 30.378 -1.323 18792 9867 1 13 . 1 1 40 40 GLU H H 40 8.298 8.298 8.499 -0.201 18792 9868 1 13 . 1 1 41 41 ALA N N 41 125.922 125.922 123.134 2.788 18792 9869 1 13 . 1 1 41 41 ALA C C 41 175.557 175.557 174.796 0.761 18792 9870 1 13 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.102 -1.129 18792 9871 1 13 . 1 1 41 41 ALA CB C 41 17.245 17.245 19.462 -2.217 18792 9872 1 13 . 1 1 41 41 ALA H H 41 8.212 8.212 7.853 0.359 18792 9873 1 13 . 1 1 43 43 GLU N N 43 120.783 120.783 121.876 -1.093 18792 9874 1 13 . 1 1 43 43 GLU C C 43 177.174 177.174 175.643 1.531 18792 9875 1 13 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.853 -0.512 18792 9876 1 13 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.143 -0.856 18792 9877 1 13 . 1 1 43 43 GLU H H 43 8.519 8.519 8.455 0.064 18792 9878 1 13 . 1 1 44 44 GLY N N 44 110.022 110.022 109.716 0.306 18792 9879 1 13 . 1 1 44 44 GLY C C 44 174.773 174.773 174.681 0.092 18792 9880 1 13 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.355 -0.327 18792 9881 1 13 . 1 1 44 44 GLY H H 44 8.429 8.429 8.303 0.126 18792 9882 1 13 . 1 1 45 45 THR N N 45 112.790 112.790 115.080 -2.290 18792 9883 1 13 . 1 1 45 45 THR C C 45 175.726 175.726 175.298 0.428 18792 9884 1 13 . 1 1 45 45 THR CA C 45 61.987 61.987 63.374 -1.387 18792 9885 1 13 . 1 1 45 45 THR CB C 45 69.304 69.304 69.334 -0.030 18792 9886 1 13 . 1 1 45 45 THR H H 45 8.125 8.125 7.655 0.470 18792 9887 1 13 . 1 1 46 46 GLU N N 46 122.752 122.752 120.054 2.698 18792 9888 1 13 . 1 1 46 46 GLU C C 46 177.419 177.419 176.038 1.381 18792 9889 1 13 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.102 1.129 18792 9890 1 13 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.654 -1.454 18792 9891 1 13 . 1 1 46 46 GLU H H 46 8.765 8.765 8.402 0.363 18792 9892 1 13 . 1 1 47 47 SER N N 47 114.895 114.895 113.909 0.986 18792 9893 1 13 . 1 1 47 47 SER C C 47 175.826 175.826 175.557 0.269 18792 9894 1 13 . 1 1 47 47 SER CA C 47 58.582 58.582 59.472 -0.890 18792 9895 1 13 . 1 1 47 47 SER CB C 47 62.537 62.537 63.917 -1.380 18792 9896 1 13 . 1 1 47 47 SER H H 47 8.355 8.355 8.114 0.241 18792 9897 1 13 . 1 1 48 48 GLU N N 48 122.429 122.429 122.270 0.159 18792 9898 1 13 . 1 1 48 48 GLU C C 48 178.099 178.099 177.702 0.397 18792 9899 1 13 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.180 -0.562 18792 9900 1 13 . 1 1 48 48 GLU CB C 48 28.475 28.475 28.863 -0.389 18792 9901 1 13 . 1 1 48 48 GLU H H 48 8.139 8.139 8.521 -0.382 18792 9902 1 13 . 1 1 49 49 ALA N N 49 120.374 120.374 122.347 -1.973 18792 9903 1 13 . 1 1 49 49 ALA C C 49 180.843 180.843 179.525 1.318 18792 9904 1 13 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.818 -0.335 18792 9905 1 13 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.369 -0.934 18792 9906 1 13 . 1 1 49 49 ALA H H 49 8.079 8.079 8.478 -0.399 18792 9907 1 13 . 1 1 50 50 VAL N N 50 118.599 118.599 117.637 0.962 18792 9908 1 13 . 1 1 50 50 VAL C C 50 176.921 176.921 177.967 -1.046 18792 9909 1 13 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.806 -1.246 18792 9910 1 13 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.580 -1.283 18792 9911 1 13 . 1 1 50 50 VAL H H 50 7.419 7.419 7.638 -0.219 18792 9912 1 13 . 1 1 51 51 LYS N N 51 117.469 117.469 120.197 -2.728 18792 9913 1 13 . 1 1 51 51 LYS C C 51 179.061 179.061 178.950 0.111 18792 9914 1 13 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.945 -0.722 18792 9915 1 13 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.032 -1.036 18792 9916 1 13 . 1 1 51 51 LYS H H 51 7.359 7.359 7.718 -0.359 18792 9917 1 13 . 1 1 52 52 GLN N N 52 115.930 115.930 118.523 -2.593 18792 9918 1 13 . 1 1 52 52 GLN C C 52 177.713 177.713 178.324 -0.611 18792 9919 1 13 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.703 -0.227 18792 9920 1 13 . 1 1 52 52 GLN CB C 52 26.568 26.568 27.698 -1.131 18792 9921 1 13 . 1 1 52 52 GLN H H 52 8.025 8.025 7.682 0.343 18792 9922 1 13 . 1 1 53 53 ALA N N 53 119.782 119.782 122.406 -2.624 18792 9923 1 13 . 1 1 53 53 ALA C C 53 180.008 180.008 179.014 0.994 18792 9924 1 13 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.712 -0.327 18792 9925 1 13 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.511 -0.996 18792 9926 1 13 . 1 1 53 53 ALA H H 53 7.655 7.655 8.001 -0.346 18792 9927 1 13 . 1 1 54 54 LEU N N 54 120.443 120.443 120.413 0.030 18792 9928 1 13 . 1 1 54 54 LEU C C 54 179.330 179.330 178.341 0.989 18792 9929 1 13 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.780 0.233 18792 9930 1 13 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.851 -0.989 18792 9931 1 13 . 1 1 54 54 LEU H H 54 8.419 8.419 8.388 0.031 18792 9932 1 13 . 1 1 55 55 ARG N N 55 118.423 118.423 118.351 0.072 18792 9933 1 13 . 1 1 55 55 ARG C C 55 178.767 178.767 178.474 0.293 18792 9934 1 13 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.435 0.962 18792 9935 1 13 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.323 -0.580 18792 9936 1 13 . 1 1 55 55 ARG H H 55 8.062 8.062 8.165 -0.103 18792 9937 1 13 . 1 1 56 56 GLU N N 56 115.988 115.988 119.946 -3.958 18792 9938 1 13 . 1 1 56 56 GLU C C 56 180.090 180.090 178.367 1.723 18792 9939 1 13 . 1 1 56 56 GLU CA C 56 58.760 58.760 58.791 -0.031 18792 9940 1 13 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.376 -1.022 18792 9941 1 13 . 1 1 56 56 GLU H H 56 7.772 7.772 7.821 -0.049 18792 9942 1 13 . 1 1 57 57 ALA N N 57 122.837 122.837 121.952 0.885 18792 9943 1 13 . 1 1 57 57 ALA C C 57 181.861 181.861 179.508 2.353 18792 9944 1 13 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.822 -0.188 18792 9945 1 13 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.548 -0.075 18792 9946 1 13 . 1 1 57 57 ALA H H 57 8.774 8.774 7.938 0.836 18792 9947 1 13 . 1 1 58 58 GLY N N 58 108.409 108.409 106.500 1.909 18792 9948 1 13 . 1 1 58 58 GLY C C 58 175.331 175.331 175.912 -0.581 18792 9949 1 13 . 1 1 58 58 GLY CA C 58 46.668 46.668 47.047 -0.379 18792 9950 1 13 . 1 1 58 58 GLY H H 58 9.073 9.073 8.543 0.530 18792 9951 1 13 . 1 1 59 59 ASP N N 59 122.074 122.074 121.716 0.358 18792 9952 1 13 . 1 1 59 59 ASP C C 59 179.023 179.023 178.017 1.006 18792 9953 1 13 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.700 -0.399 18792 9954 1 13 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.340 -2.498 18792 9955 1 13 . 1 1 59 59 ASP H H 59 8.049 8.049 8.011 0.038 18792 9956 1 13 . 1 1 60 60 GLU N N 60 120.131 120.131 120.231 -0.100 18792 9957 1 13 . 1 1 60 60 GLU C C 60 178.522 178.522 179.024 -0.502 18792 9958 1 13 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.202 -0.193 18792 9959 1 13 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.631 -1.432 18792 9960 1 13 . 1 1 60 60 GLU H H 60 8.136 8.136 7.766 0.370 18792 9961 1 13 . 1 1 61 61 PHE N N 61 121.309 121.309 119.456 1.853 18792 9962 1 13 . 1 1 61 61 PHE C C 61 176.904 176.904 177.721 -0.817 18792 9963 1 13 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.772 -0.450 18792 9964 1 13 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.303 -0.694 18792 9965 1 13 . 1 1 61 61 PHE H H 61 8.523 8.523 8.187 0.336 18792 9966 1 13 . 1 1 62 62 GLU N N 62 115.971 115.971 119.759 -3.788 18792 9967 1 13 . 1 1 62 62 GLU C C 62 177.713 177.713 178.408 -0.695 18792 9968 1 13 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.571 -0.380 18792 9969 1 13 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.337 -1.060 18792 9970 1 13 . 1 1 62 62 GLU H H 62 7.969 7.969 8.092 -0.123 18792 9971 1 13 . 1 1 63 63 LEU N N 63 116.703 116.703 119.755 -3.052 18792 9972 1 13 . 1 1 63 63 LEU C C 63 178.963 178.963 178.679 0.284 18792 9973 1 13 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.420 -0.008 18792 9974 1 13 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.578 -1.172 18792 9975 1 13 . 1 1 63 63 LEU H H 63 7.347 7.347 8.239 -0.892 18792 9976 1 13 . 1 1 64 64 ARG N N 64 117.453 117.453 118.289 -0.836 18792 9977 1 13 . 1 1 64 64 ARG C C 64 177.297 177.297 175.402 1.895 18792 9978 1 13 . 1 1 64 64 ARG CA C 64 57.337 57.337 55.469 1.868 18792 9979 1 13 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.576 -0.979 18792 9980 1 13 . 1 1 64 64 ARG H H 64 7.995 7.995 7.477 0.518 18792 9981 1 13 . 1 1 65 65 TYR N N 65 118.956 118.956 114.378 4.578 18792 9982 1 13 . 1 1 65 65 TYR C C 65 175.278 175.278 175.094 0.184 18792 9983 1 13 . 1 1 65 65 TYR CA C 65 55.701 55.701 57.659 -1.958 18792 9984 1 13 . 1 1 65 65 TYR CB C 65 35.986 35.986 34.934 1.052 18792 9985 1 13 . 1 1 65 65 TYR H H 65 7.909 7.909 7.575 0.334 18792 9986 1 13 . 1 1 66 66 ARG N N 66 119.438 119.438 119.153 0.285 18792 9987 1 13 . 1 1 66 66 ARG C C 66 178.424 178.424 178.108 0.316 18792 9988 1 13 . 1 1 66 66 ARG CA C 66 58.476 58.476 55.877 2.599 18792 9989 1 13 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.008 -1.187 18792 9990 1 13 . 1 1 66 66 ARG H H 66 7.244 7.244 7.752 -0.508 18792 9991 1 13 . 1 1 67 67 ARG N N 67 118.936 118.936 124.348 -5.412 18792 9992 1 13 . 1 1 67 67 ARG C C 67 177.542 177.542 178.468 -0.926 18792 9993 1 13 . 1 1 67 67 ARG CA C 67 57.444 57.444 60.158 -2.714 18792 9994 1 13 . 1 1 67 67 ARG CB C 67 28.121 28.121 30.025 -1.904 18792 9995 1 13 . 1 1 67 67 ARG H H 67 8.417 8.417 8.989 -0.572 18792 9996 1 13 . 1 1 68 68 ALA N N 68 121.797 121.797 123.718 -1.921 18792 9997 1 13 . 1 1 68 68 ALA C C 68 180.337 180.337 179.569 0.768 18792 9998 1 13 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.796 -0.660 18792 9999 1 13 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.439 -0.972 18792 10000 1 13 . 1 1 68 68 ALA H H 68 7.827 7.827 8.131 -0.304 18792 10001 1 13 . 1 1 69 69 PHE N N 69 115.986 115.986 119.274 -3.288 18792 10002 1 13 . 1 1 69 69 PHE C C 69 177.468 177.468 177.100 0.368 18792 10003 1 13 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.752 -1.703 18792 10004 1 13 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.856 -1.257 18792 10005 1 13 . 1 1 69 69 PHE H H 69 8.517 8.517 8.884 -0.367 18792 10006 1 13 . 1 1 70 70 SER N N 70 116.526 116.526 115.021 1.505 18792 10007 1 13 . 1 1 70 70 SER C C 70 177.640 177.640 176.440 1.200 18792 10008 1 13 . 1 1 70 70 SER CA C 70 61.073 61.073 62.474 -1.401 18792 10009 1 13 . 1 1 70 70 SER CB C 70 61.993 61.993 62.836 -0.842 18792 10010 1 13 . 1 1 70 70 SER H H 70 8.152 8.152 8.325 -0.173 18792 10011 1 13 . 1 1 71 71 ASP N N 71 121.181 121.181 122.755 -1.574 18792 10012 1 13 . 1 1 71 71 ASP C C 71 178.546 178.546 178.497 0.049 18792 10013 1 13 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.277 -0.829 18792 10014 1 13 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.706 -1.475 18792 10015 1 13 . 1 1 71 71 ASP H H 71 8.356 8.356 7.648 0.708 18792 10016 1 13 . 1 1 72 72 LEU N N 72 120.747 120.747 120.816 -0.069 18792 10017 1 13 . 1 1 72 72 LEU C C 72 178.963 178.963 178.253 0.710 18792 10018 1 13 . 1 1 72 72 LEU CA C 72 57.444 57.444 57.978 -0.534 18792 10019 1 13 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.037 -1.020 18792 10020 1 13 . 1 1 72 72 LEU H H 72 7.738 7.738 8.209 -0.471 18792 10021 1 13 . 1 1 73 73 THR N N 73 109.432 109.432 113.842 -4.410 18792 10022 1 13 . 1 1 73 73 THR C C 73 177.481 177.481 175.238 2.243 18792 10023 1 13 . 1 1 73 73 THR CA C 73 65.128 65.128 66.250 -1.122 18792 10024 1 13 . 1 1 73 73 THR CB C 73 67.720 67.720 68.496 -0.776 18792 10025 1 13 . 1 1 73 73 THR H H 73 8.296 8.296 7.835 0.461 18792 10026 1 13 . 1 1 74 74 SER N N 74 115.862 115.862 112.867 2.995 18792 10027 1 13 . 1 1 74 74 SER C C 74 175.361 175.361 176.038 -0.677 18792 10028 1 13 . 1 1 74 74 SER CA C 74 60.112 60.112 59.861 0.251 18792 10029 1 13 . 1 1 74 74 SER CB C 74 62.537 62.537 63.432 -0.895 18792 10030 1 13 . 1 1 74 74 SER H H 74 7.629 7.629 7.915 -0.286 18792 10031 1 13 . 1 1 75 75 GLN N N 75 118.551 118.551 120.203 -1.652 18792 10032 1 13 . 1 1 75 75 GLN C C 75 176.316 176.316 177.152 -0.836 18792 10033 1 13 . 1 1 75 75 GLN CA C 75 56.804 56.804 58.382 -1.578 18792 10034 1 13 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.177 -0.900 18792 10035 1 13 . 1 1 75 75 GLN H H 75 7.640 7.640 7.638 0.002 18792 10036 1 13 . 1 1 76 76 LEU N N 76 118.313 118.313 113.742 4.571 18792 10037 1 13 . 1 1 76 76 LEU C C 76 174.160 174.160 177.036 -2.876 18792 10038 1 13 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.306 -0.566 18792 10039 1 13 . 1 1 76 76 LEU CB C 76 42.727 42.727 44.694 -1.968 18792 10040 1 13 . 1 1 76 76 LEU H H 76 7.411 7.411 7.523 -0.112 18792 10041 1 13 . 1 1 77 77 HIS N N 77 120.104 120.104 116.208 3.896 18792 10042 1 13 . 1 1 77 77 HIS C C 77 174.528 174.528 174.184 0.344 18792 10043 1 13 . 1 1 77 77 HIS CA C 77 54.207 54.207 59.692 -5.485 18792 10044 1 13 . 1 1 77 77 HIS CB C 77 27.966 27.966 29.419 -1.453 18792 10045 1 13 . 1 1 77 77 HIS H H 77 8.117 8.117 8.052 0.065 18792 10046 1 13 . 1 1 78 78 ILE N N 78 122.298 122.298 116.717 5.581 18792 10047 1 13 . 1 1 78 78 ILE C C 78 174.240 174.240 176.007 -1.767 18792 10048 1 13 . 1 1 78 78 ILE CA C 78 61.402 61.402 62.294 -0.892 18792 10049 1 13 . 1 1 78 78 ILE CB C 78 37.591 37.591 40.340 -2.749 18792 10050 1 13 . 1 1 78 78 ILE H H 78 8.655 8.655 8.205 0.450 18792 10051 1 13 . 1 1 79 79 THR N N 79 116.442 116.442 117.814 -1.372 18792 10052 1 13 . 1 1 79 79 THR C C 79 174.291 174.291 174.120 0.171 18792 10053 1 13 . 1 1 79 79 THR CA C 79 61.632 61.632 65.982 -4.350 18792 10054 1 13 . 1 1 79 79 THR CB C 79 68.704 68.704 66.832 1.872 18792 10055 1 13 . 1 1 79 79 THR H H 79 8.245 8.245 8.298 -0.053 18792 10056 1 13 . 1 1 84 84 TYR N N 84 120.888 120.888 119.225 1.663 18792 10057 1 13 . 1 1 84 84 TYR C C 84 176.708 176.708 178.235 -1.527 18792 10058 1 13 . 1 1 84 84 TYR CA C 84 60.432 60.432 62.638 -2.206 18792 10059 1 13 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.233 -1.488 18792 10060 1 13 . 1 1 84 84 TYR H H 84 8.733 8.733 9.016 -0.283 18792 10061 1 13 . 1 1 85 85 GLN N N 85 114.530 114.530 118.431 -3.901 18792 10062 1 13 . 1 1 85 85 GLN C C 85 178.473 178.473 178.414 0.059 18792 10063 1 13 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.965 -0.671 18792 10064 1 13 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.699 -0.898 18792 10065 1 13 . 1 1 85 85 GLN H H 85 8.413 8.413 8.901 -0.488 18792 10066 1 13 . 1 1 86 86 SER N N 86 114.032 114.032 115.823 -1.791 18792 10067 1 13 . 1 1 86 86 SER C C 86 178.473 178.473 176.630 1.843 18792 10068 1 13 . 1 1 86 86 SER CA C 86 62.175 62.175 61.255 0.920 18792 10069 1 13 . 1 1 86 86 SER CB C 86 63.252 63.252 62.678 0.574 18792 10070 1 13 . 1 1 86 86 SER H H 86 7.258 7.258 8.166 -0.908 18792 10071 1 13 . 1 1 88 88 GLU N N 88 119.386 119.386 119.166 0.220 18792 10072 1 13 . 1 1 88 88 GLU C C 88 177.199 177.199 178.502 -1.303 18792 10073 1 13 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.386 -0.804 18792 10074 1 13 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.232 -0.256 18792 10075 1 13 . 1 1 88 88 GLU H H 88 8.534 8.534 7.787 0.747 18792 10076 1 13 . 1 1 89 89 GLN N N 89 114.678 114.678 120.370 -5.692 18792 10077 1 13 . 1 1 89 89 GLN C C 89 178.669 178.669 177.998 0.671 18792 10078 1 13 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.955 -0.373 18792 10079 1 13 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.526 -1.104 18792 10080 1 13 . 1 1 89 89 GLN H H 89 7.500 7.500 7.700 -0.200 18792 10081 1 13 . 1 1 90 90 VAL N N 90 118.174 118.174 119.123 -0.949 18792 10082 1 13 . 1 1 90 90 VAL C C 90 178.081 178.081 177.234 0.847 18792 10083 1 13 . 1 1 90 90 VAL CA C 90 65.555 65.555 66.101 -0.546 18792 10084 1 13 . 1 1 90 90 VAL CB C 90 30.607 30.607 32.088 -1.481 18792 10085 1 13 . 1 1 90 90 VAL H H 90 7.017 7.017 8.154 -1.137 18792 10086 1 13 . 1 1 91 91 VAL N N 91 119.489 119.489 117.041 2.448 18792 10087 1 13 . 1 1 91 91 VAL C C 91 177.914 177.914 177.701 0.213 18792 10088 1 13 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.136 -0.367 18792 10089 1 13 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.971 -0.680 18792 10090 1 13 . 1 1 91 91 VAL H H 91 7.833 7.833 7.717 0.116 18792 10091 1 13 . 1 1 92 92 ASN N N 92 117.180 117.180 118.669 -1.489 18792 10092 1 13 . 1 1 92 92 ASN C C 92 179.110 179.110 177.186 1.924 18792 10093 1 13 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.174 -1.256 18792 10094 1 13 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.690 -2.722 18792 10095 1 13 . 1 1 92 92 ASN H H 92 8.368 8.368 8.321 0.047 18792 10096 1 13 . 1 1 93 93 GLU N N 93 118.476 118.476 119.233 -0.757 18792 10097 1 13 . 1 1 93 93 GLU C C 93 179.355 179.355 179.420 -0.065 18792 10098 1 13 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.200 -0.795 18792 10099 1 13 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.005 -2.272 18792 10100 1 13 . 1 1 93 93 GLU H H 93 7.213 7.213 8.102 -0.889 18792 10101 1 13 . 1 1 94 94 LEU N N 94 120.889 120.889 121.153 -0.264 18792 10102 1 13 . 1 1 94 94 LEU C C 94 178.473 178.473 178.658 -0.185 18792 10103 1 13 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.134 -0.117 18792 10104 1 13 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.848 -1.918 18792 10105 1 13 . 1 1 94 94 LEU H H 94 7.446 7.446 7.959 -0.513 18792 10106 1 13 . 1 1 95 95 PHE N N 95 112.902 112.902 118.802 -5.900 18792 10107 1 13 . 1 1 95 95 PHE C C 95 176.586 176.586 176.240 0.346 18792 10108 1 13 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.771 -2.612 18792 10109 1 13 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.151 -0.930 18792 10110 1 13 . 1 1 95 95 PHE H H 95 6.916 6.916 7.756 -0.840 18792 10111 1 13 . 1 1 96 96 ARG N N 96 123.729 123.729 118.593 5.136 18792 10112 1 13 . 1 1 96 96 ARG C C 96 177.272 177.272 177.296 -0.024 18792 10113 1 13 . 1 1 96 96 ARG CA C 96 59.223 59.223 57.728 1.495 18792 10114 1 13 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.202 -1.770 18792 10115 1 13 . 1 1 96 96 ARG H H 96 7.126 7.126 7.684 -0.558 18792 10116 1 13 . 1 1 97 97 ASP N N 97 116.576 116.576 114.516 2.060 18792 10117 1 13 . 1 1 97 97 ASP C C 97 175.687 175.687 176.567 -0.880 18792 10118 1 13 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.430 -0.757 18792 10119 1 13 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.543 -2.498 18792 10120 1 13 . 1 1 97 97 ASP H H 97 8.644 8.644 7.863 0.781 18792 10121 1 13 . 1 1 98 98 GLY N N 98 108.551 108.551 107.841 0.710 18792 10122 1 13 . 1 1 98 98 GLY C C 98 172.690 172.690 172.176 0.514 18792 10123 1 13 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.495 -2.245 18792 10124 1 13 . 1 1 98 98 GLY H H 98 7.463 7.463 7.417 0.046 18792 10125 1 13 . 1 1 99 99 VAL N N 99 120.630 120.630 117.155 3.475 18792 10126 1 13 . 1 1 99 99 VAL C C 99 174.503 174.503 173.395 1.108 18792 10127 1 13 . 1 1 99 99 VAL CA C 99 62.318 62.318 62.427 -0.109 18792 10128 1 13 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.908 -2.145 18792 10129 1 13 . 1 1 99 99 VAL H H 99 8.184 8.184 7.450 0.734 18792 10130 1 13 . 1 1 100 100 ASN N N 100 115.485 115.485 116.844 -1.359 18792 10131 1 13 . 1 1 100 100 ASN C C 100 175.239 175.239 176.957 -1.718 18792 10132 1 13 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.142 -2.781 18792 10133 1 13 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.367 0.553 18792 10134 1 13 . 1 1 100 100 ASN H H 100 6.241 6.241 6.793 -0.552 18792 10135 1 13 . 1 1 101 101 TRP N N 101 118.266 118.266 121.477 -3.211 18792 10136 1 13 . 1 1 101 101 TRP C C 101 178.301 178.301 176.458 1.843 18792 10137 1 13 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.257 1.282 18792 10138 1 13 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.305 1.525 18792 10139 1 13 . 1 1 101 101 TRP H H 101 8.409 8.409 8.203 0.206 18792 10140 1 13 . 1 1 102 102 GLY N N 102 106.147 106.147 106.528 -0.381 18792 10141 1 13 . 1 1 102 102 GLY C C 102 177.640 177.640 175.146 2.494 18792 10142 1 13 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.744 2.170 18792 10143 1 13 . 1 1 102 102 GLY H H 102 8.504 8.504 7.451 1.053 18792 10144 1 13 . 1 1 103 103 ARG N N 103 121.347 121.347 121.700 -0.353 18792 10145 1 13 . 1 1 103 103 ARG C C 103 177.738 177.738 177.716 0.022 18792 10146 1 13 . 1 1 103 103 ARG CA C 103 57.942 57.942 59.101 -1.159 18792 10147 1 13 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.338 -0.119 18792 10148 1 13 . 1 1 103 103 ARG H H 103 8.099 8.099 8.016 0.083 18792 10149 1 13 . 1 1 104 104 ILE N N 104 120.930 120.930 120.002 0.928 18792 10150 1 13 . 1 1 104 104 ILE C C 104 178.197 178.197 177.534 0.663 18792 10151 1 13 . 1 1 104 104 ILE CA C 104 66.535 66.535 63.035 3.500 18792 10152 1 13 . 1 1 104 104 ILE CB C 104 36.045 36.045 36.604 -0.559 18792 10153 1 13 . 1 1 104 104 ILE H H 104 7.690 7.690 8.036 -0.346 18792 10154 1 13 . 1 1 105 105 VAL N N 105 120.938 120.938 120.170 0.768 18792 10155 1 13 . 1 1 105 105 VAL C C 105 177.854 177.854 176.764 1.090 18792 10156 1 13 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.027 1.431 18792 10157 1 13 . 1 1 105 105 VAL CB C 105 30.374 30.374 31.146 -0.772 18792 10158 1 13 . 1 1 105 105 VAL H H 105 8.245 8.245 7.585 0.660 18792 10159 1 13 . 1 1 106 106 ALA N N 106 121.165 121.165 122.256 -1.091 18792 10160 1 13 . 1 1 106 106 ALA C C 106 178.284 178.284 178.678 -0.394 18792 10161 1 13 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.322 0.276 18792 10162 1 13 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.023 -0.508 18792 10163 1 13 . 1 1 106 106 ALA H H 106 7.529 7.529 7.252 0.277 18792 10164 1 13 . 1 1 107 107 PHE N N 107 119.242 119.242 119.958 -0.716 18792 10165 1 13 . 1 1 107 107 PHE C C 107 176.390 176.390 176.768 -0.378 18792 10166 1 13 . 1 1 107 107 PHE CA C 107 60.173 60.173 59.580 0.593 18792 10167 1 13 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.285 -2.198 18792 10168 1 13 . 1 1 107 107 PHE H H 107 7.974 7.974 8.400 -0.426 18792 10169 1 13 . 1 1 108 108 PHE N N 108 120.009 120.009 119.973 0.036 18792 10170 1 13 . 1 1 108 108 PHE C C 108 177.640 177.640 176.370 1.270 18792 10171 1 13 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.856 1.568 18792 10172 1 13 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.291 -2.945 18792 10173 1 13 . 1 1 108 108 PHE H H 108 7.946 7.946 8.278 -0.332 18792 10174 1 13 . 1 1 109 109 SER N N 109 114.631 114.631 116.231 -1.600 18792 10175 1 13 . 1 1 109 109 SER C C 109 177.770 177.770 176.142 1.628 18792 10176 1 13 . 1 1 109 109 SER CA C 109 63.349 63.349 61.514 1.835 18792 10177 1 13 . 1 1 109 109 SER H H 109 8.424 8.424 7.103 1.321 18792 10178 1 13 . 1 1 110 110 PHE N N 110 124.230 124.230 121.833 2.397 18792 10179 1 13 . 1 1 110 110 PHE C C 110 176.708 176.708 178.494 -1.786 18792 10180 1 13 . 1 1 110 110 PHE CA C 110 59.614 59.614 58.387 1.227 18792 10181 1 13 . 1 1 110 110 PHE CB C 110 37.444 37.444 37.981 -0.537 18792 10182 1 13 . 1 1 110 110 PHE H H 110 9.052 9.052 7.993 1.059 18792 10183 1 13 . 1 1 111 111 GLY N N 111 105.893 105.893 106.627 -0.734 18792 10184 1 13 . 1 1 111 111 GLY C C 111 176.795 176.795 176.131 0.664 18792 10185 1 13 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.670 0.706 18792 10186 1 13 . 1 1 111 111 GLY H H 111 7.926 7.926 8.487 -0.561 18792 10187 1 13 . 1 1 112 112 GLY N N 112 107.410 107.410 108.805 -1.395 18792 10188 1 13 . 1 1 112 112 GLY C C 112 174.650 174.650 175.739 -1.089 18792 10189 1 13 . 1 1 112 112 GLY CA C 112 47.305 47.305 45.835 1.470 18792 10190 1 13 . 1 1 112 112 GLY H H 112 8.799 8.799 7.993 0.806 18792 10191 1 13 . 1 1 113 113 ALA N N 113 124.313 124.313 125.933 -1.620 18792 10192 1 13 . 1 1 113 113 ALA C C 113 181.300 181.300 179.164 2.136 18792 10193 1 13 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.934 -0.407 18792 10194 1 13 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.985 -1.502 18792 10195 1 13 . 1 1 113 113 ALA H H 113 8.212 8.212 7.781 0.431 18792 10196 1 13 . 1 1 114 114 LEU N N 114 118.878 118.878 116.772 2.106 18792 10197 1 13 . 1 1 114 114 LEU C C 114 180.286 180.286 178.546 1.740 18792 10198 1 13 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.910 -0.928 18792 10199 1 13 . 1 1 114 114 LEU CB C 114 41.017 41.017 40.993 0.023 18792 10200 1 13 . 1 1 114 114 LEU H H 114 8.161 8.161 8.150 0.011 18792 10201 1 13 . 1 1 115 115 CYS N N 115 119.002 119.002 118.083 0.919 18792 10202 1 13 . 1 1 115 115 CYS C C 115 176.087 176.087 176.540 -0.453 18792 10203 1 13 . 1 1 115 115 CYS CA C 115 63.944 63.944 61.709 2.235 18792 10204 1 13 . 1 1 115 115 CYS CB C 115 25.635 25.635 26.691 -1.056 18792 10205 1 13 . 1 1 115 115 CYS H H 115 8.070 8.070 7.694 0.376 18792 10206 1 13 . 1 1 116 116 VAL N N 116 118.737 118.737 122.168 -3.431 18792 10207 1 13 . 1 1 116 116 VAL C C 116 177.494 177.494 177.816 -0.322 18792 10208 1 13 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.567 0.195 18792 10209 1 13 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.621 -0.858 18792 10210 1 13 . 1 1 116 116 VAL H H 116 7.995 7.995 7.624 0.371 18792 10211 1 13 . 1 1 117 117 GLU N N 117 118.886 118.886 120.139 -1.253 18792 10212 1 13 . 1 1 117 117 GLU C C 117 178.424 178.424 178.772 -0.348 18792 10213 1 13 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.519 -0.759 18792 10214 1 13 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.502 -1.448 18792 10215 1 13 . 1 1 117 117 GLU H H 117 8.059 8.059 8.021 0.038 18792 10216 1 13 . 1 1 118 118 SER N N 118 113.417 113.417 115.943 -2.526 18792 10217 1 13 . 1 1 118 118 SER C C 118 175.607 175.607 176.812 -1.205 18792 10218 1 13 . 1 1 118 118 SER CA C 118 62.638 62.638 61.687 0.951 18792 10219 1 13 . 1 1 118 118 SER CB C 118 61.061 61.061 63.356 -2.295 18792 10220 1 13 . 1 1 118 118 SER H H 118 7.626 7.626 7.591 0.035 18792 10221 1 13 . 1 1 119 119 VAL N N 119 120.612 120.612 119.195 1.417 18792 10222 1 13 . 1 1 119 119 VAL C C 119 179.713 179.713 177.571 2.142 18792 10223 1 13 . 1 1 119 119 VAL CA C 119 66.225 66.225 66.210 0.014 18792 10224 1 13 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.562 -1.483 18792 10225 1 13 . 1 1 119 119 VAL H H 119 7.297 7.297 7.865 -0.568 18792 10226 1 13 . 1 1 120 120 ASP N N 120 122.546 122.546 120.331 2.215 18792 10227 1 13 . 1 1 120 120 ASP C C 120 178.057 178.057 177.475 0.582 18792 10228 1 13 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.234 0.755 18792 10229 1 13 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.981 -1.058 18792 10230 1 13 . 1 1 120 120 ASP H H 120 8.264 8.264 7.818 0.446 18792 10231 1 13 . 1 1 121 121 LYS N N 121 115.636 115.636 118.167 -2.531 18792 10232 1 13 . 1 1 121 121 LYS C C 121 175.159 175.159 175.552 -0.393 18792 10233 1 13 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.166 -0.906 18792 10234 1 13 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.664 -1.889 18792 10235 1 13 . 1 1 121 121 LYS H H 121 7.558 7.558 7.260 0.298 18792 10236 1 13 . 1 1 122 122 GLU N N 122 113.915 113.915 117.102 -3.187 18792 10237 1 13 . 1 1 122 122 GLU C C 122 176.109 176.109 175.698 0.411 18792 10238 1 13 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.579 -0.272 18792 10239 1 13 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.337 -3.005 18792 10240 1 13 . 1 1 122 122 GLU H H 122 7.826 7.826 7.691 0.135 18792 10241 1 13 . 1 1 124 124 GLN N N 124 119.233 119.233 120.515 -1.282 18792 10242 1 13 . 1 1 124 124 GLN C C 124 177.640 177.640 176.974 0.666 18792 10243 1 13 . 1 1 124 124 GLN CA C 124 59.472 59.472 59.017 0.455 18792 10244 1 13 . 1 1 124 124 GLN CB C 124 26.490 26.490 27.017 -0.527 18792 10245 1 13 . 1 1 124 124 GLN H H 124 8.626 8.626 8.481 0.145 18792 10246 1 13 . 1 1 125 125 VAL N N 125 117.011 117.011 116.519 0.492 18792 10247 1 13 . 1 1 125 125 VAL C C 125 175.826 175.826 177.169 -1.343 18792 10248 1 13 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.753 -1.617 18792 10249 1 13 . 1 1 125 125 VAL CB C 125 30.297 30.297 30.823 -0.526 18792 10250 1 13 . 1 1 125 125 VAL H H 125 7.870 7.870 7.573 0.297 18792 10251 1 13 . 1 1 126 126 LEU N N 126 117.058 117.058 119.527 -2.469 18792 10252 1 13 . 1 1 126 126 LEU C C 126 178.096 178.096 178.215 -0.119 18792 10253 1 13 . 1 1 126 126 LEU CA C 126 55.085 55.085 56.925 -1.840 18792 10254 1 13 . 1 1 126 126 LEU CB C 126 40.273 40.273 41.723 -1.450 18792 10255 1 13 . 1 1 126 126 LEU H H 126 7.747 7.747 8.082 -0.335 18792 10256 1 13 . 1 1 127 127 VAL N N 127 119.457 119.457 119.597 -0.140 18792 10257 1 13 . 1 1 127 127 VAL C C 127 177.150 177.150 178.094 -0.944 18792 10258 1 13 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.928 0.228 18792 10259 1 13 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.955 -1.202 18792 10260 1 13 . 1 1 127 127 VAL H H 127 7.306 7.306 7.898 -0.592 18792 10261 1 13 . 1 1 128 128 SER N N 128 110.647 110.647 114.563 -3.916 18792 10262 1 13 . 1 1 128 128 SER C C 128 177.222 177.222 176.922 0.300 18792 10263 1 13 . 1 1 128 128 SER CA C 128 60.752 60.752 61.450 -0.698 18792 10264 1 13 . 1 1 128 128 SER CB C 128 61.605 61.605 63.269 -1.664 18792 10265 1 13 . 1 1 128 128 SER H H 128 8.237 8.237 8.082 0.155 18792 10266 1 13 . 1 1 129 129 ARG N N 129 123.100 123.100 122.211 0.889 18792 10267 1 13 . 1 1 129 129 ARG C C 129 175.802 175.802 178.896 -3.094 18792 10268 1 13 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.699 -0.472 18792 10269 1 13 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.302 -2.103 18792 10270 1 13 . 1 1 129 129 ARG H H 129 6.564 6.564 7.863 -1.299 18792 10271 1 13 . 1 1 130 130 ILE N N 130 118.182 118.182 116.782 1.400 18792 10272 1 13 . 1 1 130 130 ILE C C 130 178.156 178.156 178.092 0.064 18792 10273 1 13 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.181 -0.835 18792 10274 1 13 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.478 -0.797 18792 10275 1 13 . 1 1 130 130 ILE H H 130 7.955 7.955 8.453 -0.498 18792 10276 1 13 . 1 1 131 131 ALA N N 131 119.029 119.029 122.228 -3.199 18792 10277 1 13 . 1 1 131 131 ALA C C 131 179.593 179.593 179.460 0.133 18792 10278 1 13 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.098 -0.500 18792 10279 1 13 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.155 -0.767 18792 10280 1 13 . 1 1 131 131 ALA H H 131 7.582 7.582 8.812 -1.230 18792 10281 1 13 . 1 1 132 132 ALA N N 132 120.336 120.336 121.716 -1.380 18792 10282 1 13 . 1 1 132 132 ALA C C 132 181.095 181.095 179.067 2.028 18792 10283 1 13 . 1 1 132 132 ALA CA C 132 54.598 54.598 55.096 -0.498 18792 10284 1 13 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.745 -2.044 18792 10285 1 13 . 1 1 132 132 ALA H H 132 7.224 7.224 8.189 -0.965 18792 10286 1 13 . 1 1 133 133 TRP N N 133 121.194 121.194 120.773 0.421 18792 10287 1 13 . 1 1 133 133 TRP C C 133 179.698 179.698 178.077 1.621 18792 10288 1 13 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.141 -2.839 18792 10289 1 13 . 1 1 133 133 TRP CB C 133 27.655 27.655 30.541 -2.886 18792 10290 1 13 . 1 1 133 133 TRP H H 133 8.925 8.925 8.601 0.324 18792 10291 1 13 . 1 1 134 134 MET N N 134 116.987 116.987 117.057 -0.070 18792 10292 1 13 . 1 1 134 134 MET C C 134 178.277 178.277 177.656 0.621 18792 10293 1 13 . 1 1 134 134 MET CA C 134 59.578 59.578 58.229 1.349 18792 10294 1 13 . 1 1 134 134 MET CB C 134 33.559 33.559 31.693 1.866 18792 10295 1 13 . 1 1 134 134 MET H H 134 8.863 8.863 8.956 -0.093 18792 10296 1 13 . 1 1 135 135 ALA N N 135 120.523 120.523 121.763 -1.240 18792 10297 1 13 . 1 1 135 135 ALA C C 135 179.298 179.298 179.479 -0.181 18792 10298 1 13 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.014 0.419 18792 10299 1 13 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.162 -1.524 18792 10300 1 13 . 1 1 135 135 ALA H H 135 8.152 8.152 8.047 0.105 18792 10301 1 13 . 1 1 136 136 THR N N 136 116.715 116.715 117.480 -0.765 18792 10302 1 13 . 1 1 136 136 THR C C 136 175.106 175.106 176.107 -1.001 18792 10303 1 13 . 1 1 136 136 THR CA C 136 66.729 66.729 67.094 -0.365 18792 10304 1 13 . 1 1 136 136 THR CB C 136 68.441 68.441 68.806 -0.365 18792 10305 1 13 . 1 1 136 136 THR H H 136 8.532 8.532 7.581 0.951 18792 10306 1 13 . 1 1 137 137 TYR N N 137 123.204 123.204 122.388 0.816 18792 10307 1 13 . 1 1 137 137 TYR C C 137 179.592 179.592 177.138 2.454 18792 10308 1 13 . 1 1 137 137 TYR CA C 137 63.065 63.065 59.880 3.186 18792 10309 1 13 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.670 0.318 18792 10310 1 13 . 1 1 137 137 TYR H H 137 8.809 8.809 7.650 1.159 18792 10311 1 13 . 1 1 138 138 LEU N N 138 119.247 119.247 120.461 -1.214 18792 10312 1 13 . 1 1 138 138 LEU C C 138 178.385 178.385 177.969 0.416 18792 10313 1 13 . 1 1 138 138 LEU CA C 138 58.938 58.938 57.994 0.944 18792 10314 1 13 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.882 -0.174 18792 10315 1 13 . 1 1 138 138 LEU H H 138 8.742 8.742 7.842 0.900 18792 10316 1 13 . 1 1 139 139 ASN N N 139 117.122 117.122 115.632 1.490 18792 10317 1 13 . 1 1 139 139 ASN C C 139 176.417 176.417 177.213 -0.796 18792 10318 1 13 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.366 1.082 18792 10319 1 13 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.338 0.314 18792 10320 1 13 . 1 1 139 139 ASN H H 139 8.307 8.307 7.727 0.580 18792 10321 1 13 . 1 1 140 140 ASP N N 140 115.394 115.394 119.231 -3.837 18792 10322 1 13 . 1 1 140 140 ASP C C 140 177.919 177.919 176.944 0.975 18792 10323 1 13 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.826 -0.873 18792 10324 1 13 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.996 -1.610 18792 10325 1 13 . 1 1 140 140 ASP H H 140 8.439 8.439 8.188 0.251 18792 10326 1 13 . 1 1 141 141 HIS N N 141 111.695 111.695 113.717 -2.022 18792 10327 1 13 . 1 1 141 141 HIS C C 141 175.949 175.949 176.406 -0.457 18792 10328 1 13 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.154 -0.097 18792 10329 1 13 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.373 -2.466 18792 10330 1 13 . 1 1 141 141 HIS H H 141 8.043 8.043 7.094 0.949 18792 10331 1 13 . 1 1 142 142 LEU N N 142 117.054 117.054 122.140 -5.086 18792 10332 1 13 . 1 1 142 142 LEU C C 142 176.530 176.530 177.471 -0.941 18792 10333 1 13 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.768 -2.459 18792 10334 1 13 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.588 0.750 18792 10335 1 13 . 1 1 142 142 LEU H H 142 7.198 7.198 7.698 -0.500 18792 10336 1 13 . 1 1 143 143 GLU N N 143 121.335 121.335 120.286 1.049 18792 10337 1 13 . 1 1 143 143 GLU C C 143 173.964 173.964 175.635 -1.671 18792 10338 1 13 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.394 -0.140 18792 10339 1 13 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.247 -1.990 18792 10340 1 13 . 1 1 143 143 GLU H H 143 8.565 8.565 7.761 0.804 18792 10341 1 13 . 1 1 145 145 TRP N N 145 117.973 117.973 120.174 -2.201 18792 10342 1 13 . 1 1 145 145 TRP C C 145 179.526 179.526 177.701 1.825 18792 10343 1 13 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.317 1.289 18792 10344 1 13 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.494 -1.605 18792 10345 1 13 . 1 1 145 145 TRP H H 145 7.078 7.078 8.236 -1.158 18792 10346 1 13 . 1 1 146 146 ILE N N 146 122.101 122.101 111.730 10.371 18792 10347 1 13 . 1 1 146 146 ILE C C 146 179.110 179.110 176.983 2.127 18792 10348 1 13 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.492 3.842 18792 10349 1 13 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.189 -1.367 18792 10350 1 13 . 1 1 146 146 ILE H H 146 8.389 8.389 7.505 0.884 18792 10351 1 13 . 1 1 147 147 GLN N N 147 116.344 116.344 121.091 -4.747 18792 10352 1 13 . 1 1 147 147 GLN C C 147 179.526 179.526 177.367 2.159 18792 10353 1 13 . 1 1 147 147 GLN CA C 147 58.013 58.013 59.150 -1.137 18792 10354 1 13 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.660 -0.937 18792 10355 1 13 . 1 1 147 147 GLN H H 147 8.376 8.376 8.014 0.362 18792 10356 1 13 . 1 1 148 148 GLU N N 148 118.913 118.913 119.840 -0.927 18792 10357 1 13 . 1 1 148 148 GLU C C 148 176.880 176.880 177.653 -0.773 18792 10358 1 13 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.112 -2.740 18792 10359 1 13 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.583 -1.151 18792 10360 1 13 . 1 1 148 148 GLU H H 148 7.504 7.504 7.876 -0.372 18792 10361 1 13 . 1 1 149 149 ASN N N 149 116.616 116.616 112.938 3.678 18792 10362 1 13 . 1 1 149 149 ASN C C 149 173.964 173.964 177.017 -3.053 18792 10363 1 13 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.551 -0.305 18792 10364 1 13 . 1 1 149 149 ASN CB C 149 37.133 37.133 38.934 -1.801 18792 10365 1 13 . 1 1 149 149 ASN H H 149 7.070 7.070 7.870 -0.800 18792 10366 1 13 . 1 1 150 150 GLY N N 150 104.750 104.750 106.839 -2.089 18792 10367 1 13 . 1 1 150 150 GLY C C 150 176.022 176.022 174.074 1.948 18792 10368 1 13 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.304 -0.062 18792 10369 1 13 . 1 1 150 150 GLY H H 150 7.313 7.313 8.091 -0.778 18792 10370 1 13 . 1 1 151 151 GLY N N 151 108.385 108.385 107.398 0.987 18792 10371 1 13 . 1 1 151 151 GLY C C 151 173.449 173.449 175.643 -2.194 18792 10372 1 13 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.196 -1.163 18792 10373 1 13 . 1 1 151 151 GLY H H 151 8.452 8.452 7.260 1.192 18792 10374 1 13 . 1 1 152 152 TRP N N 152 118.092 118.092 122.124 -4.032 18792 10375 1 13 . 1 1 152 152 TRP C C 152 178.571 178.571 177.921 0.650 18792 10376 1 13 . 1 1 152 152 TRP CA C 152 60.077 60.077 59.528 0.549 18792 10377 1 13 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.030 -0.442 18792 10378 1 13 . 1 1 152 152 TRP H H 152 8.644 8.644 8.497 0.147 18792 10379 1 13 . 1 1 153 153 ASP N N 153 117.758 117.758 117.554 0.204 18792 10380 1 13 . 1 1 153 153 ASP C C 153 179.796 179.796 178.591 1.205 18792 10381 1 13 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.671 -0.369 18792 10382 1 13 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.787 -1.556 18792 10383 1 13 . 1 1 153 153 ASP H H 153 8.827 8.827 8.423 0.404 18792 10384 1 13 . 1 1 154 154 THR N N 154 116.817 116.817 117.480 -0.663 18792 10385 1 13 . 1 1 154 154 THR C C 154 175.352 175.352 176.952 -1.600 18792 10386 1 13 . 1 1 154 154 THR CA C 154 65.910 65.910 66.691 -0.781 18792 10387 1 13 . 1 1 154 154 THR CB C 154 67.712 67.712 69.128 -1.416 18792 10388 1 13 . 1 1 154 154 THR H H 154 7.494 7.494 7.632 -0.138 18792 10389 1 13 . 1 1 155 155 PHE N N 155 122.196 122.196 121.662 0.534 18792 10390 1 13 . 1 1 155 155 PHE C C 155 176.831 176.831 177.603 -0.772 18792 10391 1 13 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.031 0.255 18792 10392 1 13 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.292 -1.625 18792 10393 1 13 . 1 1 155 155 PHE H H 155 6.477 6.477 8.796 -2.319 18792 10394 1 13 . 1 1 156 156 VAL N N 156 117.387 117.387 119.079 -1.692 18792 10395 1 13 . 1 1 156 156 VAL C C 156 178.497 178.497 178.014 0.483 18792 10396 1 13 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.572 -0.341 18792 10397 1 13 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.193 -0.508 18792 10398 1 13 . 1 1 156 156 VAL H H 156 7.788 7.788 8.584 -0.796 18792 10399 1 13 . 1 1 157 157 GLU N N 157 119.876 119.876 120.572 -0.696 18792 10400 1 13 . 1 1 157 157 GLU C C 157 178.399 178.399 179.269 -0.870 18792 10401 1 13 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.746 -0.986 18792 10402 1 13 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.565 -1.288 18792 10403 1 13 . 1 1 157 157 GLU H H 157 7.409 7.409 8.098 -0.689 18792 10404 1 13 . 1 1 158 158 LEU N N 158 117.194 117.194 119.775 -2.581 18792 10405 1 13 . 1 1 158 158 LEU C C 158 178.595 178.595 179.062 -0.467 18792 10406 1 13 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.591 -1.214 18792 10407 1 13 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.163 0.408 18792 10408 1 13 . 1 1 158 158 LEU H H 158 7.584 7.584 7.937 -0.353 18792 10409 1 13 . 1 1 159 159 TYR N N 159 115.549 115.549 119.352 -3.803 18792 10410 1 13 . 1 1 159 159 TYR C C 159 177.032 177.032 177.259 -0.227 18792 10411 1 13 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.855 -0.739 18792 10412 1 13 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.479 -0.880 18792 10413 1 13 . 1 1 159 159 TYR H H 159 8.099 8.099 7.981 0.118 18792 10414 1 13 . 1 1 160 160 GLY N N 160 108.334 108.334 107.319 1.015 18792 10415 1 13 . 1 1 160 160 GLY C C 160 173.973 173.973 175.038 -1.065 18792 10416 1 13 . 1 1 160 160 GLY CA C 160 45.064 45.064 45.715 -0.651 18792 10417 1 13 . 1 1 160 160 GLY H H 160 8.020 8.020 8.271 -0.251 18792 10418 1 13 . 1 1 161 161 ASN N N 161 118.189 118.189 118.602 -0.413 18792 10419 1 13 . 1 1 161 161 ASN C C 161 175.513 175.513 174.683 0.830 18792 10420 1 13 . 1 1 161 161 ASN CA C 161 53.104 53.104 53.623 -0.520 18792 10421 1 13 . 1 1 161 161 ASN CB C 161 38.203 38.203 40.522 -2.319 18792 10422 1 13 . 1 1 161 161 ASN H H 161 8.327 8.327 7.827 0.500 18792 10423 1 13 . 1 1 162 162 ASN N N 162 119.022 119.022 116.438 2.584 18792 10424 1 13 . 1 1 162 162 ASN C C 162 175.690 175.690 173.669 2.021 18792 10425 1 13 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.779 -0.355 18792 10426 1 13 . 1 1 162 162 ASN CB C 162 38.203 38.203 40.258 -2.055 18792 10427 1 13 . 1 1 162 162 ASN H H 162 8.363 8.363 8.056 0.307 18792 10428 1 13 . 1 1 163 163 ALA N N 163 123.275 123.275 127.255 -3.980 18792 10429 1 13 . 1 1 163 163 ALA C C 163 178.598 178.598 178.174 0.424 18792 10430 1 13 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.718 -0.480 18792 10431 1 13 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.971 -2.360 18792 10432 1 13 . 1 1 163 163 ALA H H 163 8.103 8.103 8.727 -0.624 18792 10433 1 13 . 1 1 164 164 ALA N N 164 121.521 121.521 121.516 0.005 18792 10434 1 13 . 1 1 164 164 ALA C C 164 178.642 178.642 178.195 0.447 18792 10435 1 13 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.137 -1.553 18792 10436 1 13 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.475 -0.656 18792 10437 1 13 . 1 1 164 164 ALA H H 164 8.053 8.053 8.607 -0.554 18792 10438 1 13 . 1 1 165 165 ALA N N 165 122.101 122.101 118.979 3.122 18792 10439 1 13 . 1 1 165 165 ALA C C 165 179.124 179.124 178.263 0.861 18792 10440 1 13 . 1 1 165 165 ALA CA C 165 53.139 53.139 53.457 -0.318 18792 10441 1 13 . 1 1 165 165 ALA CB C 165 17.978 17.978 19.223 -1.245 18792 10442 1 13 . 1 1 165 165 ALA H H 165 7.949 7.949 7.999 -0.050 18792 10443 1 13 . 1 1 166 166 GLU N N 166 118.381 118.381 118.222 0.159 18792 10444 1 13 . 1 1 166 166 GLU C C 166 177.664 177.664 177.379 0.285 18792 10445 1 13 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.313 0.775 18792 10446 1 13 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.964 -1.610 18792 10447 1 13 . 1 1 166 166 GLU H H 166 8.202 8.202 8.196 0.006 18792 10448 1 13 . 1 1 167 167 SER N N 167 115.193 115.193 115.923 -0.730 18792 10449 1 13 . 1 1 167 167 SER C C 167 175.312 175.312 174.380 0.932 18792 10450 1 13 . 1 1 167 167 SER CA C 167 58.831 58.831 60.643 -1.812 18792 10451 1 13 . 1 1 167 167 SER CB C 167 62.537 62.537 63.452 -0.915 18792 10452 1 13 . 1 1 167 167 SER H H 167 8.029 8.029 7.795 0.234 18792 10453 1 13 . 1 1 168 168 ARG N N 168 121.696 121.696 118.456 3.240 18792 10454 1 13 . 1 1 168 168 ARG C C 168 176.880 176.880 174.496 2.384 18792 10455 1 13 . 1 1 168 168 ARG CA C 168 56.163 56.163 57.123 -0.960 18792 10456 1 13 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.009 0.200 18792 10457 1 13 . 1 1 168 168 ARG H H 168 7.967 7.967 8.503 -0.536 18792 10458 1 13 . 1 1 169 169 LYS N N 169 120.917 120.917 120.024 0.893 18792 10459 1 13 . 1 1 169 169 LYS C C 169 177.640 177.640 175.604 2.036 18792 10460 1 13 . 1 1 169 169 LYS CA C 169 56.697 56.697 55.732 0.965 18792 10461 1 13 . 1 1 169 169 LYS CB C 169 31.462 31.462 34.451 -2.989 18792 10462 1 13 . 1 1 169 169 LYS H H 169 8.011 8.011 7.889 0.122 18792 10463 1 13 . 1 1 170 170 GLY N N 170 109.155 109.155 110.089 -0.934 18792 10464 1 13 . 1 1 170 170 GLY C C 170 174.479 174.479 173.158 1.321 18792 10465 1 13 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.358 0.706 18792 10466 1 13 . 1 1 170 170 GLY H H 170 8.329 8.329 8.462 -0.133 18792 10467 1 13 . 1 1 171 171 GLN N N 171 119.292 119.292 120.322 -1.030 18792 10468 1 13 . 1 1 171 171 GLN C C 171 176.463 176.463 175.302 1.161 18792 10469 1 13 . 1 1 171 171 GLN CA C 171 55.666 55.666 54.777 0.889 18792 10470 1 13 . 1 1 171 171 GLN CB C 171 28.199 28.199 31.241 -3.042 18792 10471 1 13 . 1 1 171 171 GLN H H 171 8.035 8.035 8.041 -0.006 18792 10472 1 13 . 1 1 172 172 GLU N N 172 121.703 121.703 120.080 1.623 18792 10473 1 13 . 1 1 172 172 GLU C C 172 176.414 176.414 175.288 1.126 18792 10474 1 13 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.233 1.109 18792 10475 1 13 . 1 1 172 172 GLU CB C 172 28.821 28.821 31.029 -2.208 18792 10476 1 13 . 1 1 172 172 GLU H H 172 8.405 8.405 8.591 -0.186 18792 10477 1 13 . 1 1 173 173 ARG N N 173 121.852 121.852 118.593 3.259 18792 10478 1 13 . 1 1 173 173 ARG C C 173 176.365 176.365 173.527 2.838 18792 10479 1 13 . 1 1 173 173 ARG CA C 173 56.199 56.199 56.230 -0.030 18792 10480 1 13 . 1 1 173 173 ARG CB C 173 29.131 29.131 32.157 -3.026 18792 10481 1 13 . 1 1 173 173 ARG H H 173 8.335 8.335 8.644 -0.309 18792 10482 1 13 . 1 1 174 174 LEU N N 174 122.640 122.640 126.741 -4.101 18792 10483 1 13 . 1 1 174 174 LEU C C 174 176.523 176.523 175.312 1.211 18792 10484 1 13 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.060 -0.292 18792 10485 1 13 . 1 1 174 174 LEU CB C 174 40.784 40.784 43.025 -2.241 18792 10486 1 13 . 1 1 174 174 LEU H H 174 8.082 8.082 8.584 -0.502 18792 10487 1 13 . 1 1 175 175 GLU N N 175 125.909 125.909 123.458 2.451 18792 10488 1 13 . 1 1 175 175 GLU C C 175 181.029 181.029 174.362 6.667 18792 10489 1 13 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.155 2.243 18792 10490 1 13 . 1 1 175 175 GLU CB C 175 30.050 30.050 33.384 -3.334 18792 10491 1 13 . 1 1 175 175 GLU H H 175 7.785 7.785 8.461 -0.676 18792 10492 1 14 . 1 1 4 4 ALA N N 4 124.786 124.786 124.665 0.121 18792 10493 1 14 . 1 1 4 4 ALA C C 4 178.272 178.272 179.214 -0.942 18792 10494 1 14 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.718 -2.152 18792 10495 1 14 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.903 -0.669 18792 10496 1 14 . 1 1 4 4 ALA H H 4 8.414 8.414 8.753 -0.339 18792 10497 1 14 . 1 1 5 5 MET N N 5 119.681 119.681 119.367 0.314 18792 10498 1 14 . 1 1 5 5 MET C C 5 176.929 176.929 177.090 -0.161 18792 10499 1 14 . 1 1 5 5 MET CA C 5 55.594 55.594 57.534 -1.940 18792 10500 1 14 . 1 1 5 5 MET CB C 5 31.540 31.540 32.140 -0.600 18792 10501 1 14 . 1 1 5 5 MET H H 5 8.336 8.336 8.527 -0.191 18792 10502 1 14 . 1 1 6 6 SER N N 6 116.162 116.162 115.472 0.690 18792 10503 1 14 . 1 1 6 6 SER C C 6 175.924 175.924 176.677 -0.753 18792 10504 1 14 . 1 1 6 6 SER CA C 6 59.009 59.009 61.500 -2.491 18792 10505 1 14 . 1 1 6 6 SER CB C 6 62.537 62.537 61.875 0.662 18792 10506 1 14 . 1 1 6 6 SER H H 6 8.272 8.272 8.444 -0.172 18792 10507 1 14 . 1 1 7 7 GLN N N 7 122.263 122.263 120.747 1.516 18792 10508 1 14 . 1 1 7 7 GLN C C 7 177.027 177.027 178.220 -1.193 18792 10509 1 14 . 1 1 7 7 GLN CA C 7 56.270 56.270 59.326 -3.056 18792 10510 1 14 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.531 -0.792 18792 10511 1 14 . 1 1 7 7 GLN H H 7 8.314 8.314 7.932 0.382 18792 10512 1 14 . 1 1 8 8 SER N N 8 116.625 116.625 116.198 0.427 18792 10513 1 14 . 1 1 8 8 SER C C 8 176.457 176.457 176.482 -0.025 18792 10514 1 14 . 1 1 8 8 SER CA C 8 59.650 59.650 62.209 -2.559 18792 10515 1 14 . 1 1 8 8 SER CB C 8 62.226 62.226 63.008 -0.782 18792 10516 1 14 . 1 1 8 8 SER H H 8 8.333 8.333 7.944 0.389 18792 10517 1 14 . 1 1 9 9 ASN N N 9 121.307 121.307 121.619 -0.312 18792 10518 1 14 . 1 1 9 9 ASN C C 9 177.419 177.419 177.273 0.146 18792 10519 1 14 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.415 -0.928 18792 10520 1 14 . 1 1 9 9 ASN CB C 9 37.133 37.133 39.054 -1.921 18792 10521 1 14 . 1 1 9 9 ASN H H 9 8.611 8.611 7.784 0.827 18792 10522 1 14 . 1 1 10 10 ARG N N 10 119.830 119.830 121.203 -1.373 18792 10523 1 14 . 1 1 10 10 ARG C C 10 177.615 177.615 178.318 -0.703 18792 10524 1 14 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.990 -0.732 18792 10525 1 14 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.228 -2.029 18792 10526 1 14 . 1 1 10 10 ARG H H 10 7.996 7.996 8.441 -0.445 18792 10527 1 14 . 1 1 11 11 GLU N N 11 117.270 117.270 119.685 -2.415 18792 10528 1 14 . 1 1 11 11 GLU C C 11 179.649 179.649 178.638 1.011 18792 10529 1 14 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.208 -0.199 18792 10530 1 14 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.492 -1.371 18792 10531 1 14 . 1 1 11 11 GLU H H 11 7.885 7.885 8.271 -0.386 18792 10532 1 14 . 1 1 12 12 LEU N N 12 119.900 119.900 120.799 -0.899 18792 10533 1 14 . 1 1 12 12 LEU C C 12 178.473 178.473 178.969 -0.496 18792 10534 1 14 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.173 -0.480 18792 10535 1 14 . 1 1 12 12 LEU CB C 12 40.629 40.629 42.056 -1.427 18792 10536 1 14 . 1 1 12 12 LEU H H 12 7.691 7.691 7.868 -0.177 18792 10537 1 14 . 1 1 13 13 VAL N N 13 117.320 117.320 118.104 -0.784 18792 10538 1 14 . 1 1 13 13 VAL C C 13 177.272 177.272 178.089 -0.817 18792 10539 1 14 . 1 1 13 13 VAL CA C 13 67.156 67.156 65.936 1.220 18792 10540 1 14 . 1 1 13 13 VAL CB C 13 31.229 31.229 30.963 0.266 18792 10541 1 14 . 1 1 13 13 VAL H H 13 7.629 7.629 7.803 -0.174 18792 10542 1 14 . 1 1 14 14 VAL N N 14 116.659 116.659 121.125 -4.466 18792 10543 1 14 . 1 1 14 14 VAL C C 14 178.718 178.718 178.043 0.675 18792 10544 1 14 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.788 -0.272 18792 10545 1 14 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.447 -1.073 18792 10546 1 14 . 1 1 14 14 VAL H H 14 8.210 8.210 7.939 0.271 18792 10547 1 14 . 1 1 15 15 ASP N N 15 120.374 120.374 121.147 -0.773 18792 10548 1 14 . 1 1 15 15 ASP C C 15 177.557 177.557 178.448 -0.891 18792 10549 1 14 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.349 1.127 18792 10550 1 14 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.562 1.991 18792 10551 1 14 . 1 1 15 15 ASP H H 15 7.967 7.967 8.790 -0.823 18792 10552 1 14 . 1 1 16 16 PHE N N 16 119.864 119.864 122.126 -2.262 18792 10553 1 14 . 1 1 16 16 PHE C C 16 178.252 178.252 177.108 1.144 18792 10554 1 14 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.316 2.464 18792 10555 1 14 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.783 0.277 18792 10556 1 14 . 1 1 16 16 PHE H H 16 8.228 8.228 8.086 0.142 18792 10557 1 14 . 1 1 17 17 LEU N N 17 116.312 116.312 119.250 -2.938 18792 10558 1 14 . 1 1 17 17 LEU C C 17 179.649 179.649 178.695 0.954 18792 10559 1 14 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.625 -0.861 18792 10560 1 14 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.625 -1.540 18792 10561 1 14 . 1 1 17 17 LEU H H 17 8.766 8.766 8.142 0.624 18792 10562 1 14 . 1 1 18 18 SER N N 18 113.715 113.715 114.956 -1.241 18792 10563 1 14 . 1 1 18 18 SER C C 18 177.362 177.362 176.415 0.947 18792 10564 1 14 . 1 1 18 18 SER CA C 18 61.948 61.948 61.322 0.626 18792 10565 1 14 . 1 1 18 18 SER CB C 18 63.003 63.003 63.241 -0.238 18792 10566 1 14 . 1 1 18 18 SER H H 18 8.384 8.384 8.214 0.170 18792 10567 1 14 . 1 1 19 19 TYR N N 19 124.570 124.570 122.845 1.725 18792 10568 1 14 . 1 1 19 19 TYR C C 19 178.415 178.415 177.464 0.951 18792 10569 1 14 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.861 -2.098 18792 10570 1 14 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.640 -1.624 18792 10571 1 14 . 1 1 19 19 TYR H H 19 8.155 8.155 8.779 -0.624 18792 10572 1 14 . 1 1 20 20 LYS N N 20 119.739 119.739 120.311 -0.572 18792 10573 1 14 . 1 1 20 20 LYS C C 20 180.456 180.456 178.976 1.480 18792 10574 1 14 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.142 -2.654 18792 10575 1 14 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.254 -4.095 18792 10576 1 14 . 1 1 20 20 LYS H H 20 8.224 8.224 7.854 0.370 18792 10577 1 14 . 1 1 21 21 LEU N N 21 118.092 118.092 120.048 -1.956 18792 10578 1 14 . 1 1 21 21 LEU C C 21 179.989 179.989 179.048 0.941 18792 10579 1 14 . 1 1 21 21 LEU CA C 21 58.126 58.126 57.847 0.279 18792 10580 1 14 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.762 -2.154 18792 10581 1 14 . 1 1 21 21 LEU H H 21 8.586 8.586 7.964 0.622 18792 10582 1 14 . 1 1 22 22 SER N N 22 117.304 117.304 113.839 3.465 18792 10583 1 14 . 1 1 22 22 SER C C 22 180.152 180.152 176.752 3.400 18792 10584 1 14 . 1 1 22 22 SER CA C 22 61.287 61.287 61.086 0.201 18792 10585 1 14 . 1 1 22 22 SER H H 22 8.266 8.266 7.775 0.491 18792 10586 1 14 . 1 1 23 23 GLN N N 23 122.497 122.497 122.099 0.398 18792 10587 1 14 . 1 1 23 23 GLN C C 23 177.297 177.297 177.444 -0.147 18792 10588 1 14 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.313 -0.371 18792 10589 1 14 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.424 -0.613 18792 10590 1 14 . 1 1 23 23 GLN H H 23 7.571 7.571 8.223 -0.652 18792 10591 1 14 . 1 1 24 24 LYS N N 24 116.038 116.038 116.446 -0.408 18792 10592 1 14 . 1 1 24 24 LYS C C 24 175.704 175.704 177.028 -1.324 18792 10593 1 14 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.749 -3.254 18792 10594 1 14 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.517 -2.288 18792 10595 1 14 . 1 1 24 24 LYS H H 24 7.134 7.134 7.795 -0.661 18792 10596 1 14 . 1 1 25 25 GLY N N 25 105.283 105.283 106.617 -1.334 18792 10597 1 14 . 1 1 25 25 GLY C C 25 174.013 174.013 173.672 0.341 18792 10598 1 14 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.773 0.006 18792 10599 1 14 . 1 1 25 25 GLY H H 25 7.483 7.483 8.004 -0.521 18792 10600 1 14 . 1 1 26 26 TYR N N 26 119.547 119.547 120.751 -1.204 18792 10601 1 14 . 1 1 26 26 TYR C C 26 175.122 175.122 174.511 0.611 18792 10602 1 14 . 1 1 26 26 TYR CA C 26 55.132 55.132 57.166 -2.034 18792 10603 1 14 . 1 1 26 26 TYR CB C 26 40.080 40.080 38.843 1.238 18792 10604 1 14 . 1 1 26 26 TYR H H 26 7.788 7.788 7.661 0.127 18792 10605 1 14 . 1 1 27 27 SER N N 27 115.088 115.088 119.545 -4.457 18792 10606 1 14 . 1 1 27 27 SER C C 27 174.452 174.452 175.148 -0.696 18792 10607 1 14 . 1 1 27 27 SER CA C 27 56.306 56.306 56.196 0.110 18792 10608 1 14 . 1 1 27 27 SER CB C 27 63.921 63.921 63.720 0.201 18792 10609 1 14 . 1 1 27 27 SER H H 27 8.473 8.473 8.442 0.031 18792 10610 1 14 . 1 1 28 28 TRP N N 28 127.014 127.014 128.014 -1.000 18792 10611 1 14 . 1 1 28 28 TRP C C 28 177.002 177.002 177.539 -0.537 18792 10612 1 14 . 1 1 28 28 TRP CA C 28 59.472 59.472 60.560 -1.088 18792 10613 1 14 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.027 0.803 18792 10614 1 14 . 1 1 28 28 TRP H H 28 8.897 8.897 8.909 -0.012 18792 10615 1 14 . 1 1 29 29 SER N N 29 112.044 112.044 111.215 0.829 18792 10616 1 14 . 1 1 29 29 SER C C 29 175.106 175.106 175.089 0.017 18792 10617 1 14 . 1 1 29 29 SER CA C 29 59.472 59.472 59.848 -0.376 18792 10618 1 14 . 1 1 29 29 SER CB C 29 62.226 62.226 62.569 -0.343 18792 10619 1 14 . 1 1 29 29 SER H H 29 8.129 8.129 8.212 -0.083 18792 10620 1 14 . 1 1 30 30 GLN N N 30 119.160 119.160 119.354 -0.194 18792 10621 1 14 . 1 1 30 30 GLN C C 30 176.218 176.218 175.157 1.061 18792 10622 1 14 . 1 1 30 30 GLN CA C 30 56.412 56.412 54.944 1.468 18792 10623 1 14 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.563 -0.985 18792 10624 1 14 . 1 1 30 30 GLN H H 30 7.370 7.370 7.414 -0.044 18792 10625 1 14 . 1 1 31 31 PHE N N 31 116.277 116.277 115.186 1.091 18792 10626 1 14 . 1 1 31 31 PHE C C 31 175.217 175.217 175.342 -0.125 18792 10627 1 14 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.306 -2.072 18792 10628 1 14 . 1 1 31 31 PHE CB C 31 39.066 39.066 35.326 3.740 18792 10629 1 14 . 1 1 31 31 PHE H H 31 7.248 7.248 7.206 0.042 18792 10630 1 14 . 1 1 32 32 SER N N 32 113.683 113.683 114.790 -1.107 18792 10631 1 14 . 1 1 32 32 SER C C 32 173.793 173.793 175.971 -2.178 18792 10632 1 14 . 1 1 32 32 SER CA C 32 57.124 57.124 59.259 -2.135 18792 10633 1 14 . 1 1 32 32 SER CB C 32 63.081 63.081 64.117 -1.036 18792 10634 1 14 . 1 1 32 32 SER H H 32 7.242 7.242 7.665 -0.423 18792 10635 1 14 . 1 1 33 33 ASP N N 33 122.195 122.195 120.214 1.981 18792 10636 1 14 . 1 1 33 33 ASP C C 33 176.394 176.394 177.107 -0.713 18792 10637 1 14 . 1 1 33 33 ASP CA C 33 53.748 53.748 56.999 -3.251 18792 10638 1 14 . 1 1 33 33 ASP CB C 33 40.398 40.398 41.069 -0.671 18792 10639 1 14 . 1 1 33 33 ASP H H 33 8.257 8.257 8.695 -0.438 18792 10640 1 14 . 1 1 34 34 VAL N N 34 118.913 118.913 117.172 1.741 18792 10641 1 14 . 1 1 34 34 VAL C C 34 176.328 176.328 175.064 1.264 18792 10642 1 14 . 1 1 34 34 VAL CA C 34 61.891 61.891 63.160 -1.269 18792 10643 1 14 . 1 1 34 34 VAL CB C 34 32.015 32.015 33.071 -1.056 18792 10644 1 14 . 1 1 34 34 VAL H H 34 7.852 7.852 7.924 -0.072 18792 10645 1 14 . 1 1 35 35 GLU N N 35 124.205 124.205 120.778 3.427 18792 10646 1 14 . 1 1 35 35 GLU C C 35 176.586 176.586 174.644 1.942 18792 10647 1 14 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.558 -1.501 18792 10648 1 14 . 1 1 35 35 GLU CB C 35 28.898 28.898 28.577 0.321 18792 10649 1 14 . 1 1 35 35 GLU H H 35 8.401 8.401 8.473 -0.072 18792 10650 1 14 . 1 1 36 36 GLU N N 36 121.670 121.670 122.040 -0.370 18792 10651 1 14 . 1 1 36 36 GLU C C 36 176.218 176.218 173.592 2.626 18792 10652 1 14 . 1 1 36 36 GLU CA C 36 55.988 55.988 55.768 0.220 18792 10653 1 14 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.961 -1.519 18792 10654 1 14 . 1 1 36 36 GLU H H 36 8.239 8.239 7.978 0.261 18792 10655 1 14 . 1 1 37 37 ASN N N 37 119.252 119.252 123.148 -3.896 18792 10656 1 14 . 1 1 37 37 ASN C C 37 175.003 175.003 174.983 0.020 18792 10657 1 14 . 1 1 37 37 ASN CA C 37 52.655 52.655 52.719 -0.064 18792 10658 1 14 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.555 -1.343 18792 10659 1 14 . 1 1 37 37 ASN H H 37 8.412 8.412 8.420 -0.008 18792 10660 1 14 . 1 1 38 38 ARG N N 38 121.622 121.622 124.426 -2.804 18792 10661 1 14 . 1 1 38 38 ARG C C 38 176.610 176.610 176.032 0.578 18792 10662 1 14 . 1 1 38 38 ARG CA C 38 55.364 55.364 54.935 0.428 18792 10663 1 14 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.041 -1.622 18792 10664 1 14 . 1 1 38 38 ARG H H 38 8.227 8.227 8.507 -0.280 18792 10665 1 14 . 1 1 39 39 THR N N 39 115.681 115.681 117.042 -1.361 18792 10666 1 14 . 1 1 39 39 THR C C 39 174.500 174.500 174.387 0.113 18792 10667 1 14 . 1 1 39 39 THR CA C 39 61.606 61.606 63.240 -1.634 18792 10668 1 14 . 1 1 39 39 THR CB C 39 69.163 69.163 68.986 0.177 18792 10669 1 14 . 1 1 39 39 THR H H 39 8.173 8.173 8.204 -0.031 18792 10670 1 14 . 1 1 40 40 GLU N N 40 122.708 122.708 120.219 2.489 18792 10671 1 14 . 1 1 40 40 GLU C C 40 175.728 175.728 175.158 0.570 18792 10672 1 14 . 1 1 40 40 GLU CA C 40 55.772 55.772 55.955 -0.182 18792 10673 1 14 . 1 1 40 40 GLU CB C 40 29.054 29.054 28.324 0.730 18792 10674 1 14 . 1 1 40 40 GLU H H 40 8.298 8.298 8.404 -0.106 18792 10675 1 14 . 1 1 41 41 ALA N N 41 125.922 125.922 123.119 2.803 18792 10676 1 14 . 1 1 41 41 ALA C C 41 175.557 175.557 177.303 -1.746 18792 10677 1 14 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.816 -1.843 18792 10678 1 14 . 1 1 41 41 ALA CB C 41 17.245 17.245 19.159 -1.914 18792 10679 1 14 . 1 1 41 41 ALA H H 41 8.212 8.212 8.003 0.209 18792 10680 1 14 . 1 1 43 43 GLU N N 43 120.783 120.783 118.294 2.489 18792 10681 1 14 . 1 1 43 43 GLU C C 43 177.174 177.174 175.448 1.726 18792 10682 1 14 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.322 0.019 18792 10683 1 14 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.404 -0.117 18792 10684 1 14 . 1 1 43 43 GLU H H 43 8.519 8.519 8.379 0.140 18792 10685 1 14 . 1 1 44 44 GLY N N 44 110.022 110.022 107.568 2.454 18792 10686 1 14 . 1 1 44 44 GLY C C 44 174.773 174.773 173.090 1.683 18792 10687 1 14 . 1 1 44 44 GLY CA C 44 45.028 45.028 44.427 0.601 18792 10688 1 14 . 1 1 44 44 GLY H H 44 8.429 8.429 7.748 0.681 18792 10689 1 14 . 1 1 45 45 THR N N 45 112.790 112.790 115.573 -2.783 18792 10690 1 14 . 1 1 45 45 THR C C 45 175.726 175.726 175.275 0.451 18792 10691 1 14 . 1 1 45 45 THR CA C 45 61.987 61.987 62.243 -0.256 18792 10692 1 14 . 1 1 45 45 THR CB C 45 69.304 69.304 69.132 0.172 18792 10693 1 14 . 1 1 45 45 THR H H 45 8.125 8.125 8.142 -0.017 18792 10694 1 14 . 1 1 46 46 GLU N N 46 122.752 122.752 121.976 0.776 18792 10695 1 14 . 1 1 46 46 GLU C C 46 177.419 177.419 177.013 0.406 18792 10696 1 14 . 1 1 46 46 GLU CA C 46 57.231 57.231 57.906 -0.675 18792 10697 1 14 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.543 -1.344 18792 10698 1 14 . 1 1 46 46 GLU H H 46 8.765 8.765 8.637 0.128 18792 10699 1 14 . 1 1 47 47 SER N N 47 114.895 114.895 114.058 0.837 18792 10700 1 14 . 1 1 47 47 SER C C 47 175.826 175.826 175.205 0.621 18792 10701 1 14 . 1 1 47 47 SER CA C 47 58.582 58.582 58.435 0.147 18792 10702 1 14 . 1 1 47 47 SER CB C 47 62.537 62.537 62.824 -0.287 18792 10703 1 14 . 1 1 47 47 SER H H 47 8.355 8.355 8.020 0.335 18792 10704 1 14 . 1 1 48 48 GLU N N 48 122.429 122.429 120.222 2.207 18792 10705 1 14 . 1 1 48 48 GLU C C 48 178.099 178.099 177.228 0.871 18792 10706 1 14 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.904 -0.286 18792 10707 1 14 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.677 -1.202 18792 10708 1 14 . 1 1 48 48 GLU H H 48 8.139 8.139 8.624 -0.485 18792 10709 1 14 . 1 1 49 49 ALA N N 49 120.374 120.374 121.167 -0.793 18792 10710 1 14 . 1 1 49 49 ALA C C 49 180.843 180.843 178.848 1.995 18792 10711 1 14 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.737 -0.254 18792 10712 1 14 . 1 1 49 49 ALA CB C 49 17.435 17.435 17.986 -0.551 18792 10713 1 14 . 1 1 49 49 ALA H H 49 8.079 8.079 7.974 0.105 18792 10714 1 14 . 1 1 50 50 VAL N N 50 118.599 118.599 117.808 0.791 18792 10715 1 14 . 1 1 50 50 VAL C C 50 176.921 176.921 177.313 -0.392 18792 10716 1 14 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.193 -0.633 18792 10717 1 14 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.833 -0.536 18792 10718 1 14 . 1 1 50 50 VAL H H 50 7.419 7.419 7.357 0.062 18792 10719 1 14 . 1 1 51 51 LYS N N 51 117.469 117.469 120.438 -2.969 18792 10720 1 14 . 1 1 51 51 LYS C C 51 179.061 179.061 178.777 0.284 18792 10721 1 14 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.753 -0.530 18792 10722 1 14 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.928 -0.932 18792 10723 1 14 . 1 1 51 51 LYS H H 51 7.359 7.359 7.478 -0.119 18792 10724 1 14 . 1 1 52 52 GLN N N 52 115.930 115.930 117.596 -1.666 18792 10725 1 14 . 1 1 52 52 GLN C C 52 177.713 177.713 178.083 -0.370 18792 10726 1 14 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.358 0.118 18792 10727 1 14 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.575 -2.007 18792 10728 1 14 . 1 1 52 52 GLN H H 52 8.025 8.025 7.687 0.338 18792 10729 1 14 . 1 1 53 53 ALA N N 53 119.782 119.782 122.335 -2.553 18792 10730 1 14 . 1 1 53 53 ALA C C 53 180.008 180.008 179.307 0.701 18792 10731 1 14 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.915 -0.530 18792 10732 1 14 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.460 -0.945 18792 10733 1 14 . 1 1 53 53 ALA H H 53 7.655 7.655 7.649 0.006 18792 10734 1 14 . 1 1 54 54 LEU N N 54 120.443 120.443 119.675 0.768 18792 10735 1 14 . 1 1 54 54 LEU C C 54 179.330 179.330 177.775 1.555 18792 10736 1 14 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.771 1.242 18792 10737 1 14 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.031 -0.169 18792 10738 1 14 . 1 1 54 54 LEU H H 54 8.419 8.419 7.852 0.567 18792 10739 1 14 . 1 1 55 55 ARG N N 55 118.423 118.423 119.538 -1.115 18792 10740 1 14 . 1 1 55 55 ARG C C 55 178.767 178.767 177.943 0.824 18792 10741 1 14 . 1 1 55 55 ARG CA C 55 60.397 60.397 58.882 1.515 18792 10742 1 14 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.328 -0.585 18792 10743 1 14 . 1 1 55 55 ARG H H 55 8.062 8.062 7.318 0.744 18792 10744 1 14 . 1 1 56 56 GLU N N 56 115.988 115.988 118.689 -2.701 18792 10745 1 14 . 1 1 56 56 GLU C C 56 180.090 180.090 178.479 1.611 18792 10746 1 14 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.580 -0.820 18792 10747 1 14 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.491 -1.137 18792 10748 1 14 . 1 1 56 56 GLU H H 56 7.772 7.772 8.136 -0.364 18792 10749 1 14 . 1 1 57 57 ALA N N 57 122.837 122.837 120.817 2.020 18792 10750 1 14 . 1 1 57 57 ALA C C 57 181.861 181.861 179.816 2.045 18792 10751 1 14 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.766 -0.132 18792 10752 1 14 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.283 0.190 18792 10753 1 14 . 1 1 57 57 ALA H H 57 8.774 8.774 7.894 0.880 18792 10754 1 14 . 1 1 58 58 GLY N N 58 108.409 108.409 106.910 1.499 18792 10755 1 14 . 1 1 58 58 GLY C C 58 175.331 175.331 175.973 -0.642 18792 10756 1 14 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.998 -0.330 18792 10757 1 14 . 1 1 58 58 GLY H H 58 9.073 9.073 8.267 0.806 18792 10758 1 14 . 1 1 59 59 ASP N N 59 122.074 122.074 121.583 0.491 18792 10759 1 14 . 1 1 59 59 ASP C C 59 179.023 179.023 178.419 0.604 18792 10760 1 14 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.360 -0.058 18792 10761 1 14 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.427 -1.585 18792 10762 1 14 . 1 1 59 59 ASP H H 59 8.049 8.049 8.448 -0.399 18792 10763 1 14 . 1 1 60 60 GLU N N 60 120.131 120.131 120.517 -0.386 18792 10764 1 14 . 1 1 60 60 GLU C C 60 178.522 178.522 178.939 -0.417 18792 10765 1 14 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.370 -0.361 18792 10766 1 14 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.961 -1.762 18792 10767 1 14 . 1 1 60 60 GLU H H 60 8.136 8.136 8.062 0.074 18792 10768 1 14 . 1 1 61 61 PHE N N 61 121.309 121.309 118.634 2.675 18792 10769 1 14 . 1 1 61 61 PHE C C 61 176.904 176.904 178.115 -1.211 18792 10770 1 14 . 1 1 61 61 PHE CA C 61 61.322 61.322 60.689 0.633 18792 10771 1 14 . 1 1 61 61 PHE CB C 61 38.609 38.609 38.899 -0.290 18792 10772 1 14 . 1 1 61 61 PHE H H 61 8.523 8.523 8.489 0.034 18792 10773 1 14 . 1 1 62 62 GLU N N 62 115.971 115.971 119.692 -3.721 18792 10774 1 14 . 1 1 62 62 GLU C C 62 177.713 177.713 178.034 -0.321 18792 10775 1 14 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.517 -1.326 18792 10776 1 14 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.535 -1.258 18792 10777 1 14 . 1 1 62 62 GLU H H 62 7.969 7.969 8.894 -0.925 18792 10778 1 14 . 1 1 63 63 LEU N N 63 116.703 116.703 119.821 -3.118 18792 10779 1 14 . 1 1 63 63 LEU C C 63 178.963 178.963 178.468 0.495 18792 10780 1 14 . 1 1 63 63 LEU CA C 63 56.412 56.412 55.957 0.455 18792 10781 1 14 . 1 1 63 63 LEU CB C 63 41.406 41.406 41.693 -0.287 18792 10782 1 14 . 1 1 63 63 LEU H H 63 7.347 7.347 7.615 -0.268 18792 10783 1 14 . 1 1 64 64 ARG N N 64 117.453 117.453 119.089 -1.636 18792 10784 1 14 . 1 1 64 64 ARG C C 64 177.297 177.297 176.722 0.575 18792 10785 1 14 . 1 1 64 64 ARG CA C 64 57.337 57.337 57.893 -0.556 18792 10786 1 14 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.182 -1.585 18792 10787 1 14 . 1 1 64 64 ARG H H 64 7.995 7.995 8.067 -0.072 18792 10788 1 14 . 1 1 65 65 TYR N N 65 118.956 118.956 117.558 1.398 18792 10789 1 14 . 1 1 65 65 TYR C C 65 175.278 175.278 174.080 1.198 18792 10790 1 14 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.574 -2.873 18792 10791 1 14 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.189 -3.203 18792 10792 1 14 . 1 1 65 65 TYR H H 65 7.909 7.909 7.928 -0.019 18792 10793 1 14 . 1 1 66 66 ARG N N 66 119.438 119.438 121.375 -1.937 18792 10794 1 14 . 1 1 66 66 ARG C C 66 178.424 178.424 175.666 2.758 18792 10795 1 14 . 1 1 66 66 ARG CA C 66 58.476 58.476 56.359 2.117 18792 10796 1 14 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.514 -1.693 18792 10797 1 14 . 1 1 66 66 ARG H H 66 7.244 7.244 8.169 -0.925 18792 10798 1 14 . 1 1 67 67 ARG N N 67 118.936 118.936 120.722 -1.786 18792 10799 1 14 . 1 1 67 67 ARG C C 67 177.542 177.542 177.899 -0.357 18792 10800 1 14 . 1 1 67 67 ARG CA C 67 57.444 57.444 58.681 -1.237 18792 10801 1 14 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.921 -1.800 18792 10802 1 14 . 1 1 67 67 ARG H H 67 8.417 8.417 8.444 -0.027 18792 10803 1 14 . 1 1 68 68 ALA N N 68 121.797 121.797 122.890 -1.093 18792 10804 1 14 . 1 1 68 68 ALA C C 68 180.337 180.337 179.022 1.315 18792 10805 1 14 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.263 -0.126 18792 10806 1 14 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.142 -0.675 18792 10807 1 14 . 1 1 68 68 ALA H H 68 7.827 7.827 8.437 -0.610 18792 10808 1 14 . 1 1 69 69 PHE N N 69 115.986 115.986 117.898 -1.912 18792 10809 1 14 . 1 1 69 69 PHE C C 69 177.468 177.468 177.179 0.289 18792 10810 1 14 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.256 -1.207 18792 10811 1 14 . 1 1 69 69 PHE CB C 69 37.599 37.599 37.579 0.020 18792 10812 1 14 . 1 1 69 69 PHE H H 69 8.517 8.517 7.975 0.542 18792 10813 1 14 . 1 1 70 70 SER N N 70 116.526 116.526 114.549 1.977 18792 10814 1 14 . 1 1 70 70 SER C C 70 177.640 177.640 176.107 1.533 18792 10815 1 14 . 1 1 70 70 SER CA C 70 61.073 61.073 60.908 0.165 18792 10816 1 14 . 1 1 70 70 SER CB C 70 61.993 61.993 62.443 -0.450 18792 10817 1 14 . 1 1 70 70 SER H H 70 8.152 8.152 7.719 0.433 18792 10818 1 14 . 1 1 71 71 ASP N N 71 121.181 121.181 122.078 -0.897 18792 10819 1 14 . 1 1 71 71 ASP C C 71 178.546 178.546 178.262 0.284 18792 10820 1 14 . 1 1 71 71 ASP CA C 71 56.448 56.448 56.541 -0.093 18792 10821 1 14 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.605 -1.374 18792 10822 1 14 . 1 1 71 71 ASP H H 71 8.356 8.356 7.405 0.951 18792 10823 1 14 . 1 1 72 72 LEU N N 72 120.747 120.747 121.302 -0.555 18792 10824 1 14 . 1 1 72 72 LEU C C 72 178.963 178.963 178.131 0.832 18792 10825 1 14 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.624 -1.180 18792 10826 1 14 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.137 -1.120 18792 10827 1 14 . 1 1 72 72 LEU H H 72 7.738 7.738 8.418 -0.680 18792 10828 1 14 . 1 1 73 73 THR N N 73 109.432 109.432 114.056 -4.624 18792 10829 1 14 . 1 1 73 73 THR C C 73 177.481 177.481 176.911 0.570 18792 10830 1 14 . 1 1 73 73 THR CA C 73 65.128 65.128 65.287 -0.159 18792 10831 1 14 . 1 1 73 73 THR CB C 73 67.720 67.720 67.796 -0.076 18792 10832 1 14 . 1 1 73 73 THR H H 73 8.296 8.296 7.951 0.345 18792 10833 1 14 . 1 1 74 74 SER N N 74 115.862 115.862 117.078 -1.216 18792 10834 1 14 . 1 1 74 74 SER C C 74 175.361 175.361 175.969 -0.608 18792 10835 1 14 . 1 1 74 74 SER CA C 74 60.112 60.112 60.369 -0.257 18792 10836 1 14 . 1 1 74 74 SER CB C 74 62.537 62.537 62.797 -0.260 18792 10837 1 14 . 1 1 74 74 SER H H 74 7.629 7.629 7.807 -0.178 18792 10838 1 14 . 1 1 75 75 GLN N N 75 118.551 118.551 119.541 -0.990 18792 10839 1 14 . 1 1 75 75 GLN C C 75 176.316 176.316 176.352 -0.036 18792 10840 1 14 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.335 -0.531 18792 10841 1 14 . 1 1 75 75 GLN CB C 75 28.277 28.277 30.516 -2.239 18792 10842 1 14 . 1 1 75 75 GLN H H 75 7.640 7.640 7.664 -0.024 18792 10843 1 14 . 1 1 76 76 LEU N N 76 118.313 118.313 118.909 -0.596 18792 10844 1 14 . 1 1 76 76 LEU C C 76 174.160 174.160 175.798 -1.638 18792 10845 1 14 . 1 1 76 76 LEU CA C 76 54.740 54.740 53.748 0.992 18792 10846 1 14 . 1 1 76 76 LEU CB C 76 42.727 42.727 41.368 1.359 18792 10847 1 14 . 1 1 76 76 LEU H H 76 7.411 7.411 7.990 -0.579 18792 10848 1 14 . 1 1 77 77 HIS N N 77 120.104 120.104 122.552 -2.448 18792 10849 1 14 . 1 1 77 77 HIS C C 77 174.528 174.528 175.362 -0.834 18792 10850 1 14 . 1 1 77 77 HIS CA C 77 54.207 54.207 56.590 -2.383 18792 10851 1 14 . 1 1 77 77 HIS CB C 77 27.966 27.966 27.678 0.288 18792 10852 1 14 . 1 1 77 77 HIS H H 77 8.117 8.117 8.395 -0.278 18792 10853 1 14 . 1 1 78 78 ILE N N 78 122.298 122.298 118.570 3.728 18792 10854 1 14 . 1 1 78 78 ILE C C 78 174.240 174.240 174.334 -0.094 18792 10855 1 14 . 1 1 78 78 ILE CA C 78 61.402 61.402 62.617 -1.215 18792 10856 1 14 . 1 1 78 78 ILE CB C 78 37.591 37.591 38.506 -0.915 18792 10857 1 14 . 1 1 78 78 ILE H H 78 8.655 8.655 8.099 0.556 18792 10858 1 14 . 1 1 79 79 THR N N 79 116.442 116.442 116.877 -0.435 18792 10859 1 14 . 1 1 79 79 THR C C 79 174.291 174.291 172.477 1.814 18792 10860 1 14 . 1 1 79 79 THR CA C 79 61.632 61.632 59.221 2.412 18792 10861 1 14 . 1 1 79 79 THR CB C 79 68.704 68.704 69.945 -1.241 18792 10862 1 14 . 1 1 79 79 THR H H 79 8.245 8.245 8.361 -0.116 18792 10863 1 14 . 1 1 84 84 TYR N N 84 120.888 120.888 119.230 1.658 18792 10864 1 14 . 1 1 84 84 TYR C C 84 176.708 176.708 177.480 -0.772 18792 10865 1 14 . 1 1 84 84 TYR CA C 84 60.432 60.432 59.770 0.661 18792 10866 1 14 . 1 1 84 84 TYR CB C 84 36.745 36.745 36.380 0.365 18792 10867 1 14 . 1 1 84 84 TYR H H 84 8.733 8.733 8.076 0.657 18792 10868 1 14 . 1 1 85 85 GLN N N 85 114.530 114.530 119.593 -5.063 18792 10869 1 14 . 1 1 85 85 GLN C C 85 178.473 178.473 178.191 0.282 18792 10870 1 14 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.046 0.248 18792 10871 1 14 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.011 -1.210 18792 10872 1 14 . 1 1 85 85 GLN H H 85 8.413 8.413 7.027 1.386 18792 10873 1 14 . 1 1 86 86 SER N N 86 114.032 114.032 115.420 -1.388 18792 10874 1 14 . 1 1 86 86 SER C C 86 178.473 178.473 176.729 1.744 18792 10875 1 14 . 1 1 86 86 SER CA C 86 62.175 62.175 61.585 0.590 18792 10876 1 14 . 1 1 86 86 SER CB C 86 63.252 63.252 62.889 0.363 18792 10877 1 14 . 1 1 86 86 SER H H 86 7.258 7.258 7.488 -0.230 18792 10878 1 14 . 1 1 88 88 GLU N N 88 119.386 119.386 119.728 -0.342 18792 10879 1 14 . 1 1 88 88 GLU C C 88 177.199 177.199 178.708 -1.509 18792 10880 1 14 . 1 1 88 88 GLU CA C 88 58.582 58.582 60.181 -1.599 18792 10881 1 14 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.426 -0.450 18792 10882 1 14 . 1 1 88 88 GLU H H 88 8.534 8.534 8.738 -0.204 18792 10883 1 14 . 1 1 89 89 GLN N N 89 114.678 114.678 118.811 -4.133 18792 10884 1 14 . 1 1 89 89 GLN C C 89 178.669 178.669 178.779 -0.110 18792 10885 1 14 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.082 -0.500 18792 10886 1 14 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.683 -1.260 18792 10887 1 14 . 1 1 89 89 GLN H H 89 7.500 7.500 7.775 -0.275 18792 10888 1 14 . 1 1 90 90 VAL N N 90 118.174 118.174 120.181 -2.007 18792 10889 1 14 . 1 1 90 90 VAL C C 90 178.081 178.081 177.758 0.323 18792 10890 1 14 . 1 1 90 90 VAL CA C 90 65.555 65.555 66.656 -1.101 18792 10891 1 14 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.058 -0.451 18792 10892 1 14 . 1 1 90 90 VAL H H 90 7.017 7.017 7.593 -0.576 18792 10893 1 14 . 1 1 91 91 VAL N N 91 119.489 119.489 120.945 -1.456 18792 10894 1 14 . 1 1 91 91 VAL C C 91 177.914 177.914 178.339 -0.425 18792 10895 1 14 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.793 -1.024 18792 10896 1 14 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.009 -0.718 18792 10897 1 14 . 1 1 91 91 VAL H H 91 7.833 7.833 8.654 -0.821 18792 10898 1 14 . 1 1 92 92 ASN N N 92 117.180 117.180 117.896 -0.716 18792 10899 1 14 . 1 1 92 92 ASN C C 92 179.110 179.110 178.294 0.816 18792 10900 1 14 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.057 -1.139 18792 10901 1 14 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.231 -2.263 18792 10902 1 14 . 1 1 92 92 ASN H H 92 8.368 8.368 8.628 -0.260 18792 10903 1 14 . 1 1 93 93 GLU N N 93 118.476 118.476 120.483 -2.007 18792 10904 1 14 . 1 1 93 93 GLU C C 93 179.355 179.355 179.254 0.101 18792 10905 1 14 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.201 -0.796 18792 10906 1 14 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.103 -2.370 18792 10907 1 14 . 1 1 93 93 GLU H H 93 7.213 7.213 7.863 -0.650 18792 10908 1 14 . 1 1 94 94 LEU N N 94 120.889 120.889 121.032 -0.143 18792 10909 1 14 . 1 1 94 94 LEU C C 94 178.473 178.473 178.969 -0.496 18792 10910 1 14 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.752 -0.735 18792 10911 1 14 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.545 -2.615 18792 10912 1 14 . 1 1 94 94 LEU H H 94 7.446 7.446 8.299 -0.853 18792 10913 1 14 . 1 1 95 95 PHE N N 95 112.902 112.902 117.514 -4.612 18792 10914 1 14 . 1 1 95 95 PHE C C 95 176.586 176.586 176.780 -0.194 18792 10915 1 14 . 1 1 95 95 PHE CA C 95 57.159 57.159 57.751 -0.592 18792 10916 1 14 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.139 -0.918 18792 10917 1 14 . 1 1 95 95 PHE H H 95 6.916 6.916 8.594 -1.678 18792 10918 1 14 . 1 1 96 96 ARG N N 96 123.729 123.729 120.390 3.339 18792 10919 1 14 . 1 1 96 96 ARG C C 96 177.272 177.272 176.266 1.006 18792 10920 1 14 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.204 1.019 18792 10921 1 14 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.612 -2.180 18792 10922 1 14 . 1 1 96 96 ARG H H 96 7.126 7.126 7.495 -0.369 18792 10923 1 14 . 1 1 97 97 ASP N N 97 116.576 116.576 115.833 0.743 18792 10924 1 14 . 1 1 97 97 ASP C C 97 175.687 175.687 174.949 0.738 18792 10925 1 14 . 1 1 97 97 ASP CA C 97 53.673 53.673 53.857 -0.184 18792 10926 1 14 . 1 1 97 97 ASP CB C 97 40.045 40.045 41.984 -1.939 18792 10927 1 14 . 1 1 97 97 ASP H H 97 8.644 8.644 8.037 0.607 18792 10928 1 14 . 1 1 98 98 GLY N N 98 108.551 108.551 106.463 2.088 18792 10929 1 14 . 1 1 98 98 GLY C C 98 172.690 172.690 173.105 -0.415 18792 10930 1 14 . 1 1 98 98 GLY CA C 98 43.250 43.250 44.502 -1.252 18792 10931 1 14 . 1 1 98 98 GLY H H 98 7.463 7.463 7.170 0.293 18792 10932 1 14 . 1 1 99 99 VAL N N 99 120.630 120.630 115.833 4.797 18792 10933 1 14 . 1 1 99 99 VAL C C 99 174.503 174.503 173.872 0.631 18792 10934 1 14 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.284 -0.966 18792 10935 1 14 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.500 -1.737 18792 10936 1 14 . 1 1 99 99 VAL H H 99 8.184 8.184 8.415 -0.231 18792 10937 1 14 . 1 1 100 100 ASN N N 100 115.485 115.485 116.216 -0.731 18792 10938 1 14 . 1 1 100 100 ASN C C 100 175.239 175.239 176.672 -1.433 18792 10939 1 14 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.123 -2.763 18792 10940 1 14 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.154 0.766 18792 10941 1 14 . 1 1 100 100 ASN H H 100 6.241 6.241 8.096 -1.855 18792 10942 1 14 . 1 1 101 101 TRP N N 101 118.266 118.266 121.466 -3.200 18792 10943 1 14 . 1 1 101 101 TRP C C 101 178.301 178.301 176.727 1.574 18792 10944 1 14 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.782 0.756 18792 10945 1 14 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.552 1.278 18792 10946 1 14 . 1 1 101 101 TRP H H 101 8.409 8.409 8.889 -0.480 18792 10947 1 14 . 1 1 102 102 GLY N N 102 106.147 106.147 106.390 -0.243 18792 10948 1 14 . 1 1 102 102 GLY C C 102 177.640 177.640 175.694 1.946 18792 10949 1 14 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.489 2.425 18792 10950 1 14 . 1 1 102 102 GLY H H 102 8.504 8.504 7.690 0.814 18792 10951 1 14 . 1 1 103 103 ARG N N 103 121.347 121.347 122.809 -1.462 18792 10952 1 14 . 1 1 103 103 ARG C C 103 177.738 177.738 178.306 -0.568 18792 10953 1 14 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.146 -0.204 18792 10954 1 14 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.770 0.449 18792 10955 1 14 . 1 1 103 103 ARG H H 103 8.099 8.099 8.217 -0.118 18792 10956 1 14 . 1 1 104 104 ILE N N 104 120.930 120.930 120.004 0.926 18792 10957 1 14 . 1 1 104 104 ILE C C 104 178.197 178.197 177.908 0.289 18792 10958 1 14 . 1 1 104 104 ILE CA C 104 66.535 66.535 65.224 1.311 18792 10959 1 14 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.872 -1.827 18792 10960 1 14 . 1 1 104 104 ILE H H 104 7.690 7.690 8.097 -0.407 18792 10961 1 14 . 1 1 105 105 VAL N N 105 120.938 120.938 119.267 1.671 18792 10962 1 14 . 1 1 105 105 VAL C C 105 177.854 177.854 178.354 -0.500 18792 10963 1 14 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.197 1.261 18792 10964 1 14 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.855 -0.481 18792 10965 1 14 . 1 1 105 105 VAL H H 105 8.245 8.245 7.759 0.486 18792 10966 1 14 . 1 1 106 106 ALA N N 106 121.165 121.165 122.986 -1.821 18792 10967 1 14 . 1 1 106 106 ALA C C 106 178.284 178.284 180.063 -1.779 18792 10968 1 14 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.531 0.067 18792 10969 1 14 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.738 -1.223 18792 10970 1 14 . 1 1 106 106 ALA H H 106 7.529 7.529 8.097 -0.568 18792 10971 1 14 . 1 1 107 107 PHE N N 107 119.242 119.242 119.854 -0.612 18792 10972 1 14 . 1 1 107 107 PHE C C 107 176.390 176.390 177.647 -1.257 18792 10973 1 14 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.363 -0.190 18792 10974 1 14 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.773 -1.686 18792 10975 1 14 . 1 1 107 107 PHE H H 107 7.974 7.974 8.595 -0.621 18792 10976 1 14 . 1 1 108 108 PHE N N 108 120.009 120.009 120.379 -0.370 18792 10977 1 14 . 1 1 108 108 PHE C C 108 177.640 177.640 176.889 0.751 18792 10978 1 14 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.830 1.594 18792 10979 1 14 . 1 1 108 108 PHE CB C 108 35.346 35.346 39.000 -3.654 18792 10980 1 14 . 1 1 108 108 PHE H H 108 7.946 7.946 8.439 -0.493 18792 10981 1 14 . 1 1 109 109 SER N N 109 114.631 114.631 116.487 -1.856 18792 10982 1 14 . 1 1 109 109 SER C C 109 177.770 177.770 176.522 1.248 18792 10983 1 14 . 1 1 109 109 SER CA C 109 63.349 63.349 61.698 1.651 18792 10984 1 14 . 1 1 109 109 SER H H 109 8.424 8.424 7.671 0.753 18792 10985 1 14 . 1 1 110 110 PHE N N 110 124.230 124.230 124.660 -0.430 18792 10986 1 14 . 1 1 110 110 PHE C C 110 176.708 176.708 177.685 -0.977 18792 10987 1 14 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.060 0.554 18792 10988 1 14 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.882 -1.438 18792 10989 1 14 . 1 1 110 110 PHE H H 110 9.052 9.052 8.785 0.267 18792 10990 1 14 . 1 1 111 111 GLY N N 111 105.893 105.893 106.398 -0.505 18792 10991 1 14 . 1 1 111 111 GLY C C 111 176.795 176.795 175.879 0.916 18792 10992 1 14 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.761 0.615 18792 10993 1 14 . 1 1 111 111 GLY H H 111 7.926 7.926 8.652 -0.726 18792 10994 1 14 . 1 1 112 112 GLY N N 112 107.410 107.410 108.850 -1.440 18792 10995 1 14 . 1 1 112 112 GLY C C 112 174.650 174.650 175.382 -0.732 18792 10996 1 14 . 1 1 112 112 GLY CA C 112 47.305 47.305 45.969 1.336 18792 10997 1 14 . 1 1 112 112 GLY H H 112 8.799 8.799 8.028 0.771 18792 10998 1 14 . 1 1 113 113 ALA N N 113 124.313 124.313 124.948 -0.635 18792 10999 1 14 . 1 1 113 113 ALA C C 113 181.300 181.300 179.473 1.827 18792 11000 1 14 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.529 -0.002 18792 11001 1 14 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.321 -0.838 18792 11002 1 14 . 1 1 113 113 ALA H H 113 8.212 8.212 7.522 0.690 18792 11003 1 14 . 1 1 114 114 LEU N N 114 118.878 118.878 118.427 0.451 18792 11004 1 14 . 1 1 114 114 LEU C C 114 180.286 180.286 178.950 1.336 18792 11005 1 14 . 1 1 114 114 LEU CA C 114 56.982 56.982 56.752 0.230 18792 11006 1 14 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.695 -0.678 18792 11007 1 14 . 1 1 114 114 LEU H H 114 8.161 8.161 7.799 0.362 18792 11008 1 14 . 1 1 115 115 CYS N N 115 119.002 119.002 118.933 0.069 18792 11009 1 14 . 1 1 115 115 CYS C C 115 176.087 176.087 176.361 -0.274 18792 11010 1 14 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.902 0.042 18792 11011 1 14 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.482 -1.847 18792 11012 1 14 . 1 1 115 115 CYS H H 115 8.070 8.070 8.377 -0.307 18792 11013 1 14 . 1 1 116 116 VAL N N 116 118.737 118.737 119.843 -1.106 18792 11014 1 14 . 1 1 116 116 VAL C C 116 177.494 177.494 177.141 0.353 18792 11015 1 14 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.006 0.756 18792 11016 1 14 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.433 -0.670 18792 11017 1 14 . 1 1 116 116 VAL H H 116 7.995 7.995 7.436 0.559 18792 11018 1 14 . 1 1 117 117 GLU N N 117 118.886 118.886 119.875 -0.989 18792 11019 1 14 . 1 1 117 117 GLU C C 117 178.424 178.424 178.848 -0.424 18792 11020 1 14 . 1 1 117 117 GLU CA C 117 58.760 58.760 58.995 -0.235 18792 11021 1 14 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.138 -1.084 18792 11022 1 14 . 1 1 117 117 GLU H H 117 8.059 8.059 7.793 0.266 18792 11023 1 14 . 1 1 118 118 SER N N 118 113.417 113.417 115.427 -2.010 18792 11024 1 14 . 1 1 118 118 SER C C 118 175.607 175.607 177.189 -1.582 18792 11025 1 14 . 1 1 118 118 SER CA C 118 62.638 62.638 61.694 0.944 18792 11026 1 14 . 1 1 118 118 SER CB C 118 61.061 61.061 63.006 -1.945 18792 11027 1 14 . 1 1 118 118 SER H H 118 7.626 7.626 8.139 -0.513 18792 11028 1 14 . 1 1 119 119 VAL N N 119 120.612 120.612 121.840 -1.228 18792 11029 1 14 . 1 1 119 119 VAL C C 119 179.713 179.713 178.157 1.556 18792 11030 1 14 . 1 1 119 119 VAL CA C 119 66.225 66.225 64.930 1.295 18792 11031 1 14 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.454 -1.375 18792 11032 1 14 . 1 1 119 119 VAL H H 119 7.297 7.297 7.860 -0.563 18792 11033 1 14 . 1 1 120 120 ASP N N 120 122.546 122.546 119.334 3.212 18792 11034 1 14 . 1 1 120 120 ASP C C 120 178.057 178.057 177.276 0.781 18792 11035 1 14 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.785 0.204 18792 11036 1 14 . 1 1 120 120 ASP CB C 120 39.923 39.923 41.204 -1.281 18792 11037 1 14 . 1 1 120 120 ASP H H 120 8.264 8.264 8.373 -0.109 18792 11038 1 14 . 1 1 121 121 LYS N N 121 115.636 115.636 116.524 -0.888 18792 11039 1 14 . 1 1 121 121 LYS C C 121 175.159 175.159 176.355 -1.196 18792 11040 1 14 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.383 -1.123 18792 11041 1 14 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.954 -3.179 18792 11042 1 14 . 1 1 121 121 LYS H H 121 7.558 7.558 7.673 -0.115 18792 11043 1 14 . 1 1 122 122 GLU N N 122 113.915 113.915 116.677 -2.762 18792 11044 1 14 . 1 1 122 122 GLU C C 122 176.109 176.109 176.132 -0.023 18792 11045 1 14 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.319 -1.012 18792 11046 1 14 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.038 -1.706 18792 11047 1 14 . 1 1 122 122 GLU H H 122 7.826 7.826 8.091 -0.265 18792 11048 1 14 . 1 1 124 124 GLN N N 124 119.233 119.233 119.863 -0.630 18792 11049 1 14 . 1 1 124 124 GLN C C 124 177.640 177.640 177.118 0.522 18792 11050 1 14 . 1 1 124 124 GLN CA C 124 59.472 59.472 57.715 1.757 18792 11051 1 14 . 1 1 124 124 GLN CB C 124 26.490 26.490 29.236 -2.746 18792 11052 1 14 . 1 1 124 124 GLN H H 124 8.626 8.626 8.344 0.282 18792 11053 1 14 . 1 1 125 125 VAL N N 125 117.011 117.011 111.811 5.200 18792 11054 1 14 . 1 1 125 125 VAL C C 125 175.826 175.826 175.194 0.632 18792 11055 1 14 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.639 -0.503 18792 11056 1 14 . 1 1 125 125 VAL CB C 125 30.297 30.297 29.262 1.035 18792 11057 1 14 . 1 1 125 125 VAL H H 125 7.870 7.870 8.337 -0.467 18792 11058 1 14 . 1 1 126 126 LEU N N 126 117.058 117.058 114.713 2.345 18792 11059 1 14 . 1 1 126 126 LEU C C 126 178.096 178.096 177.649 0.447 18792 11060 1 14 . 1 1 126 126 LEU CA C 126 55.085 55.085 55.528 -0.443 18792 11061 1 14 . 1 1 126 126 LEU CB C 126 40.273 40.273 43.182 -2.909 18792 11062 1 14 . 1 1 126 126 LEU H H 126 7.747 7.747 7.299 0.448 18792 11063 1 14 . 1 1 127 127 VAL N N 127 119.457 119.457 121.985 -2.528 18792 11064 1 14 . 1 1 127 127 VAL C C 127 177.150 177.150 176.858 0.292 18792 11065 1 14 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.061 1.095 18792 11066 1 14 . 1 1 127 127 VAL CB C 127 29.753 29.753 31.277 -1.524 18792 11067 1 14 . 1 1 127 127 VAL H H 127 7.306 7.306 7.480 -0.174 18792 11068 1 14 . 1 1 128 128 SER N N 128 110.647 110.647 114.518 -3.871 18792 11069 1 14 . 1 1 128 128 SER C C 128 177.222 177.222 176.369 0.853 18792 11070 1 14 . 1 1 128 128 SER CA C 128 60.752 60.752 61.455 -0.703 18792 11071 1 14 . 1 1 128 128 SER CB C 128 61.605 61.605 62.712 -1.107 18792 11072 1 14 . 1 1 128 128 SER H H 128 8.237 8.237 8.618 -0.381 18792 11073 1 14 . 1 1 129 129 ARG N N 129 123.100 123.100 122.465 0.635 18792 11074 1 14 . 1 1 129 129 ARG C C 129 175.802 175.802 178.706 -2.904 18792 11075 1 14 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.509 -1.282 18792 11076 1 14 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.401 -2.202 18792 11077 1 14 . 1 1 129 129 ARG H H 129 6.564 6.564 7.768 -1.204 18792 11078 1 14 . 1 1 130 130 ILE N N 130 118.182 118.182 117.765 0.417 18792 11079 1 14 . 1 1 130 130 ILE C C 130 178.156 178.156 177.269 0.887 18792 11080 1 14 . 1 1 130 130 ILE CA C 130 64.346 64.346 64.686 -0.340 18792 11081 1 14 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.105 -0.423 18792 11082 1 14 . 1 1 130 130 ILE H H 130 7.955 7.955 8.486 -0.531 18792 11083 1 14 . 1 1 131 131 ALA N N 131 119.029 119.029 122.360 -3.331 18792 11084 1 14 . 1 1 131 131 ALA C C 131 179.593 179.593 179.121 0.472 18792 11085 1 14 . 1 1 131 131 ALA CA C 131 54.598 54.598 54.652 -0.054 18792 11086 1 14 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.276 -0.888 18792 11087 1 14 . 1 1 131 131 ALA H H 131 7.582 7.582 8.084 -0.502 18792 11088 1 14 . 1 1 132 132 ALA N N 132 120.336 120.336 121.555 -1.219 18792 11089 1 14 . 1 1 132 132 ALA C C 132 181.095 181.095 179.436 1.659 18792 11090 1 14 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.486 0.112 18792 11091 1 14 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.218 -1.517 18792 11092 1 14 . 1 1 132 132 ALA H H 132 7.224 7.224 7.772 -0.548 18792 11093 1 14 . 1 1 133 133 TRP N N 133 121.194 121.194 120.517 0.677 18792 11094 1 14 . 1 1 133 133 TRP C C 133 179.698 179.698 178.436 1.262 18792 11095 1 14 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.446 -3.144 18792 11096 1 14 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.612 -1.957 18792 11097 1 14 . 1 1 133 133 TRP H H 133 8.925 8.925 8.363 0.562 18792 11098 1 14 . 1 1 134 134 MET N N 134 116.987 116.987 116.622 0.365 18792 11099 1 14 . 1 1 134 134 MET C C 134 178.277 178.277 178.210 0.067 18792 11100 1 14 . 1 1 134 134 MET CA C 134 59.578 59.578 59.003 0.575 18792 11101 1 14 . 1 1 134 134 MET CB C 134 33.559 33.559 32.559 1.000 18792 11102 1 14 . 1 1 134 134 MET H H 134 8.863 8.863 8.423 0.440 18792 11103 1 14 . 1 1 135 135 ALA N N 135 120.523 120.523 122.472 -1.949 18792 11104 1 14 . 1 1 135 135 ALA C C 135 179.298 179.298 179.553 -0.255 18792 11105 1 14 . 1 1 135 135 ALA CA C 135 55.433 55.433 54.976 0.457 18792 11106 1 14 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.468 -1.831 18792 11107 1 14 . 1 1 135 135 ALA H H 135 8.152 8.152 8.236 -0.084 18792 11108 1 14 . 1 1 136 136 THR N N 136 116.715 116.715 118.411 -1.696 18792 11109 1 14 . 1 1 136 136 THR C C 136 175.106 175.106 176.516 -1.410 18792 11110 1 14 . 1 1 136 136 THR CA C 136 66.729 66.729 67.082 -0.353 18792 11111 1 14 . 1 1 136 136 THR CB C 136 68.441 68.441 69.204 -0.763 18792 11112 1 14 . 1 1 136 136 THR H H 136 8.532 8.532 8.144 0.388 18792 11113 1 14 . 1 1 137 137 TYR N N 137 123.204 123.204 122.749 0.455 18792 11114 1 14 . 1 1 137 137 TYR C C 137 179.592 179.592 177.545 2.047 18792 11115 1 14 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.343 1.722 18792 11116 1 14 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.527 -0.539 18792 11117 1 14 . 1 1 137 137 TYR H H 137 8.809 8.809 8.135 0.674 18792 11118 1 14 . 1 1 138 138 LEU N N 138 119.247 119.247 121.345 -2.098 18792 11119 1 14 . 1 1 138 138 LEU C C 138 178.385 178.385 178.030 0.355 18792 11120 1 14 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.552 0.386 18792 11121 1 14 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.243 -0.535 18792 11122 1 14 . 1 1 138 138 LEU H H 138 8.742 8.742 8.282 0.460 18792 11123 1 14 . 1 1 139 139 ASN N N 139 117.122 117.122 116.563 0.559 18792 11124 1 14 . 1 1 139 139 ASN C C 139 176.417 176.417 177.308 -0.891 18792 11125 1 14 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.601 0.847 18792 11126 1 14 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.020 0.632 18792 11127 1 14 . 1 1 139 139 ASN H H 139 8.307 8.307 8.143 0.164 18792 11128 1 14 . 1 1 140 140 ASP N N 140 115.394 115.394 120.582 -5.188 18792 11129 1 14 . 1 1 140 140 ASP C C 140 177.919 177.919 176.898 1.021 18792 11130 1 14 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.745 -0.792 18792 11131 1 14 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.312 -1.927 18792 11132 1 14 . 1 1 140 140 ASP H H 140 8.439 8.439 8.295 0.144 18792 11133 1 14 . 1 1 141 141 HIS N N 141 111.695 111.695 113.813 -2.118 18792 11134 1 14 . 1 1 141 141 HIS C C 141 175.949 175.949 176.265 -0.316 18792 11135 1 14 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.869 -0.812 18792 11136 1 14 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.557 -2.649 18792 11137 1 14 . 1 1 141 141 HIS H H 141 8.043 8.043 7.509 0.534 18792 11138 1 14 . 1 1 142 142 LEU N N 142 117.054 117.054 122.449 -5.395 18792 11139 1 14 . 1 1 142 142 LEU C C 142 176.530 176.530 178.260 -1.730 18792 11140 1 14 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.247 -2.938 18792 11141 1 14 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.840 0.498 18792 11142 1 14 . 1 1 142 142 LEU H H 142 7.198 7.198 8.181 -0.983 18792 11143 1 14 . 1 1 143 143 GLU N N 143 121.335 121.335 119.695 1.640 18792 11144 1 14 . 1 1 143 143 GLU C C 143 173.964 173.964 175.798 -1.834 18792 11145 1 14 . 1 1 143 143 GLU CA C 143 60.254 60.254 61.513 -1.259 18792 11146 1 14 . 1 1 143 143 GLU CB C 143 26.257 26.257 27.978 -1.721 18792 11147 1 14 . 1 1 143 143 GLU H H 143 8.565 8.565 7.943 0.622 18792 11148 1 14 . 1 1 145 145 TRP N N 145 117.973 117.973 119.648 -1.675 18792 11149 1 14 . 1 1 145 145 TRP C C 145 179.526 179.526 178.008 1.518 18792 11150 1 14 . 1 1 145 145 TRP CA C 145 61.606 61.606 59.450 2.156 18792 11151 1 14 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.957 -2.069 18792 11152 1 14 . 1 1 145 145 TRP H H 145 7.078 7.078 8.155 -1.077 18792 11153 1 14 . 1 1 146 146 ILE N N 146 122.101 122.101 111.823 10.278 18792 11154 1 14 . 1 1 146 146 ILE C C 146 179.110 179.110 176.949 2.161 18792 11155 1 14 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.823 3.511 18792 11156 1 14 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.270 -1.448 18792 11157 1 14 . 1 1 146 146 ILE H H 146 8.389 8.389 7.699 0.690 18792 11158 1 14 . 1 1 147 147 GLN N N 147 116.344 116.344 121.517 -5.173 18792 11159 1 14 . 1 1 147 147 GLN C C 147 179.526 179.526 177.811 1.715 18792 11160 1 14 . 1 1 147 147 GLN CA C 147 58.013 58.013 59.022 -1.009 18792 11161 1 14 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.559 -1.836 18792 11162 1 14 . 1 1 147 147 GLN H H 147 8.376 8.376 8.282 0.094 18792 11163 1 14 . 1 1 148 148 GLU N N 148 118.913 118.913 120.508 -1.595 18792 11164 1 14 . 1 1 148 148 GLU C C 148 176.880 176.880 178.193 -1.313 18792 11165 1 14 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.555 -3.182 18792 11166 1 14 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.539 -1.107 18792 11167 1 14 . 1 1 148 148 GLU H H 148 7.504 7.504 8.102 -0.598 18792 11168 1 14 . 1 1 149 149 ASN N N 149 116.616 116.616 114.041 2.575 18792 11169 1 14 . 1 1 149 149 ASN C C 149 173.964 173.964 176.641 -2.677 18792 11170 1 14 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.709 -0.463 18792 11171 1 14 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.840 -2.707 18792 11172 1 14 . 1 1 149 149 ASN H H 149 7.070 7.070 8.253 -1.183 18792 11173 1 14 . 1 1 150 150 GLY N N 150 104.750 104.750 105.523 -0.773 18792 11174 1 14 . 1 1 150 150 GLY C C 150 176.022 176.022 174.012 2.010 18792 11175 1 14 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.553 -0.311 18792 11176 1 14 . 1 1 150 150 GLY H H 150 7.313 7.313 8.079 -0.766 18792 11177 1 14 . 1 1 151 151 GLY N N 151 108.385 108.385 108.418 -0.033 18792 11178 1 14 . 1 1 151 151 GLY C C 151 173.449 173.449 174.684 -1.235 18792 11179 1 14 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.769 -0.737 18792 11180 1 14 . 1 1 151 151 GLY H H 151 8.452 8.452 7.570 0.882 18792 11181 1 14 . 1 1 152 152 TRP N N 152 118.092 118.092 122.116 -4.024 18792 11182 1 14 . 1 1 152 152 TRP C C 152 178.571 178.571 177.890 0.681 18792 11183 1 14 . 1 1 152 152 TRP CA C 152 60.077 60.077 63.352 -3.275 18792 11184 1 14 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.767 -1.179 18792 11185 1 14 . 1 1 152 152 TRP H H 152 8.644 8.644 9.218 -0.574 18792 11186 1 14 . 1 1 153 153 ASP N N 153 117.758 117.758 118.015 -0.257 18792 11187 1 14 . 1 1 153 153 ASP C C 153 179.796 179.796 178.631 1.165 18792 11188 1 14 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.466 -0.164 18792 11189 1 14 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.862 -1.631 18792 11190 1 14 . 1 1 153 153 ASP H H 153 8.827 8.827 8.544 0.283 18792 11191 1 14 . 1 1 154 154 THR N N 154 116.817 116.817 117.716 -0.899 18792 11192 1 14 . 1 1 154 154 THR C C 154 175.352 175.352 176.449 -1.097 18792 11193 1 14 . 1 1 154 154 THR CA C 154 65.910 65.910 66.454 -0.544 18792 11194 1 14 . 1 1 154 154 THR CB C 154 67.712 67.712 68.791 -1.079 18792 11195 1 14 . 1 1 154 154 THR H H 154 7.494 7.494 7.561 -0.067 18792 11196 1 14 . 1 1 155 155 PHE N N 155 122.196 122.196 121.447 0.749 18792 11197 1 14 . 1 1 155 155 PHE C C 155 176.831 176.831 177.590 -0.759 18792 11198 1 14 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.045 0.241 18792 11199 1 14 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.208 -1.541 18792 11200 1 14 . 1 1 155 155 PHE H H 155 6.477 6.477 8.558 -2.081 18792 11201 1 14 . 1 1 156 156 VAL N N 156 117.387 117.387 118.741 -1.354 18792 11202 1 14 . 1 1 156 156 VAL C C 156 178.497 178.497 177.840 0.657 18792 11203 1 14 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.624 -0.393 18792 11204 1 14 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.641 -0.956 18792 11205 1 14 . 1 1 156 156 VAL H H 156 7.788 7.788 8.088 -0.300 18792 11206 1 14 . 1 1 157 157 GLU N N 157 119.876 119.876 121.136 -1.260 18792 11207 1 14 . 1 1 157 157 GLU C C 157 178.399 178.399 178.529 -0.130 18792 11208 1 14 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.703 -0.943 18792 11209 1 14 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.797 -1.520 18792 11210 1 14 . 1 1 157 157 GLU H H 157 7.409 7.409 8.370 -0.961 18792 11211 1 14 . 1 1 158 158 LEU N N 158 117.194 117.194 119.869 -2.675 18792 11212 1 14 . 1 1 158 158 LEU C C 158 178.595 178.595 178.444 0.151 18792 11213 1 14 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.240 -0.863 18792 11214 1 14 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.426 0.145 18792 11215 1 14 . 1 1 158 158 LEU H H 158 7.584 7.584 7.652 -0.068 18792 11216 1 14 . 1 1 159 159 TYR N N 159 115.549 115.549 118.455 -2.906 18792 11217 1 14 . 1 1 159 159 TYR C C 159 177.032 177.032 177.126 -0.094 18792 11218 1 14 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.951 -0.835 18792 11219 1 14 . 1 1 159 159 TYR CB C 159 37.599 37.599 39.284 -1.685 18792 11220 1 14 . 1 1 159 159 TYR H H 159 8.099 8.099 8.272 -0.173 18792 11221 1 14 . 1 1 160 160 GLY N N 160 108.334 108.334 105.896 2.438 18792 11222 1 14 . 1 1 160 160 GLY C C 160 173.973 173.973 175.293 -1.320 18792 11223 1 14 . 1 1 160 160 GLY CA C 160 45.064 45.064 45.062 0.002 18792 11224 1 14 . 1 1 160 160 GLY H H 160 8.020 8.020 8.096 -0.076 18792 11225 1 14 . 1 1 161 161 ASN N N 161 118.189 118.189 118.858 -0.669 18792 11226 1 14 . 1 1 161 161 ASN C C 161 175.513 175.513 175.964 -0.451 18792 11227 1 14 . 1 1 161 161 ASN CA C 161 53.104 53.104 53.185 -0.081 18792 11228 1 14 . 1 1 161 161 ASN CB C 161 38.203 38.203 39.380 -1.177 18792 11229 1 14 . 1 1 161 161 ASN H H 161 8.327 8.327 7.649 0.678 18792 11230 1 14 . 1 1 162 162 ASN N N 162 119.022 119.022 119.224 -0.202 18792 11231 1 14 . 1 1 162 162 ASN C C 162 175.690 175.690 174.392 1.298 18792 11232 1 14 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.521 -0.097 18792 11233 1 14 . 1 1 162 162 ASN CB C 162 38.203 38.203 36.325 1.878 18792 11234 1 14 . 1 1 162 162 ASN H H 162 8.363 8.363 8.754 -0.391 18792 11235 1 14 . 1 1 163 163 ALA N N 163 123.275 123.275 123.063 0.212 18792 11236 1 14 . 1 1 163 163 ALA C C 163 178.598 178.598 177.216 1.382 18792 11237 1 14 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.264 -0.026 18792 11238 1 14 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.408 -1.797 18792 11239 1 14 . 1 1 163 163 ALA H H 163 8.103 8.103 7.978 0.125 18792 11240 1 14 . 1 1 164 164 ALA N N 164 121.521 121.521 120.008 1.513 18792 11241 1 14 . 1 1 164 164 ALA C C 164 178.642 178.642 179.402 -0.760 18792 11242 1 14 . 1 1 164 164 ALA CA C 164 52.584 52.584 52.757 -0.173 18792 11243 1 14 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.883 -1.064 18792 11244 1 14 . 1 1 164 164 ALA H H 164 8.053 8.053 8.150 -0.097 18792 11245 1 14 . 1 1 165 165 ALA N N 165 122.101 122.101 121.966 0.135 18792 11246 1 14 . 1 1 165 165 ALA C C 165 179.124 179.124 177.773 1.351 18792 11247 1 14 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.194 -1.055 18792 11248 1 14 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.298 -0.320 18792 11249 1 14 . 1 1 165 165 ALA H H 165 7.949 7.949 8.049 -0.100 18792 11250 1 14 . 1 1 166 166 GLU N N 166 118.381 118.381 116.687 1.694 18792 11251 1 14 . 1 1 166 166 GLU C C 166 177.664 177.664 176.875 0.789 18792 11252 1 14 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.062 1.026 18792 11253 1 14 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.464 -1.110 18792 11254 1 14 . 1 1 166 166 GLU H H 166 8.202 8.202 8.290 -0.088 18792 11255 1 14 . 1 1 167 167 SER N N 167 115.193 115.193 115.627 -0.434 18792 11256 1 14 . 1 1 167 167 SER C C 167 175.312 175.312 175.576 -0.264 18792 11257 1 14 . 1 1 167 167 SER CA C 167 58.831 58.831 60.842 -2.011 18792 11258 1 14 . 1 1 167 167 SER CB C 167 62.537 62.537 63.462 -0.925 18792 11259 1 14 . 1 1 167 167 SER H H 167 8.029 8.029 8.045 -0.016 18792 11260 1 14 . 1 1 168 168 ARG N N 168 121.696 121.696 117.283 4.413 18792 11261 1 14 . 1 1 168 168 ARG C C 168 176.880 176.880 175.796 1.084 18792 11262 1 14 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.314 -0.151 18792 11263 1 14 . 1 1 168 168 ARG CB C 168 29.209 29.209 31.244 -2.035 18792 11264 1 14 . 1 1 168 168 ARG H H 168 7.967 7.967 8.749 -0.782 18792 11265 1 14 . 1 1 169 169 LYS N N 169 120.917 120.917 118.190 2.727 18792 11266 1 14 . 1 1 169 169 LYS C C 169 177.640 177.640 175.049 2.591 18792 11267 1 14 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.444 0.253 18792 11268 1 14 . 1 1 169 169 LYS CB C 169 31.462 31.462 34.406 -2.944 18792 11269 1 14 . 1 1 169 169 LYS H H 169 8.011 8.011 8.177 -0.166 18792 11270 1 14 . 1 1 170 170 GLY N N 170 109.155 109.155 110.168 -1.013 18792 11271 1 14 . 1 1 170 170 GLY C C 170 174.479 174.479 172.684 1.795 18792 11272 1 14 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.293 -0.229 18792 11273 1 14 . 1 1 170 170 GLY H H 170 8.329 8.329 8.455 -0.126 18792 11274 1 14 . 1 1 171 171 GLN N N 171 119.292 119.292 120.334 -1.042 18792 11275 1 14 . 1 1 171 171 GLN C C 171 176.463 176.463 174.160 2.303 18792 11276 1 14 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.232 0.434 18792 11277 1 14 . 1 1 171 171 GLN CB C 171 28.199 28.199 31.922 -3.723 18792 11278 1 14 . 1 1 171 171 GLN H H 171 8.035 8.035 8.892 -0.857 18792 11279 1 14 . 1 1 172 172 GLU N N 172 121.703 121.703 121.112 0.591 18792 11280 1 14 . 1 1 172 172 GLU C C 172 176.414 176.414 174.834 1.580 18792 11281 1 14 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.496 0.845 18792 11282 1 14 . 1 1 172 172 GLU CB C 172 28.821 28.821 31.773 -2.952 18792 11283 1 14 . 1 1 172 172 GLU H H 172 8.405 8.405 8.740 -0.335 18792 11284 1 14 . 1 1 173 173 ARG N N 173 121.852 121.852 119.862 1.990 18792 11285 1 14 . 1 1 173 173 ARG C C 173 176.365 176.365 174.393 1.972 18792 11286 1 14 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.485 0.714 18792 11287 1 14 . 1 1 173 173 ARG CB C 173 29.131 29.131 32.620 -3.489 18792 11288 1 14 . 1 1 173 173 ARG H H 173 8.335 8.335 8.734 -0.399 18792 11289 1 14 . 1 1 174 174 LEU N N 174 122.640 122.640 120.977 1.663 18792 11290 1 14 . 1 1 174 174 LEU C C 174 176.523 176.523 174.841 1.682 18792 11291 1 14 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.737 0.031 18792 11292 1 14 . 1 1 174 174 LEU CB C 174 40.784 40.784 44.656 -3.872 18792 11293 1 14 . 1 1 174 174 LEU H H 174 8.082 8.082 8.937 -0.855 18792 11294 1 14 . 1 1 175 175 GLU N N 175 125.909 125.909 119.883 6.026 18792 11295 1 14 . 1 1 175 175 GLU C C 175 181.029 181.029 174.622 6.407 18792 11296 1 14 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.863 1.535 18792 11297 1 14 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.315 -1.265 18792 11298 1 14 . 1 1 175 175 GLU H H 175 7.785 7.785 8.587 -0.802 18792 11299 1 15 . 1 1 4 4 ALA N N 4 124.786 124.786 122.647 2.139 18792 11300 1 15 . 1 1 4 4 ALA C C 4 178.272 178.272 178.936 -0.664 18792 11301 1 15 . 1 1 4 4 ALA CA C 4 52.566 52.566 53.031 -0.465 18792 11302 1 15 . 1 1 4 4 ALA CB C 4 18.234 18.234 19.929 -1.695 18792 11303 1 15 . 1 1 4 4 ALA H H 4 8.414 8.414 7.844 0.570 18792 11304 1 15 . 1 1 5 5 MET N N 5 119.681 119.681 117.955 1.726 18792 11305 1 15 . 1 1 5 5 MET C C 5 176.929 176.929 178.008 -1.079 18792 11306 1 15 . 1 1 5 5 MET CA C 5 55.594 55.594 58.365 -2.771 18792 11307 1 15 . 1 1 5 5 MET CB C 5 31.540 31.540 32.246 -0.706 18792 11308 1 15 . 1 1 5 5 MET H H 5 8.336 8.336 8.364 -0.028 18792 11309 1 15 . 1 1 6 6 SER N N 6 116.162 116.162 117.418 -1.256 18792 11310 1 15 . 1 1 6 6 SER C C 6 175.924 175.924 176.706 -0.782 18792 11311 1 15 . 1 1 6 6 SER CA C 6 59.009 59.009 61.760 -2.751 18792 11312 1 15 . 1 1 6 6 SER CB C 6 62.537 62.537 62.816 -0.279 18792 11313 1 15 . 1 1 6 6 SER H H 6 8.272 8.272 8.223 0.049 18792 11314 1 15 . 1 1 7 7 GLN N N 7 122.263 122.263 120.733 1.530 18792 11315 1 15 . 1 1 7 7 GLN C C 7 177.027 177.027 178.243 -1.216 18792 11316 1 15 . 1 1 7 7 GLN CA C 7 56.270 56.270 59.007 -2.737 18792 11317 1 15 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.655 -0.916 18792 11318 1 15 . 1 1 7 7 GLN H H 7 8.314 8.314 7.959 0.355 18792 11319 1 15 . 1 1 8 8 SER N N 8 116.625 116.625 114.915 1.710 18792 11320 1 15 . 1 1 8 8 SER C C 8 176.457 176.457 176.476 -0.019 18792 11321 1 15 . 1 1 8 8 SER CA C 8 59.650 59.650 61.253 -1.603 18792 11322 1 15 . 1 1 8 8 SER CB C 8 62.226 62.226 62.851 -0.625 18792 11323 1 15 . 1 1 8 8 SER H H 8 8.333 8.333 8.346 -0.013 18792 11324 1 15 . 1 1 9 9 ASN N N 9 121.307 121.307 120.527 0.780 18792 11325 1 15 . 1 1 9 9 ASN C C 9 177.419 177.419 177.679 -0.260 18792 11326 1 15 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.781 -1.294 18792 11327 1 15 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.892 -1.759 18792 11328 1 15 . 1 1 9 9 ASN H H 9 8.611 8.611 8.136 0.475 18792 11329 1 15 . 1 1 10 10 ARG N N 10 119.830 119.830 119.915 -0.085 18792 11330 1 15 . 1 1 10 10 ARG C C 10 177.615 177.615 178.510 -0.895 18792 11331 1 15 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.250 0.008 18792 11332 1 15 . 1 1 10 10 ARG CB C 10 28.199 28.199 29.265 -1.066 18792 11333 1 15 . 1 1 10 10 ARG H H 10 7.996 7.996 8.518 -0.522 18792 11334 1 15 . 1 1 11 11 GLU N N 11 117.270 117.270 120.577 -3.307 18792 11335 1 15 . 1 1 11 11 GLU C C 11 179.649 179.649 178.793 0.856 18792 11336 1 15 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.231 -0.222 18792 11337 1 15 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.539 -1.418 18792 11338 1 15 . 1 1 11 11 GLU H H 11 7.885 7.885 8.027 -0.142 18792 11339 1 15 . 1 1 12 12 LEU N N 12 119.900 119.900 122.074 -2.174 18792 11340 1 15 . 1 1 12 12 LEU C C 12 178.473 178.473 178.277 0.196 18792 11341 1 15 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.360 -0.667 18792 11342 1 15 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.796 -1.167 18792 11343 1 15 . 1 1 12 12 LEU H H 12 7.691 7.691 8.103 -0.412 18792 11344 1 15 . 1 1 13 13 VAL N N 13 117.320 117.320 118.779 -1.459 18792 11345 1 15 . 1 1 13 13 VAL C C 13 177.272 177.272 178.079 -0.807 18792 11346 1 15 . 1 1 13 13 VAL CA C 13 67.156 67.156 67.683 -0.527 18792 11347 1 15 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.933 -0.704 18792 11348 1 15 . 1 1 13 13 VAL H H 13 7.629 7.629 7.678 -0.048 18792 11349 1 15 . 1 1 14 14 VAL N N 14 116.659 116.659 120.431 -3.772 18792 11350 1 15 . 1 1 14 14 VAL C C 14 178.718 178.718 177.999 0.719 18792 11351 1 15 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.543 -0.027 18792 11352 1 15 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.351 -0.977 18792 11353 1 15 . 1 1 14 14 VAL H H 14 8.210 8.210 7.824 0.386 18792 11354 1 15 . 1 1 15 15 ASP N N 15 120.374 120.374 121.576 -1.202 18792 11355 1 15 . 1 1 15 15 ASP C C 15 177.557 177.557 178.481 -0.924 18792 11356 1 15 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.659 0.817 18792 11357 1 15 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.428 2.125 18792 11358 1 15 . 1 1 15 15 ASP H H 15 7.967 7.967 8.596 -0.629 18792 11359 1 15 . 1 1 16 16 PHE N N 16 119.864 119.864 120.921 -1.057 18792 11360 1 15 . 1 1 16 16 PHE C C 16 178.252 178.252 177.597 0.655 18792 11361 1 15 . 1 1 16 16 PHE CA C 16 62.780 62.780 62.173 0.607 18792 11362 1 15 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.541 -0.481 18792 11363 1 15 . 1 1 16 16 PHE H H 16 8.228 8.228 7.910 0.318 18792 11364 1 15 . 1 1 17 17 LEU N N 17 116.312 116.312 119.520 -3.208 18792 11365 1 15 . 1 1 17 17 LEU C C 17 179.649 179.649 179.069 0.580 18792 11366 1 15 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.164 -0.400 18792 11367 1 15 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.557 -1.472 18792 11368 1 15 . 1 1 17 17 LEU H H 17 8.766 8.766 8.654 0.112 18792 11369 1 15 . 1 1 18 18 SER N N 18 113.715 113.715 114.504 -0.789 18792 11370 1 15 . 1 1 18 18 SER C C 18 177.362 177.362 176.508 0.854 18792 11371 1 15 . 1 1 18 18 SER CA C 18 61.948 61.948 61.095 0.853 18792 11372 1 15 . 1 1 18 18 SER CB C 18 63.003 63.003 63.317 -0.314 18792 11373 1 15 . 1 1 18 18 SER H H 18 8.384 8.384 8.397 -0.013 18792 11374 1 15 . 1 1 19 19 TYR N N 19 124.570 124.570 122.367 2.203 18792 11375 1 15 . 1 1 19 19 TYR C C 19 178.415 178.415 178.297 0.118 18792 11376 1 15 . 1 1 19 19 TYR CA C 19 59.764 59.764 60.729 -0.965 18792 11377 1 15 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.156 -1.140 18792 11378 1 15 . 1 1 19 19 TYR H H 19 8.155 8.155 8.487 -0.332 18792 11379 1 15 . 1 1 20 20 LYS N N 20 119.739 119.739 119.906 -0.167 18792 11380 1 15 . 1 1 20 20 LYS C C 20 180.456 180.456 178.940 1.516 18792 11381 1 15 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.903 -2.415 18792 11382 1 15 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.404 -4.245 18792 11383 1 15 . 1 1 20 20 LYS H H 20 8.224 8.224 8.211 0.013 18792 11384 1 15 . 1 1 21 21 LEU N N 21 118.092 118.092 120.250 -2.158 18792 11385 1 15 . 1 1 21 21 LEU C C 21 179.989 179.989 177.884 2.105 18792 11386 1 15 . 1 1 21 21 LEU CA C 21 58.126 58.126 57.743 0.383 18792 11387 1 15 . 1 1 21 21 LEU CB C 21 39.608 39.608 42.061 -2.453 18792 11388 1 15 . 1 1 21 21 LEU H H 21 8.586 8.586 7.854 0.732 18792 11389 1 15 . 1 1 22 22 SER N N 22 117.304 117.304 110.870 6.434 18792 11390 1 15 . 1 1 22 22 SER C C 22 180.152 180.152 176.770 3.382 18792 11391 1 15 . 1 1 22 22 SER CA C 22 61.287 61.287 60.555 0.732 18792 11392 1 15 . 1 1 22 22 SER H H 22 8.266 8.266 7.438 0.828 18792 11393 1 15 . 1 1 23 23 GLN N N 23 122.497 122.497 121.792 0.705 18792 11394 1 15 . 1 1 23 23 GLN C C 23 177.297 177.297 177.042 0.255 18792 11395 1 15 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.186 -0.244 18792 11396 1 15 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.973 -1.161 18792 11397 1 15 . 1 1 23 23 GLN H H 23 7.571 7.571 7.476 0.095 18792 11398 1 15 . 1 1 24 24 LYS N N 24 116.038 116.038 117.161 -1.123 18792 11399 1 15 . 1 1 24 24 LYS C C 24 175.704 175.704 175.263 0.441 18792 11400 1 15 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.025 -2.530 18792 11401 1 15 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.568 -2.339 18792 11402 1 15 . 1 1 24 24 LYS H H 24 7.134 7.134 7.565 -0.431 18792 11403 1 15 . 1 1 25 25 GLY N N 25 105.283 105.283 106.722 -1.439 18792 11404 1 15 . 1 1 25 25 GLY C C 25 174.013 174.013 174.180 -0.167 18792 11405 1 15 . 1 1 25 25 GLY CA C 25 44.779 44.779 45.390 -0.611 18792 11406 1 15 . 1 1 25 25 GLY H H 25 7.483 7.483 7.643 -0.160 18792 11407 1 15 . 1 1 26 26 TYR N N 26 119.547 119.547 120.627 -1.080 18792 11408 1 15 . 1 1 26 26 TYR C C 26 175.122 175.122 176.485 -1.363 18792 11409 1 15 . 1 1 26 26 TYR CA C 26 55.132 55.132 58.742 -3.610 18792 11410 1 15 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.294 0.786 18792 11411 1 15 . 1 1 26 26 TYR H H 26 7.788 7.788 7.927 -0.139 18792 11412 1 15 . 1 1 27 27 SER N N 27 115.088 115.088 116.100 -1.012 18792 11413 1 15 . 1 1 27 27 SER C C 27 174.452 174.452 176.252 -1.800 18792 11414 1 15 . 1 1 27 27 SER CA C 27 56.306 56.306 59.116 -2.810 18792 11415 1 15 . 1 1 27 27 SER CB C 27 63.921 63.921 63.508 0.413 18792 11416 1 15 . 1 1 27 27 SER H H 27 8.473 8.473 8.824 -0.351 18792 11417 1 15 . 1 1 28 28 TRP N N 28 127.014 127.014 126.914 0.100 18792 11418 1 15 . 1 1 28 28 TRP C C 28 177.002 177.002 177.229 -0.227 18792 11419 1 15 . 1 1 28 28 TRP CA C 28 59.472 59.472 58.694 0.778 18792 11420 1 15 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.458 1.372 18792 11421 1 15 . 1 1 28 28 TRP H H 28 8.897 8.897 8.493 0.404 18792 11422 1 15 . 1 1 29 29 SER N N 29 112.044 112.044 112.934 -0.890 18792 11423 1 15 . 1 1 29 29 SER C C 29 175.106 175.106 174.734 0.372 18792 11424 1 15 . 1 1 29 29 SER CA C 29 59.472 59.472 59.009 0.463 18792 11425 1 15 . 1 1 29 29 SER CB C 29 62.226 62.226 63.452 -1.226 18792 11426 1 15 . 1 1 29 29 SER H H 29 8.129 8.129 8.089 0.040 18792 11427 1 15 . 1 1 30 30 GLN N N 30 119.160 119.160 119.030 0.130 18792 11428 1 15 . 1 1 30 30 GLN C C 30 176.218 176.218 175.330 0.888 18792 11429 1 15 . 1 1 30 30 GLN CA C 30 56.412 56.412 54.474 1.938 18792 11430 1 15 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.775 -1.197 18792 11431 1 15 . 1 1 30 30 GLN H H 30 7.370 7.370 8.087 -0.717 18792 11432 1 15 . 1 1 31 31 PHE N N 31 116.277 116.277 122.702 -6.425 18792 11433 1 15 . 1 1 31 31 PHE C C 31 175.217 175.217 175.805 -0.588 18792 11434 1 15 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.398 -2.164 18792 11435 1 15 . 1 1 31 31 PHE CB C 31 39.066 39.066 39.154 -0.087 18792 11436 1 15 . 1 1 31 31 PHE H H 31 7.248 7.248 7.781 -0.533 18792 11437 1 15 . 1 1 32 32 SER N N 32 113.683 113.683 115.867 -2.184 18792 11438 1 15 . 1 1 32 32 SER C C 32 173.793 173.793 174.265 -0.472 18792 11439 1 15 . 1 1 32 32 SER CA C 32 57.124 57.124 58.310 -1.186 18792 11440 1 15 . 1 1 32 32 SER CB C 32 63.081 63.081 64.049 -0.967 18792 11441 1 15 . 1 1 32 32 SER H H 32 7.242 7.242 7.685 -0.443 18792 11442 1 15 . 1 1 33 33 ASP N N 33 122.195 122.195 119.643 2.552 18792 11443 1 15 . 1 1 33 33 ASP C C 33 176.394 176.394 176.422 -0.028 18792 11444 1 15 . 1 1 33 33 ASP CA C 33 53.748 53.748 53.748 0.000 18792 11445 1 15 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.889 -0.491 18792 11446 1 15 . 1 1 33 33 ASP H H 33 8.257 8.257 8.326 -0.069 18792 11447 1 15 . 1 1 34 34 VAL N N 34 118.913 118.913 118.247 0.666 18792 11448 1 15 . 1 1 34 34 VAL C C 34 176.328 176.328 175.403 0.925 18792 11449 1 15 . 1 1 34 34 VAL CA C 34 61.891 61.891 63.373 -1.482 18792 11450 1 15 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.719 -0.704 18792 11451 1 15 . 1 1 34 34 VAL H H 34 7.852 7.852 7.723 0.129 18792 11452 1 15 . 1 1 35 35 GLU N N 35 124.205 124.205 118.484 5.721 18792 11453 1 15 . 1 1 35 35 GLU C C 35 176.586 176.586 174.772 1.814 18792 11454 1 15 . 1 1 35 35 GLU CA C 35 56.057 56.057 55.615 0.442 18792 11455 1 15 . 1 1 35 35 GLU CB C 35 28.898 28.898 32.578 -3.680 18792 11456 1 15 . 1 1 35 35 GLU H H 35 8.401 8.401 7.833 0.568 18792 11457 1 15 . 1 1 36 36 GLU N N 36 121.670 121.670 117.701 3.969 18792 11458 1 15 . 1 1 36 36 GLU C C 36 176.218 176.218 175.503 0.715 18792 11459 1 15 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.272 -0.284 18792 11460 1 15 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.905 -1.463 18792 11461 1 15 . 1 1 36 36 GLU H H 36 8.239 8.239 8.377 -0.138 18792 11462 1 15 . 1 1 37 37 ASN N N 37 119.252 119.252 117.990 1.262 18792 11463 1 15 . 1 1 37 37 ASN C C 37 175.003 175.003 173.930 1.073 18792 11464 1 15 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.742 -1.087 18792 11465 1 15 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.655 -1.443 18792 11466 1 15 . 1 1 37 37 ASN H H 37 8.412 8.412 8.052 0.360 18792 11467 1 15 . 1 1 38 38 ARG N N 38 121.622 121.622 119.394 2.228 18792 11468 1 15 . 1 1 38 38 ARG C C 38 176.610 176.610 174.354 2.256 18792 11469 1 15 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.010 -0.646 18792 11470 1 15 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.738 -2.320 18792 11471 1 15 . 1 1 38 38 ARG H H 38 8.227 8.227 8.081 0.146 18792 11472 1 15 . 1 1 39 39 THR N N 39 115.681 115.681 110.640 5.041 18792 11473 1 15 . 1 1 39 39 THR C C 39 174.500 174.500 174.807 -0.307 18792 11474 1 15 . 1 1 39 39 THR CA C 39 61.606 61.606 61.505 0.100 18792 11475 1 15 . 1 1 39 39 THR CB C 39 69.163 69.163 69.301 -0.138 18792 11476 1 15 . 1 1 39 39 THR H H 39 8.173 8.173 8.388 -0.215 18792 11477 1 15 . 1 1 40 40 GLU N N 40 122.708 122.708 123.224 -0.516 18792 11478 1 15 . 1 1 40 40 GLU C C 40 175.728 175.728 176.291 -0.563 18792 11479 1 15 . 1 1 40 40 GLU CA C 40 55.772 55.772 57.682 -1.910 18792 11480 1 15 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.849 -0.794 18792 11481 1 15 . 1 1 40 40 GLU H H 40 8.298 8.298 8.903 -0.605 18792 11482 1 15 . 1 1 41 41 ALA N N 41 125.922 125.922 120.634 5.288 18792 11483 1 15 . 1 1 41 41 ALA C C 41 175.557 175.557 176.387 -0.830 18792 11484 1 15 . 1 1 41 41 ALA CA C 41 49.973 49.973 52.011 -2.038 18792 11485 1 15 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.064 0.182 18792 11486 1 15 . 1 1 41 41 ALA H H 41 8.212 8.212 7.734 0.478 18792 11487 1 15 . 1 1 43 43 GLU N N 43 120.783 120.783 118.236 2.547 18792 11488 1 15 . 1 1 43 43 GLU C C 43 177.174 177.174 175.996 1.178 18792 11489 1 15 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.346 -0.005 18792 11490 1 15 . 1 1 43 43 GLU CB C 43 29.287 29.287 28.874 0.413 18792 11491 1 15 . 1 1 43 43 GLU H H 43 8.519 8.519 8.356 0.163 18792 11492 1 15 . 1 1 44 44 GLY N N 44 110.022 110.022 108.605 1.417 18792 11493 1 15 . 1 1 44 44 GLY C C 44 174.773 174.773 174.304 0.469 18792 11494 1 15 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.251 -0.223 18792 11495 1 15 . 1 1 44 44 GLY H H 44 8.429 8.429 8.459 -0.030 18792 11496 1 15 . 1 1 45 45 THR N N 45 112.790 112.790 111.999 0.791 18792 11497 1 15 . 1 1 45 45 THR C C 45 175.726 175.726 174.640 1.086 18792 11498 1 15 . 1 1 45 45 THR CA C 45 61.987 61.987 61.012 0.975 18792 11499 1 15 . 1 1 45 45 THR CB C 45 69.304 69.304 70.413 -1.109 18792 11500 1 15 . 1 1 45 45 THR H H 45 8.125 8.125 7.611 0.514 18792 11501 1 15 . 1 1 46 46 GLU N N 46 122.752 122.752 125.190 -2.438 18792 11502 1 15 . 1 1 46 46 GLU C C 46 177.419 177.419 176.777 0.642 18792 11503 1 15 . 1 1 46 46 GLU CA C 46 57.231 57.231 58.891 -1.660 18792 11504 1 15 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.422 -1.223 18792 11505 1 15 . 1 1 46 46 GLU H H 46 8.765 8.765 8.847 -0.082 18792 11506 1 15 . 1 1 47 47 SER N N 47 114.895 114.895 110.710 4.185 18792 11507 1 15 . 1 1 47 47 SER C C 47 175.826 175.826 174.614 1.212 18792 11508 1 15 . 1 1 47 47 SER CA C 47 58.582 58.582 59.069 -0.486 18792 11509 1 15 . 1 1 47 47 SER CB C 47 62.537 62.537 62.484 0.053 18792 11510 1 15 . 1 1 47 47 SER H H 47 8.355 8.355 8.164 0.191 18792 11511 1 15 . 1 1 48 48 GLU N N 48 122.429 122.429 120.220 2.209 18792 11512 1 15 . 1 1 48 48 GLU C C 48 178.099 178.099 177.933 0.166 18792 11513 1 15 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.461 0.157 18792 11514 1 15 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.746 -1.271 18792 11515 1 15 . 1 1 48 48 GLU H H 48 8.139 8.139 8.517 -0.378 18792 11516 1 15 . 1 1 49 49 ALA N N 49 120.374 120.374 122.566 -2.192 18792 11517 1 15 . 1 1 49 49 ALA C C 49 180.843 180.843 179.256 1.587 18792 11518 1 15 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.203 -0.720 18792 11519 1 15 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.124 -0.689 18792 11520 1 15 . 1 1 49 49 ALA H H 49 8.079 8.079 8.188 -0.109 18792 11521 1 15 . 1 1 50 50 VAL N N 50 118.599 118.599 119.078 -0.479 18792 11522 1 15 . 1 1 50 50 VAL C C 50 176.921 176.921 177.583 -0.662 18792 11523 1 15 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.424 -0.864 18792 11524 1 15 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.360 -1.063 18792 11525 1 15 . 1 1 50 50 VAL H H 50 7.419 7.419 7.942 -0.523 18792 11526 1 15 . 1 1 51 51 LYS N N 51 117.469 117.469 120.392 -2.923 18792 11527 1 15 . 1 1 51 51 LYS C C 51 179.061 179.061 178.501 0.560 18792 11528 1 15 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.988 -0.765 18792 11529 1 15 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.054 -1.058 18792 11530 1 15 . 1 1 51 51 LYS H H 51 7.359 7.359 7.870 -0.511 18792 11531 1 15 . 1 1 52 52 GLN N N 52 115.930 115.930 118.734 -2.804 18792 11532 1 15 . 1 1 52 52 GLN C C 52 177.713 177.713 178.057 -0.344 18792 11533 1 15 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.792 -0.316 18792 11534 1 15 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.839 -2.271 18792 11535 1 15 . 1 1 52 52 GLN H H 52 8.025 8.025 7.947 0.078 18792 11536 1 15 . 1 1 53 53 ALA N N 53 119.782 119.782 122.237 -2.455 18792 11537 1 15 . 1 1 53 53 ALA C C 53 180.008 180.008 179.351 0.657 18792 11538 1 15 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.523 -0.138 18792 11539 1 15 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.508 -0.993 18792 11540 1 15 . 1 1 53 53 ALA H H 53 7.655 7.655 7.978 -0.323 18792 11541 1 15 . 1 1 54 54 LEU N N 54 120.443 120.443 120.481 -0.038 18792 11542 1 15 . 1 1 54 54 LEU C C 54 179.330 179.330 178.109 1.221 18792 11543 1 15 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.419 0.594 18792 11544 1 15 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.322 -0.460 18792 11545 1 15 . 1 1 54 54 LEU H H 54 8.419 8.419 8.364 0.055 18792 11546 1 15 . 1 1 55 55 ARG N N 55 118.423 118.423 119.353 -0.930 18792 11547 1 15 . 1 1 55 55 ARG C C 55 178.767 178.767 178.458 0.309 18792 11548 1 15 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.831 0.566 18792 11549 1 15 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.355 -1.612 18792 11550 1 15 . 1 1 55 55 ARG H H 55 8.062 8.062 7.862 0.200 18792 11551 1 15 . 1 1 56 56 GLU N N 56 115.988 115.988 118.912 -2.924 18792 11552 1 15 . 1 1 56 56 GLU C C 56 180.090 180.090 178.769 1.321 18792 11553 1 15 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.490 -0.730 18792 11554 1 15 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.628 -1.274 18792 11555 1 15 . 1 1 56 56 GLU H H 56 7.772 7.772 8.148 -0.376 18792 11556 1 15 . 1 1 57 57 ALA N N 57 122.837 122.837 121.997 0.840 18792 11557 1 15 . 1 1 57 57 ALA C C 57 181.861 181.861 180.019 1.842 18792 11558 1 15 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.941 -0.307 18792 11559 1 15 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.872 -0.399 18792 11560 1 15 . 1 1 57 57 ALA H H 57 8.774 8.774 8.321 0.453 18792 11561 1 15 . 1 1 58 58 GLY N N 58 108.409 108.409 106.585 1.824 18792 11562 1 15 . 1 1 58 58 GLY C C 58 175.331 175.331 176.130 -0.799 18792 11563 1 15 . 1 1 58 58 GLY CA C 58 46.668 46.668 47.011 -0.343 18792 11564 1 15 . 1 1 58 58 GLY H H 58 9.073 9.073 8.059 1.014 18792 11565 1 15 . 1 1 59 59 ASP N N 59 122.074 122.074 122.319 -0.245 18792 11566 1 15 . 1 1 59 59 ASP C C 59 179.023 179.023 178.900 0.123 18792 11567 1 15 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.456 -0.154 18792 11568 1 15 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.649 -1.807 18792 11569 1 15 . 1 1 59 59 ASP H H 59 8.049 8.049 8.460 -0.411 18792 11570 1 15 . 1 1 60 60 GLU N N 60 120.131 120.131 119.922 0.209 18792 11571 1 15 . 1 1 60 60 GLU C C 60 178.522 178.522 178.397 0.125 18792 11572 1 15 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.237 -0.228 18792 11573 1 15 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.916 -1.716 18792 11574 1 15 . 1 1 60 60 GLU H H 60 8.136 8.136 8.410 -0.274 18792 11575 1 15 . 1 1 61 61 PHE N N 61 121.309 121.309 119.991 1.318 18792 11576 1 15 . 1 1 61 61 PHE C C 61 176.904 176.904 177.858 -0.954 18792 11577 1 15 . 1 1 61 61 PHE CA C 61 61.322 61.322 60.958 0.364 18792 11578 1 15 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.797 -1.188 18792 11579 1 15 . 1 1 61 61 PHE H H 61 8.523 8.523 8.096 0.427 18792 11580 1 15 . 1 1 62 62 GLU N N 62 115.971 115.971 119.568 -3.597 18792 11581 1 15 . 1 1 62 62 GLU C C 62 177.713 177.713 177.781 -0.068 18792 11582 1 15 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.585 -0.394 18792 11583 1 15 . 1 1 62 62 GLU CB C 62 28.277 28.277 28.514 -0.237 18792 11584 1 15 . 1 1 62 62 GLU H H 62 7.969 7.969 8.342 -0.373 18792 11585 1 15 . 1 1 63 63 LEU N N 63 116.703 116.703 118.989 -2.286 18792 11586 1 15 . 1 1 63 63 LEU C C 63 178.963 178.963 178.460 0.503 18792 11587 1 15 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.805 -0.393 18792 11588 1 15 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.891 -1.485 18792 11589 1 15 . 1 1 63 63 LEU H H 63 7.347 7.347 7.697 -0.350 18792 11590 1 15 . 1 1 64 64 ARG N N 64 117.453 117.453 117.098 0.355 18792 11591 1 15 . 1 1 64 64 ARG C C 64 177.297 177.297 176.338 0.959 18792 11592 1 15 . 1 1 64 64 ARG CA C 64 57.337 57.337 58.010 -0.673 18792 11593 1 15 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.630 -2.033 18792 11594 1 15 . 1 1 64 64 ARG H H 64 7.995 7.995 8.240 -0.245 18792 11595 1 15 . 1 1 65 65 TYR N N 65 118.956 118.956 116.910 2.046 18792 11596 1 15 . 1 1 65 65 TYR C C 65 175.278 175.278 175.508 -0.230 18792 11597 1 15 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.455 -2.754 18792 11598 1 15 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.975 -3.989 18792 11599 1 15 . 1 1 65 65 TYR H H 65 7.909 7.909 7.870 0.039 18792 11600 1 15 . 1 1 66 66 ARG N N 66 119.438 119.438 116.375 3.063 18792 11601 1 15 . 1 1 66 66 ARG C C 66 178.424 178.424 177.478 0.946 18792 11602 1 15 . 1 1 66 66 ARG CA C 66 58.476 58.476 58.177 0.299 18792 11603 1 15 . 1 1 66 66 ARG CB C 66 28.821 28.821 29.602 -0.782 18792 11604 1 15 . 1 1 66 66 ARG H H 66 7.244 7.244 8.158 -0.914 18792 11605 1 15 . 1 1 67 67 ARG N N 67 118.936 118.936 119.432 -0.496 18792 11606 1 15 . 1 1 67 67 ARG C C 67 177.542 177.542 177.756 -0.214 18792 11607 1 15 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.895 -2.451 18792 11608 1 15 . 1 1 67 67 ARG CB C 67 28.121 28.121 30.331 -2.210 18792 11609 1 15 . 1 1 67 67 ARG H H 67 8.417 8.417 8.821 -0.404 18792 11610 1 15 . 1 1 68 68 ALA N N 68 121.797 121.797 119.761 2.036 18792 11611 1 15 . 1 1 68 68 ALA C C 68 180.337 180.337 179.523 0.814 18792 11612 1 15 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.737 -0.601 18792 11613 1 15 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.290 -0.823 18792 11614 1 15 . 1 1 68 68 ALA H H 68 7.827 7.827 8.375 -0.548 18792 11615 1 15 . 1 1 69 69 PHE N N 69 115.986 115.986 116.784 -0.798 18792 11616 1 15 . 1 1 69 69 PHE C C 69 177.468 177.468 177.504 -0.036 18792 11617 1 15 . 1 1 69 69 PHE CA C 69 58.049 58.049 61.681 -3.632 18792 11618 1 15 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.467 -0.868 18792 11619 1 15 . 1 1 69 69 PHE H H 69 8.517 8.517 8.294 0.223 18792 11620 1 15 . 1 1 70 70 SER N N 70 116.526 116.526 115.010 1.516 18792 11621 1 15 . 1 1 70 70 SER C C 70 177.640 177.640 176.576 1.064 18792 11622 1 15 . 1 1 70 70 SER CA C 70 61.073 61.073 61.363 -0.290 18792 11623 1 15 . 1 1 70 70 SER CB C 70 61.993 61.993 63.058 -1.065 18792 11624 1 15 . 1 1 70 70 SER H H 70 8.152 8.152 7.905 0.247 18792 11625 1 15 . 1 1 71 71 ASP N N 71 121.181 121.181 122.780 -1.599 18792 11626 1 15 . 1 1 71 71 ASP C C 71 178.546 178.546 178.728 -0.182 18792 11627 1 15 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.341 -0.893 18792 11628 1 15 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.665 -1.434 18792 11629 1 15 . 1 1 71 71 ASP H H 71 8.356 8.356 8.015 0.341 18792 11630 1 15 . 1 1 72 72 LEU N N 72 120.747 120.747 119.672 1.075 18792 11631 1 15 . 1 1 72 72 LEU C C 72 178.963 178.963 178.954 0.009 18792 11632 1 15 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.211 -0.767 18792 11633 1 15 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.038 -1.022 18792 11634 1 15 . 1 1 72 72 LEU H H 72 7.738 7.738 8.415 -0.677 18792 11635 1 15 . 1 1 73 73 THR N N 73 109.432 109.432 113.635 -4.203 18792 11636 1 15 . 1 1 73 73 THR C C 73 177.481 177.481 176.064 1.417 18792 11637 1 15 . 1 1 73 73 THR CA C 73 65.128 65.128 65.574 -0.446 18792 11638 1 15 . 1 1 73 73 THR CB C 73 67.720 67.720 68.941 -1.221 18792 11639 1 15 . 1 1 73 73 THR H H 73 8.296 8.296 7.687 0.609 18792 11640 1 15 . 1 1 74 74 SER N N 74 115.862 115.862 115.393 0.469 18792 11641 1 15 . 1 1 74 74 SER C C 74 175.361 175.361 175.695 -0.334 18792 11642 1 15 . 1 1 74 74 SER CA C 74 60.112 60.112 60.791 -0.679 18792 11643 1 15 . 1 1 74 74 SER CB C 74 62.537 62.537 63.161 -0.624 18792 11644 1 15 . 1 1 74 74 SER H H 74 7.629 7.629 8.325 -0.696 18792 11645 1 15 . 1 1 75 75 GLN N N 75 118.551 118.551 120.272 -1.721 18792 11646 1 15 . 1 1 75 75 GLN C C 75 176.316 176.316 176.663 -0.347 18792 11647 1 15 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.656 0.148 18792 11648 1 15 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.588 -1.311 18792 11649 1 15 . 1 1 75 75 GLN H H 75 7.640 7.640 7.721 -0.081 18792 11650 1 15 . 1 1 76 76 LEU N N 76 118.313 118.313 118.056 0.257 18792 11651 1 15 . 1 1 76 76 LEU C C 76 174.160 174.160 175.442 -1.282 18792 11652 1 15 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.581 -0.841 18792 11653 1 15 . 1 1 76 76 LEU CB C 76 42.727 42.727 41.064 1.663 18792 11654 1 15 . 1 1 76 76 LEU H H 76 7.411 7.411 7.630 -0.219 18792 11655 1 15 . 1 1 77 77 HIS N N 77 120.104 120.104 120.484 -0.380 18792 11656 1 15 . 1 1 77 77 HIS C C 77 174.528 174.528 174.090 0.438 18792 11657 1 15 . 1 1 77 77 HIS CA C 77 54.207 54.207 57.332 -3.125 18792 11658 1 15 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.558 -0.592 18792 11659 1 15 . 1 1 77 77 HIS H H 77 8.117 8.117 8.630 -0.513 18792 11660 1 15 . 1 1 78 78 ILE N N 78 122.298 122.298 124.903 -2.605 18792 11661 1 15 . 1 1 78 78 ILE C C 78 174.240 174.240 174.093 0.147 18792 11662 1 15 . 1 1 78 78 ILE CA C 78 61.402 61.402 61.007 0.395 18792 11663 1 15 . 1 1 78 78 ILE CB C 78 37.591 37.591 41.300 -3.709 18792 11664 1 15 . 1 1 78 78 ILE H H 78 8.655 8.655 8.160 0.495 18792 11665 1 15 . 1 1 79 79 THR N N 79 116.442 116.442 120.970 -4.528 18792 11666 1 15 . 1 1 79 79 THR C C 79 174.291 174.291 173.543 0.748 18792 11667 1 15 . 1 1 79 79 THR CA C 79 61.632 61.632 58.253 3.379 18792 11668 1 15 . 1 1 79 79 THR CB C 79 68.704 68.704 69.757 -1.053 18792 11669 1 15 . 1 1 79 79 THR H H 79 8.245 8.245 8.182 0.063 18792 11670 1 15 . 1 1 84 84 TYR N N 84 120.888 120.888 120.810 0.078 18792 11671 1 15 . 1 1 84 84 TYR C C 84 176.708 176.708 177.669 -0.961 18792 11672 1 15 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.506 -1.074 18792 11673 1 15 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.371 -1.626 18792 11674 1 15 . 1 1 84 84 TYR H H 84 8.733 8.733 8.626 0.107 18792 11675 1 15 . 1 1 85 85 GLN N N 85 114.530 114.530 118.048 -3.518 18792 11676 1 15 . 1 1 85 85 GLN C C 85 178.473 178.473 178.064 0.409 18792 11677 1 15 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.692 -0.398 18792 11678 1 15 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.498 -1.697 18792 11679 1 15 . 1 1 85 85 GLN H H 85 8.413 8.413 8.601 -0.188 18792 11680 1 15 . 1 1 86 86 SER N N 86 114.032 114.032 116.486 -2.454 18792 11681 1 15 . 1 1 86 86 SER C C 86 178.473 178.473 176.638 1.835 18792 11682 1 15 . 1 1 86 86 SER CA C 86 62.175 62.175 61.519 0.656 18792 11683 1 15 . 1 1 86 86 SER CB C 86 63.252 63.252 63.450 -0.198 18792 11684 1 15 . 1 1 86 86 SER H H 86 7.258 7.258 7.974 -0.716 18792 11685 1 15 . 1 1 88 88 GLU N N 88 119.386 119.386 120.538 -1.152 18792 11686 1 15 . 1 1 88 88 GLU C C 88 177.199 177.199 178.231 -1.032 18792 11687 1 15 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.553 -0.971 18792 11688 1 15 . 1 1 88 88 GLU CB C 88 28.976 28.976 28.921 0.055 18792 11689 1 15 . 1 1 88 88 GLU H H 88 8.534 8.534 7.778 0.756 18792 11690 1 15 . 1 1 89 89 GLN N N 89 114.678 114.678 119.728 -5.050 18792 11691 1 15 . 1 1 89 89 GLN C C 89 178.669 178.669 178.148 0.521 18792 11692 1 15 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.209 -0.626 18792 11693 1 15 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.433 -1.012 18792 11694 1 15 . 1 1 89 89 GLN H H 89 7.500 7.500 7.682 -0.182 18792 11695 1 15 . 1 1 90 90 VAL N N 90 118.174 118.174 119.142 -0.968 18792 11696 1 15 . 1 1 90 90 VAL C C 90 178.081 178.081 177.055 1.026 18792 11697 1 15 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.589 -0.034 18792 11698 1 15 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.325 -0.718 18792 11699 1 15 . 1 1 90 90 VAL H H 90 7.017 7.017 7.270 -0.253 18792 11700 1 15 . 1 1 91 91 VAL N N 91 119.489 119.489 120.503 -1.014 18792 11701 1 15 . 1 1 91 91 VAL C C 91 177.914 177.914 178.036 -0.122 18792 11702 1 15 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.074 -0.305 18792 11703 1 15 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.550 -0.259 18792 11704 1 15 . 1 1 91 91 VAL H H 91 7.833 7.833 7.351 0.482 18792 11705 1 15 . 1 1 92 92 ASN N N 92 117.180 117.180 118.384 -1.204 18792 11706 1 15 . 1 1 92 92 ASN C C 92 179.110 179.110 178.006 1.104 18792 11707 1 15 . 1 1 92 92 ASN CA C 92 54.918 54.918 55.831 -0.913 18792 11708 1 15 . 1 1 92 92 ASN CB C 92 35.968 35.968 37.974 -2.006 18792 11709 1 15 . 1 1 92 92 ASN H H 92 8.368 8.368 8.447 -0.079 18792 11710 1 15 . 1 1 93 93 GLU N N 93 118.476 118.476 119.030 -0.554 18792 11711 1 15 . 1 1 93 93 GLU C C 93 179.355 179.355 178.774 0.581 18792 11712 1 15 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.393 0.012 18792 11713 1 15 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.775 -2.042 18792 11714 1 15 . 1 1 93 93 GLU H H 93 7.213 7.213 7.904 -0.691 18792 11715 1 15 . 1 1 94 94 LEU N N 94 120.889 120.889 121.180 -0.291 18792 11716 1 15 . 1 1 94 94 LEU C C 94 178.473 178.473 177.211 1.262 18792 11717 1 15 . 1 1 94 94 LEU CA C 94 57.017 57.017 56.567 0.450 18792 11718 1 15 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.138 -2.208 18792 11719 1 15 . 1 1 94 94 LEU H H 94 7.446 7.446 7.543 -0.097 18792 11720 1 15 . 1 1 95 95 PHE N N 95 112.902 112.902 116.783 -3.881 18792 11721 1 15 . 1 1 95 95 PHE C C 95 176.586 176.586 176.483 0.103 18792 11722 1 15 . 1 1 95 95 PHE CA C 95 57.159 57.159 58.085 -0.926 18792 11723 1 15 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.004 -0.783 18792 11724 1 15 . 1 1 95 95 PHE H H 95 6.916 6.916 7.919 -1.003 18792 11725 1 15 . 1 1 96 96 ARG N N 96 123.729 123.729 119.829 3.900 18792 11726 1 15 . 1 1 96 96 ARG C C 96 177.272 177.272 176.497 0.775 18792 11727 1 15 . 1 1 96 96 ARG CA C 96 59.223 59.223 57.994 1.229 18792 11728 1 15 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.815 -2.383 18792 11729 1 15 . 1 1 96 96 ARG H H 96 7.126 7.126 7.626 -0.500 18792 11730 1 15 . 1 1 97 97 ASP N N 97 116.576 116.576 114.255 2.321 18792 11731 1 15 . 1 1 97 97 ASP C C 97 175.687 175.687 174.426 1.261 18792 11732 1 15 . 1 1 97 97 ASP CA C 97 53.673 53.673 53.835 -0.162 18792 11733 1 15 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.636 -2.591 18792 11734 1 15 . 1 1 97 97 ASP H H 97 8.644 8.644 7.720 0.924 18792 11735 1 15 . 1 1 98 98 GLY N N 98 108.551 108.551 107.174 1.377 18792 11736 1 15 . 1 1 98 98 GLY C C 98 172.690 172.690 172.534 0.156 18792 11737 1 15 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.420 -2.170 18792 11738 1 15 . 1 1 98 98 GLY H H 98 7.463 7.463 7.290 0.173 18792 11739 1 15 . 1 1 99 99 VAL N N 99 120.630 120.630 122.878 -2.248 18792 11740 1 15 . 1 1 99 99 VAL C C 99 174.503 174.503 174.668 -0.165 18792 11741 1 15 . 1 1 99 99 VAL CA C 99 62.318 62.318 62.379 -0.061 18792 11742 1 15 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.454 -1.691 18792 11743 1 15 . 1 1 99 99 VAL H H 99 8.184 8.184 8.497 -0.313 18792 11744 1 15 . 1 1 100 100 ASN N N 100 115.485 115.485 116.922 -1.437 18792 11745 1 15 . 1 1 100 100 ASN C C 100 175.239 175.239 176.393 -1.154 18792 11746 1 15 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.222 -2.861 18792 11747 1 15 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.319 0.600 18792 11748 1 15 . 1 1 100 100 ASN H H 100 6.241 6.241 7.816 -1.575 18792 11749 1 15 . 1 1 101 101 TRP N N 101 118.266 118.266 120.531 -2.265 18792 11750 1 15 . 1 1 101 101 TRP C C 101 178.301 178.301 177.084 1.217 18792 11751 1 15 . 1 1 101 101 TRP CA C 101 60.539 60.539 60.705 -0.166 18792 11752 1 15 . 1 1 101 101 TRP CB C 101 29.830 29.830 29.073 0.757 18792 11753 1 15 . 1 1 101 101 TRP H H 101 8.409 8.409 7.669 0.740 18792 11754 1 15 . 1 1 102 102 GLY N N 102 106.147 106.147 104.035 2.112 18792 11755 1 15 . 1 1 102 102 GLY C C 102 177.640 177.640 175.305 2.335 18792 11756 1 15 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.383 2.531 18792 11757 1 15 . 1 1 102 102 GLY H H 102 8.504 8.504 7.993 0.511 18792 11758 1 15 . 1 1 103 103 ARG N N 103 121.347 121.347 122.747 -1.400 18792 11759 1 15 . 1 1 103 103 ARG C C 103 177.738 177.738 178.107 -0.369 18792 11760 1 15 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.802 -0.860 18792 11761 1 15 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.848 0.371 18792 11762 1 15 . 1 1 103 103 ARG H H 103 8.099 8.099 8.415 -0.316 18792 11763 1 15 . 1 1 104 104 ILE N N 104 120.930 120.930 118.619 2.311 18792 11764 1 15 . 1 1 104 104 ILE C C 104 178.197 178.197 177.988 0.209 18792 11765 1 15 . 1 1 104 104 ILE CA C 104 66.535 66.535 62.965 3.570 18792 11766 1 15 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.231 -1.186 18792 11767 1 15 . 1 1 104 104 ILE H H 104 7.690 7.690 7.958 -0.268 18792 11768 1 15 . 1 1 105 105 VAL N N 105 120.938 120.938 120.781 0.157 18792 11769 1 15 . 1 1 105 105 VAL C C 105 177.854 177.854 177.640 0.214 18792 11770 1 15 . 1 1 105 105 VAL CA C 105 67.458 67.458 65.831 1.627 18792 11771 1 15 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.089 0.285 18792 11772 1 15 . 1 1 105 105 VAL H H 105 8.245 8.245 7.570 0.675 18792 11773 1 15 . 1 1 106 106 ALA N N 106 121.165 121.165 121.595 -0.430 18792 11774 1 15 . 1 1 106 106 ALA C C 106 178.284 178.284 179.053 -0.769 18792 11775 1 15 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.065 0.533 18792 11776 1 15 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.073 -0.558 18792 11777 1 15 . 1 1 106 106 ALA H H 106 7.529 7.529 8.188 -0.659 18792 11778 1 15 . 1 1 107 107 PHE N N 107 119.242 119.242 122.109 -2.867 18792 11779 1 15 . 1 1 107 107 PHE C C 107 176.390 176.390 176.388 0.002 18792 11780 1 15 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.383 -0.210 18792 11781 1 15 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.953 -1.866 18792 11782 1 15 . 1 1 107 107 PHE H H 107 7.974 7.974 7.647 0.327 18792 11783 1 15 . 1 1 108 108 PHE N N 108 120.009 120.009 117.374 2.635 18792 11784 1 15 . 1 1 108 108 PHE C C 108 177.640 177.640 176.700 0.940 18792 11785 1 15 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.928 1.496 18792 11786 1 15 . 1 1 108 108 PHE CB C 108 35.346 35.346 37.606 -2.260 18792 11787 1 15 . 1 1 108 108 PHE H H 108 7.946 7.946 8.178 -0.232 18792 11788 1 15 . 1 1 109 109 SER N N 109 114.631 114.631 116.725 -2.094 18792 11789 1 15 . 1 1 109 109 SER C C 109 177.770 177.770 176.103 1.667 18792 11790 1 15 . 1 1 109 109 SER CA C 109 63.349 63.349 61.586 1.763 18792 11791 1 15 . 1 1 109 109 SER H H 109 8.424 8.424 6.989 1.435 18792 11792 1 15 . 1 1 110 110 PHE N N 110 124.230 124.230 123.661 0.569 18792 11793 1 15 . 1 1 110 110 PHE C C 110 176.708 176.708 177.154 -0.446 18792 11794 1 15 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.517 0.097 18792 11795 1 15 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.949 -1.505 18792 11796 1 15 . 1 1 110 110 PHE H H 110 9.052 9.052 8.132 0.920 18792 11797 1 15 . 1 1 111 111 GLY N N 111 105.893 105.893 106.311 -0.418 18792 11798 1 15 . 1 1 111 111 GLY C C 111 176.795 176.795 175.988 0.807 18792 11799 1 15 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.423 0.953 18792 11800 1 15 . 1 1 111 111 GLY H H 111 7.926 7.926 8.277 -0.351 18792 11801 1 15 . 1 1 112 112 GLY N N 112 107.410 107.410 109.209 -1.799 18792 11802 1 15 . 1 1 112 112 GLY C C 112 174.650 174.650 175.356 -0.706 18792 11803 1 15 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.152 1.153 18792 11804 1 15 . 1 1 112 112 GLY H H 112 8.799 8.799 8.067 0.732 18792 11805 1 15 . 1 1 113 113 ALA N N 113 124.313 124.313 125.081 -0.768 18792 11806 1 15 . 1 1 113 113 ALA C C 113 181.300 181.300 178.877 2.423 18792 11807 1 15 . 1 1 113 113 ALA CA C 113 54.527 54.527 55.021 -0.494 18792 11808 1 15 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.761 -1.278 18792 11809 1 15 . 1 1 113 113 ALA H H 113 8.212 8.212 7.945 0.267 18792 11810 1 15 . 1 1 114 114 LEU N N 114 118.878 118.878 118.623 0.255 18792 11811 1 15 . 1 1 114 114 LEU C C 114 180.286 180.286 178.256 2.030 18792 11812 1 15 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.552 -0.570 18792 11813 1 15 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.251 -0.234 18792 11814 1 15 . 1 1 114 114 LEU H H 114 8.161 8.161 7.760 0.401 18792 11815 1 15 . 1 1 115 115 CYS N N 115 119.002 119.002 118.821 0.181 18792 11816 1 15 . 1 1 115 115 CYS C C 115 176.087 176.087 176.381 -0.294 18792 11817 1 15 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.671 0.273 18792 11818 1 15 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.144 -1.509 18792 11819 1 15 . 1 1 115 115 CYS H H 115 8.070 8.070 7.818 0.252 18792 11820 1 15 . 1 1 116 116 VAL N N 116 118.737 118.737 119.352 -0.615 18792 11821 1 15 . 1 1 116 116 VAL C C 116 177.494 177.494 178.491 -0.997 18792 11822 1 15 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.349 0.413 18792 11823 1 15 . 1 1 116 116 VAL CB C 116 30.763 30.763 30.949 -0.186 18792 11824 1 15 . 1 1 116 116 VAL H H 116 7.995 7.995 7.624 0.371 18792 11825 1 15 . 1 1 117 117 GLU N N 117 118.886 118.886 120.332 -1.446 18792 11826 1 15 . 1 1 117 117 GLU C C 117 178.424 178.424 179.320 -0.896 18792 11827 1 15 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.480 -0.720 18792 11828 1 15 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.165 -1.111 18792 11829 1 15 . 1 1 117 117 GLU H H 117 8.059 8.059 7.936 0.123 18792 11830 1 15 . 1 1 118 118 SER N N 118 113.417 113.417 116.109 -2.692 18792 11831 1 15 . 1 1 118 118 SER C C 118 175.607 175.607 176.678 -1.071 18792 11832 1 15 . 1 1 118 118 SER CA C 118 62.638 62.638 62.095 0.543 18792 11833 1 15 . 1 1 118 118 SER CB C 118 61.061 61.061 62.969 -1.908 18792 11834 1 15 . 1 1 118 118 SER H H 118 7.626 7.626 8.030 -0.404 18792 11835 1 15 . 1 1 119 119 VAL N N 119 120.612 120.612 122.259 -1.647 18792 11836 1 15 . 1 1 119 119 VAL C C 119 179.713 179.713 178.318 1.395 18792 11837 1 15 . 1 1 119 119 VAL CA C 119 66.225 66.225 66.288 -0.063 18792 11838 1 15 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.058 -0.979 18792 11839 1 15 . 1 1 119 119 VAL H H 119 7.297 7.297 8.013 -0.716 18792 11840 1 15 . 1 1 120 120 ASP N N 120 122.546 122.546 120.160 2.386 18792 11841 1 15 . 1 1 120 120 ASP C C 120 178.057 178.057 177.701 0.356 18792 11842 1 15 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.501 0.488 18792 11843 1 15 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.998 -1.075 18792 11844 1 15 . 1 1 120 120 ASP H H 120 8.264 8.264 7.901 0.363 18792 11845 1 15 . 1 1 121 121 LYS N N 121 115.636 115.636 117.771 -2.135 18792 11846 1 15 . 1 1 121 121 LYS C C 121 175.159 175.159 175.805 -0.646 18792 11847 1 15 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.171 -0.911 18792 11848 1 15 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.663 -1.888 18792 11849 1 15 . 1 1 121 121 LYS H H 121 7.558 7.558 7.371 0.187 18792 11850 1 15 . 1 1 122 122 GLU N N 122 113.915 113.915 116.025 -2.110 18792 11851 1 15 . 1 1 122 122 GLU C C 122 176.109 176.109 176.071 0.038 18792 11852 1 15 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.864 -0.557 18792 11853 1 15 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.573 -3.241 18792 11854 1 15 . 1 1 122 122 GLU H H 122 7.826 7.826 7.748 0.078 18792 11855 1 15 . 1 1 124 124 GLN N N 124 119.233 119.233 121.198 -1.965 18792 11856 1 15 . 1 1 124 124 GLN C C 124 177.640 177.640 177.184 0.456 18792 11857 1 15 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.975 0.497 18792 11858 1 15 . 1 1 124 124 GLN CB C 124 26.490 26.490 27.147 -0.657 18792 11859 1 15 . 1 1 124 124 GLN H H 124 8.626 8.626 8.397 0.229 18792 11860 1 15 . 1 1 125 125 VAL N N 125 117.011 117.011 119.517 -2.506 18792 11861 1 15 . 1 1 125 125 VAL C C 125 175.826 175.826 177.585 -1.759 18792 11862 1 15 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.787 -1.651 18792 11863 1 15 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.156 -0.859 18792 11864 1 15 . 1 1 125 125 VAL H H 125 7.870 7.870 8.005 -0.135 18792 11865 1 15 . 1 1 126 126 LEU N N 126 117.058 117.058 118.596 -1.538 18792 11866 1 15 . 1 1 126 126 LEU C C 126 178.096 178.096 177.970 0.126 18792 11867 1 15 . 1 1 126 126 LEU CA C 126 55.085 55.085 58.215 -3.130 18792 11868 1 15 . 1 1 126 126 LEU CB C 126 40.273 40.273 40.904 -0.631 18792 11869 1 15 . 1 1 126 126 LEU H H 126 7.747 7.747 8.398 -0.651 18792 11870 1 15 . 1 1 127 127 VAL N N 127 119.457 119.457 120.747 -1.290 18792 11871 1 15 . 1 1 127 127 VAL C C 127 177.150 177.150 178.175 -1.025 18792 11872 1 15 . 1 1 127 127 VAL CA C 127 67.156 67.156 65.661 1.495 18792 11873 1 15 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.476 -0.723 18792 11874 1 15 . 1 1 127 127 VAL H H 127 7.306 7.306 7.812 -0.506 18792 11875 1 15 . 1 1 128 128 SER N N 128 110.647 110.647 115.344 -4.697 18792 11876 1 15 . 1 1 128 128 SER C C 128 177.222 177.222 176.700 0.522 18792 11877 1 15 . 1 1 128 128 SER CA C 128 60.752 60.752 61.883 -1.131 18792 11878 1 15 . 1 1 128 128 SER CB C 128 61.605 61.605 62.556 -0.951 18792 11879 1 15 . 1 1 128 128 SER H H 128 8.237 8.237 8.006 0.231 18792 11880 1 15 . 1 1 129 129 ARG N N 129 123.100 123.100 122.569 0.531 18792 11881 1 15 . 1 1 129 129 ARG C C 129 175.802 175.802 178.510 -2.708 18792 11882 1 15 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.772 -0.545 18792 11883 1 15 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.041 -1.841 18792 11884 1 15 . 1 1 129 129 ARG H H 129 6.564 6.564 7.815 -1.251 18792 11885 1 15 . 1 1 130 130 ILE N N 130 118.182 118.182 117.882 0.300 18792 11886 1 15 . 1 1 130 130 ILE C C 130 178.156 178.156 177.657 0.499 18792 11887 1 15 . 1 1 130 130 ILE CA C 130 64.346 64.346 64.975 -0.629 18792 11888 1 15 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.545 -0.863 18792 11889 1 15 . 1 1 130 130 ILE H H 130 7.955 7.955 8.310 -0.355 18792 11890 1 15 . 1 1 131 131 ALA N N 131 119.029 119.029 122.317 -3.288 18792 11891 1 15 . 1 1 131 131 ALA C C 131 179.593 179.593 179.138 0.455 18792 11892 1 15 . 1 1 131 131 ALA CA C 131 54.598 54.598 54.901 -0.303 18792 11893 1 15 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.347 -0.959 18792 11894 1 15 . 1 1 131 131 ALA H H 131 7.582 7.582 8.668 -1.086 18792 11895 1 15 . 1 1 132 132 ALA N N 132 120.336 120.336 122.201 -1.865 18792 11896 1 15 . 1 1 132 132 ALA C C 132 181.095 181.095 179.470 1.625 18792 11897 1 15 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.749 -0.151 18792 11898 1 15 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.474 -1.773 18792 11899 1 15 . 1 1 132 132 ALA H H 132 7.224 7.224 7.768 -0.544 18792 11900 1 15 . 1 1 133 133 TRP N N 133 121.194 121.194 120.617 0.577 18792 11901 1 15 . 1 1 133 133 TRP C C 133 179.698 179.698 178.339 1.359 18792 11902 1 15 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.686 -3.384 18792 11903 1 15 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.889 -2.234 18792 11904 1 15 . 1 1 133 133 TRP H H 133 8.925 8.925 8.491 0.434 18792 11905 1 15 . 1 1 134 134 MET N N 134 116.987 116.987 117.123 -0.136 18792 11906 1 15 . 1 1 134 134 MET C C 134 178.277 178.277 178.166 0.111 18792 11907 1 15 . 1 1 134 134 MET CA C 134 59.578 59.578 59.121 0.457 18792 11908 1 15 . 1 1 134 134 MET CB C 134 33.559 33.559 32.443 1.116 18792 11909 1 15 . 1 1 134 134 MET H H 134 8.863 8.863 8.337 0.526 18792 11910 1 15 . 1 1 135 135 ALA N N 135 120.523 120.523 121.621 -1.098 18792 11911 1 15 . 1 1 135 135 ALA C C 135 179.298 179.298 179.361 -0.063 18792 11912 1 15 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.254 0.179 18792 11913 1 15 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.104 -1.467 18792 11914 1 15 . 1 1 135 135 ALA H H 135 8.152 8.152 8.362 -0.210 18792 11915 1 15 . 1 1 136 136 THR N N 136 116.715 116.715 117.710 -0.995 18792 11916 1 15 . 1 1 136 136 THR C C 136 175.106 175.106 176.489 -1.383 18792 11917 1 15 . 1 1 136 136 THR CA C 136 66.729 66.729 67.098 -0.369 18792 11918 1 15 . 1 1 136 136 THR CB C 136 68.441 68.441 68.987 -0.546 18792 11919 1 15 . 1 1 136 136 THR H H 136 8.532 8.532 8.103 0.429 18792 11920 1 15 . 1 1 137 137 TYR N N 137 123.204 123.204 121.585 1.619 18792 11921 1 15 . 1 1 137 137 TYR C C 137 179.592 179.592 177.615 1.977 18792 11922 1 15 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.621 1.444 18792 11923 1 15 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.387 -0.399 18792 11924 1 15 . 1 1 137 137 TYR H H 137 8.809 8.809 7.595 1.214 18792 11925 1 15 . 1 1 138 138 LEU N N 138 119.247 119.247 120.979 -1.732 18792 11926 1 15 . 1 1 138 138 LEU C C 138 178.385 178.385 178.057 0.328 18792 11927 1 15 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.203 0.735 18792 11928 1 15 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.052 -0.344 18792 11929 1 15 . 1 1 138 138 LEU H H 138 8.742 8.742 8.376 0.366 18792 11930 1 15 . 1 1 139 139 ASN N N 139 117.122 117.122 115.968 1.154 18792 11931 1 15 . 1 1 139 139 ASN C C 139 176.417 176.417 176.809 -0.392 18792 11932 1 15 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.450 0.998 18792 11933 1 15 . 1 1 139 139 ASN CB C 139 38.652 38.652 37.879 0.773 18792 11934 1 15 . 1 1 139 139 ASN H H 139 8.307 8.307 8.121 0.185 18792 11935 1 15 . 1 1 140 140 ASP N N 140 115.394 115.394 119.943 -4.549 18792 11936 1 15 . 1 1 140 140 ASP C C 140 177.919 177.919 176.841 1.078 18792 11937 1 15 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.888 -0.935 18792 11938 1 15 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.834 -1.448 18792 11939 1 15 . 1 1 140 140 ASP H H 140 8.439 8.439 7.711 0.728 18792 11940 1 15 . 1 1 141 141 HIS N N 141 111.695 111.695 113.741 -2.046 18792 11941 1 15 . 1 1 141 141 HIS C C 141 175.949 175.949 175.777 0.172 18792 11942 1 15 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.739 -0.682 18792 11943 1 15 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.379 -2.471 18792 11944 1 15 . 1 1 141 141 HIS H H 141 8.043 8.043 7.484 0.559 18792 11945 1 15 . 1 1 142 142 LEU N N 142 117.054 117.054 121.928 -4.874 18792 11946 1 15 . 1 1 142 142 LEU C C 142 176.530 176.530 177.523 -0.993 18792 11947 1 15 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.431 -2.122 18792 11948 1 15 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.942 0.396 18792 11949 1 15 . 1 1 142 142 LEU H H 142 7.198 7.198 8.174 -0.976 18792 11950 1 15 . 1 1 143 143 GLU N N 143 121.335 121.335 120.040 1.295 18792 11951 1 15 . 1 1 143 143 GLU C C 143 173.964 173.964 175.596 -1.632 18792 11952 1 15 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.282 -0.028 18792 11953 1 15 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.241 -1.984 18792 11954 1 15 . 1 1 143 143 GLU H H 143 8.565 8.565 7.727 0.838 18792 11955 1 15 . 1 1 145 145 TRP N N 145 117.973 117.973 120.358 -2.385 18792 11956 1 15 . 1 1 145 145 TRP C C 145 179.526 179.526 177.481 2.045 18792 11957 1 15 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.513 1.093 18792 11958 1 15 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.445 -1.557 18792 11959 1 15 . 1 1 145 145 TRP H H 145 7.078 7.078 8.472 -1.394 18792 11960 1 15 . 1 1 146 146 ILE N N 146 122.101 122.101 111.489 10.612 18792 11961 1 15 . 1 1 146 146 ILE C C 146 179.110 179.110 177.326 1.784 18792 11962 1 15 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.137 4.197 18792 11963 1 15 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.729 -0.907 18792 11964 1 15 . 1 1 146 146 ILE H H 146 8.389 8.389 7.568 0.821 18792 11965 1 15 . 1 1 147 147 GLN N N 147 116.344 116.344 121.541 -5.197 18792 11966 1 15 . 1 1 147 147 GLN C C 147 179.526 179.526 177.674 1.852 18792 11967 1 15 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.780 -0.767 18792 11968 1 15 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.309 -1.586 18792 11969 1 15 . 1 1 147 147 GLN H H 147 8.376 8.376 8.069 0.307 18792 11970 1 15 . 1 1 148 148 GLU N N 148 118.913 118.913 120.397 -1.484 18792 11971 1 15 . 1 1 148 148 GLU C C 148 176.880 176.880 178.224 -1.344 18792 11972 1 15 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.111 -2.737 18792 11973 1 15 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.246 -0.814 18792 11974 1 15 . 1 1 148 148 GLU H H 148 7.504 7.504 7.985 -0.481 18792 11975 1 15 . 1 1 149 149 ASN N N 149 116.616 116.616 113.690 2.926 18792 11976 1 15 . 1 1 149 149 ASN C C 149 173.964 173.964 176.619 -2.655 18792 11977 1 15 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.647 -0.401 18792 11978 1 15 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.792 -2.659 18792 11979 1 15 . 1 1 149 149 ASN H H 149 7.070 7.070 8.066 -0.996 18792 11980 1 15 . 1 1 150 150 GLY N N 150 104.750 104.750 106.328 -1.578 18792 11981 1 15 . 1 1 150 150 GLY C C 150 176.022 176.022 174.144 1.878 18792 11982 1 15 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.378 -0.136 18792 11983 1 15 . 1 1 150 150 GLY H H 150 7.313 7.313 7.896 -0.583 18792 11984 1 15 . 1 1 151 151 GLY N N 151 108.385 108.385 107.103 1.282 18792 11985 1 15 . 1 1 151 151 GLY C C 151 173.449 173.449 175.561 -2.112 18792 11986 1 15 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.205 -1.173 18792 11987 1 15 . 1 1 151 151 GLY H H 151 8.452 8.452 7.321 1.131 18792 11988 1 15 . 1 1 152 152 TRP N N 152 118.092 118.092 122.538 -4.446 18792 11989 1 15 . 1 1 152 152 TRP C C 152 178.571 178.571 178.087 0.484 18792 11990 1 15 . 1 1 152 152 TRP CA C 152 60.077 60.077 60.293 -0.216 18792 11991 1 15 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.443 -0.855 18792 11992 1 15 . 1 1 152 152 TRP H H 152 8.644 8.644 9.146 -0.502 18792 11993 1 15 . 1 1 153 153 ASP N N 153 117.758 117.758 118.012 -0.254 18792 11994 1 15 . 1 1 153 153 ASP C C 153 179.796 179.796 178.539 1.257 18792 11995 1 15 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.465 -0.163 18792 11996 1 15 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.144 -1.913 18792 11997 1 15 . 1 1 153 153 ASP H H 153 8.827 8.827 8.322 0.505 18792 11998 1 15 . 1 1 154 154 THR N N 154 116.817 116.817 117.752 -0.935 18792 11999 1 15 . 1 1 154 154 THR C C 154 175.352 175.352 176.764 -1.412 18792 12000 1 15 . 1 1 154 154 THR CA C 154 65.910 65.910 66.751 -0.841 18792 12001 1 15 . 1 1 154 154 THR CB C 154 67.712 67.712 68.720 -1.008 18792 12002 1 15 . 1 1 154 154 THR H H 154 7.494 7.494 7.539 -0.045 18792 12003 1 15 . 1 1 155 155 PHE N N 155 122.196 122.196 121.280 0.916 18792 12004 1 15 . 1 1 155 155 PHE C C 155 176.831 176.831 177.705 -0.874 18792 12005 1 15 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.967 0.320 18792 12006 1 15 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.398 -1.731 18792 12007 1 15 . 1 1 155 155 PHE H H 155 6.477 6.477 8.672 -2.195 18792 12008 1 15 . 1 1 156 156 VAL N N 156 117.387 117.387 117.812 -0.425 18792 12009 1 15 . 1 1 156 156 VAL C C 156 178.497 178.497 177.697 0.800 18792 12010 1 15 . 1 1 156 156 VAL CA C 156 66.231 66.231 65.605 0.626 18792 12011 1 15 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.175 -0.490 18792 12012 1 15 . 1 1 156 156 VAL H H 156 7.788 7.788 8.098 -0.310 18792 12013 1 15 . 1 1 157 157 GLU N N 157 119.876 119.876 119.530 0.346 18792 12014 1 15 . 1 1 157 157 GLU C C 157 178.399 178.399 177.768 0.631 18792 12015 1 15 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.638 0.122 18792 12016 1 15 . 1 1 157 157 GLU CB C 157 28.277 28.277 30.160 -1.883 18792 12017 1 15 . 1 1 157 157 GLU H H 157 7.409 7.409 7.996 -0.587 18792 12018 1 15 . 1 1 158 158 LEU N N 158 117.194 117.194 118.377 -1.183 18792 12019 1 15 . 1 1 158 158 LEU C C 158 178.595 178.595 176.805 1.790 18792 12020 1 15 . 1 1 158 158 LEU CA C 158 56.377 56.377 54.811 1.566 18792 12021 1 15 . 1 1 158 158 LEU CB C 158 42.571 42.571 41.898 0.673 18792 12022 1 15 . 1 1 158 158 LEU H H 158 7.584 7.584 7.948 -0.364 18792 12023 1 15 . 1 1 159 159 TYR N N 159 115.549 115.549 115.943 -0.394 18792 12024 1 15 . 1 1 159 159 TYR C C 159 177.032 177.032 176.238 0.794 18792 12025 1 15 . 1 1 159 159 TYR CA C 159 59.116 59.116 58.823 0.293 18792 12026 1 15 . 1 1 159 159 TYR CB C 159 37.599 37.599 34.880 2.719 18792 12027 1 15 . 1 1 159 159 TYR H H 159 8.099 8.099 7.529 0.570 18792 12028 1 15 . 1 1 160 160 GLY N N 160 108.334 108.334 104.243 4.091 18792 12029 1 15 . 1 1 160 160 GLY C C 160 173.973 173.973 173.741 0.232 18792 12030 1 15 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.757 0.307 18792 12031 1 15 . 1 1 160 160 GLY H H 160 8.020 8.020 8.561 -0.541 18792 12032 1 15 . 1 1 161 161 ASN N N 161 118.189 118.189 116.872 1.317 18792 12033 1 15 . 1 1 161 161 ASN C C 161 175.513 175.513 173.548 1.965 18792 12034 1 15 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.467 -1.363 18792 12035 1 15 . 1 1 161 161 ASN CB C 161 38.203 38.203 38.733 -0.530 18792 12036 1 15 . 1 1 161 161 ASN H H 161 8.327 8.327 8.149 0.178 18792 12037 1 15 . 1 1 162 162 ASN N N 162 119.022 119.022 117.068 1.954 18792 12038 1 15 . 1 1 162 162 ASN C C 162 175.690 175.690 174.511 1.179 18792 12039 1 15 . 1 1 162 162 ASN CA C 162 53.424 53.424 54.543 -1.119 18792 12040 1 15 . 1 1 162 162 ASN CB C 162 38.203 38.203 39.518 -1.315 18792 12041 1 15 . 1 1 162 162 ASN H H 162 8.363 8.363 8.822 -0.459 18792 12042 1 15 . 1 1 163 163 ALA N N 163 123.275 123.275 121.506 1.769 18792 12043 1 15 . 1 1 163 163 ALA C C 163 178.598 178.598 177.616 0.982 18792 12044 1 15 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.671 0.567 18792 12045 1 15 . 1 1 163 163 ALA CB C 163 17.611 17.611 20.002 -2.390 18792 12046 1 15 . 1 1 163 163 ALA H H 163 8.103 8.103 8.100 0.003 18792 12047 1 15 . 1 1 164 164 ALA N N 164 121.521 121.521 121.191 0.330 18792 12048 1 15 . 1 1 164 164 ALA C C 164 178.642 178.642 179.836 -1.194 18792 12049 1 15 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.536 -1.952 18792 12050 1 15 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.650 -0.831 18792 12051 1 15 . 1 1 164 164 ALA H H 164 8.053 8.053 8.080 -0.027 18792 12052 1 15 . 1 1 165 165 ALA N N 165 122.101 122.101 120.032 2.069 18792 12053 1 15 . 1 1 165 165 ALA C C 165 179.124 179.124 178.543 0.581 18792 12054 1 15 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.736 -1.597 18792 12055 1 15 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.876 -0.898 18792 12056 1 15 . 1 1 165 165 ALA H H 165 7.949 7.949 7.886 0.063 18792 12057 1 15 . 1 1 166 166 GLU N N 166 118.381 118.381 115.584 2.797 18792 12058 1 15 . 1 1 166 166 GLU C C 166 177.664 177.664 176.554 1.110 18792 12059 1 15 . 1 1 166 166 GLU CA C 166 57.088 57.088 55.802 1.286 18792 12060 1 15 . 1 1 166 166 GLU CB C 166 28.354 28.354 28.477 -0.123 18792 12061 1 15 . 1 1 166 166 GLU H H 166 8.202 8.202 8.670 -0.468 18792 12062 1 15 . 1 1 167 167 SER N N 167 115.193 115.193 116.618 -1.425 18792 12063 1 15 . 1 1 167 167 SER C C 167 175.312 175.312 174.984 0.328 18792 12064 1 15 . 1 1 167 167 SER CA C 167 58.831 58.831 61.635 -2.804 18792 12065 1 15 . 1 1 167 167 SER CB C 167 62.537 62.537 63.790 -1.253 18792 12066 1 15 . 1 1 167 167 SER H H 167 8.029 8.029 7.494 0.535 18792 12067 1 15 . 1 1 168 168 ARG N N 168 121.696 121.696 119.259 2.437 18792 12068 1 15 . 1 1 168 168 ARG C C 168 176.880 176.880 174.569 2.311 18792 12069 1 15 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.246 -0.083 18792 12070 1 15 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.867 -0.658 18792 12071 1 15 . 1 1 168 168 ARG H H 168 7.967 7.967 8.345 -0.378 18792 12072 1 15 . 1 1 169 169 LYS N N 169 120.917 120.917 122.257 -1.340 18792 12073 1 15 . 1 1 169 169 LYS C C 169 177.640 177.640 175.087 2.553 18792 12074 1 15 . 1 1 169 169 LYS CA C 169 56.697 56.697 55.593 1.104 18792 12075 1 15 . 1 1 169 169 LYS CB C 169 31.462 31.462 35.337 -3.875 18792 12076 1 15 . 1 1 169 169 LYS H H 169 8.011 8.011 7.913 0.098 18792 12077 1 15 . 1 1 170 170 GLY N N 170 109.155 109.155 107.999 1.156 18792 12078 1 15 . 1 1 170 170 GLY C C 170 174.479 174.479 173.672 0.807 18792 12079 1 15 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.509 -0.445 18792 12080 1 15 . 1 1 170 170 GLY H H 170 8.329 8.329 8.669 -0.340 18792 12081 1 15 . 1 1 171 171 GLN N N 171 119.292 119.292 124.024 -4.732 18792 12082 1 15 . 1 1 171 171 GLN C C 171 176.463 176.463 174.961 1.502 18792 12083 1 15 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.562 0.103 18792 12084 1 15 . 1 1 171 171 GLN CB C 171 28.199 28.199 30.893 -2.694 18792 12085 1 15 . 1 1 171 171 GLN H H 171 8.035 8.035 8.495 -0.460 18792 12086 1 15 . 1 1 172 172 GLU N N 172 121.703 121.703 120.517 1.186 18792 12087 1 15 . 1 1 172 172 GLU C C 172 176.414 176.414 175.345 1.069 18792 12088 1 15 . 1 1 172 172 GLU CA C 172 56.341 56.341 57.038 -0.697 18792 12089 1 15 . 1 1 172 172 GLU CB C 172 28.821 28.821 29.201 -0.380 18792 12090 1 15 . 1 1 172 172 GLU H H 172 8.405 8.405 8.459 -0.054 18792 12091 1 15 . 1 1 173 173 ARG N N 173 121.852 121.852 124.244 -2.392 18792 12092 1 15 . 1 1 173 173 ARG C C 173 176.365 176.365 175.161 1.204 18792 12093 1 15 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.405 0.794 18792 12094 1 15 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.070 -1.939 18792 12095 1 15 . 1 1 173 173 ARG H H 173 8.335 8.335 8.444 -0.109 18792 12096 1 15 . 1 1 174 174 LEU N N 174 122.640 122.640 123.597 -0.957 18792 12097 1 15 . 1 1 174 174 LEU C C 174 176.523 176.523 176.191 0.332 18792 12098 1 15 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.490 0.278 18792 12099 1 15 . 1 1 174 174 LEU CB C 174 40.784 40.784 43.808 -3.024 18792 12100 1 15 . 1 1 174 174 LEU H H 174 8.082 8.082 8.483 -0.401 18792 12101 1 15 . 1 1 175 175 GLU N N 175 125.909 125.909 121.390 4.519 18792 12102 1 15 . 1 1 175 175 GLU C C 175 181.029 181.029 175.259 5.770 18792 12103 1 15 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.502 1.896 18792 12104 1 15 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.275 -1.225 18792 12105 1 15 . 1 1 175 175 GLU H H 175 7.785 7.785 8.321 -0.536 18792 12106 1 16 . 1 1 4 4 ALA N N 4 124.786 124.786 125.252 -0.466 18792 12107 1 16 . 1 1 4 4 ALA C C 4 178.272 178.272 178.388 -0.116 18792 12108 1 16 . 1 1 4 4 ALA CA C 4 52.566 52.566 52.848 -0.282 18792 12109 1 16 . 1 1 4 4 ALA CB C 4 18.234 18.234 19.379 -1.145 18792 12110 1 16 . 1 1 4 4 ALA H H 4 8.414 8.414 8.237 0.177 18792 12111 1 16 . 1 1 5 5 MET N N 5 119.681 119.681 119.063 0.618 18792 12112 1 16 . 1 1 5 5 MET C C 5 176.929 176.929 176.372 0.557 18792 12113 1 16 . 1 1 5 5 MET CA C 5 55.594 55.594 54.417 1.177 18792 12114 1 16 . 1 1 5 5 MET CB C 5 31.540 31.540 32.737 -1.197 18792 12115 1 16 . 1 1 5 5 MET H H 5 8.336 8.336 8.308 0.028 18792 12116 1 16 . 1 1 6 6 SER N N 6 116.162 116.162 115.883 0.279 18792 12117 1 16 . 1 1 6 6 SER C C 6 175.924 175.924 176.397 -0.473 18792 12118 1 16 . 1 1 6 6 SER CA C 6 59.009 59.009 60.673 -1.664 18792 12119 1 16 . 1 1 6 6 SER CB C 6 62.537 62.537 63.237 -0.700 18792 12120 1 16 . 1 1 6 6 SER H H 6 8.272 8.272 8.186 0.086 18792 12121 1 16 . 1 1 7 7 GLN N N 7 122.263 122.263 120.193 2.070 18792 12122 1 16 . 1 1 7 7 GLN C C 7 177.027 177.027 177.997 -0.970 18792 12123 1 16 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.177 -1.907 18792 12124 1 16 . 1 1 7 7 GLN CB C 7 27.739 27.739 27.722 0.017 18792 12125 1 16 . 1 1 7 7 GLN H H 7 8.314 8.314 8.573 -0.259 18792 12126 1 16 . 1 1 8 8 SER N N 8 116.625 116.625 115.673 0.952 18792 12127 1 16 . 1 1 8 8 SER C C 8 176.457 176.457 175.849 0.608 18792 12128 1 16 . 1 1 8 8 SER CA C 8 59.650 59.650 61.292 -1.642 18792 12129 1 16 . 1 1 8 8 SER CB C 8 62.226 62.226 62.777 -0.551 18792 12130 1 16 . 1 1 8 8 SER H H 8 8.333 8.333 7.752 0.581 18792 12131 1 16 . 1 1 9 9 ASN N N 9 121.307 121.307 119.379 1.928 18792 12132 1 16 . 1 1 9 9 ASN C C 9 177.419 177.419 177.338 0.081 18792 12133 1 16 . 1 1 9 9 ASN CA C 9 55.487 55.487 55.920 -0.433 18792 12134 1 16 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.128 -0.995 18792 12135 1 16 . 1 1 9 9 ASN H H 9 8.611 8.611 8.363 0.248 18792 12136 1 16 . 1 1 10 10 ARG N N 10 119.830 119.830 121.195 -1.365 18792 12137 1 16 . 1 1 10 10 ARG C C 10 177.615 177.615 178.295 -0.680 18792 12138 1 16 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.600 -0.342 18792 12139 1 16 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.129 -1.930 18792 12140 1 16 . 1 1 10 10 ARG H H 10 7.996 7.996 7.854 0.142 18792 12141 1 16 . 1 1 11 11 GLU N N 11 117.270 117.270 119.884 -2.614 18792 12142 1 16 . 1 1 11 11 GLU C C 11 179.649 179.649 178.210 1.439 18792 12143 1 16 . 1 1 11 11 GLU CA C 11 59.009 59.009 58.973 0.036 18792 12144 1 16 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.738 -1.617 18792 12145 1 16 . 1 1 11 11 GLU H H 11 7.885 7.885 7.838 0.047 18792 12146 1 16 . 1 1 12 12 LEU N N 12 119.900 119.900 121.506 -1.606 18792 12147 1 16 . 1 1 12 12 LEU C C 12 178.473 178.473 178.048 0.425 18792 12148 1 16 . 1 1 12 12 LEU CA C 12 57.693 57.693 57.608 0.085 18792 12149 1 16 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.736 -1.107 18792 12150 1 16 . 1 1 12 12 LEU H H 12 7.691 7.691 7.946 -0.255 18792 12151 1 16 . 1 1 13 13 VAL N N 13 117.320 117.320 118.546 -1.226 18792 12152 1 16 . 1 1 13 13 VAL C C 13 177.272 177.272 177.840 -0.568 18792 12153 1 16 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.503 0.653 18792 12154 1 16 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.959 -0.730 18792 12155 1 16 . 1 1 13 13 VAL H H 13 7.629 7.629 7.696 -0.067 18792 12156 1 16 . 1 1 14 14 VAL N N 14 116.659 116.659 116.261 0.398 18792 12157 1 16 . 1 1 14 14 VAL C C 14 178.718 178.718 177.810 0.908 18792 12158 1 16 . 1 1 14 14 VAL CA C 14 66.516 66.516 65.446 1.070 18792 12159 1 16 . 1 1 14 14 VAL CB C 14 30.374 30.374 30.639 -0.265 18792 12160 1 16 . 1 1 14 14 VAL H H 14 8.210 8.210 7.393 0.817 18792 12161 1 16 . 1 1 15 15 ASP N N 15 120.374 120.374 122.309 -1.935 18792 12162 1 16 . 1 1 15 15 ASP C C 15 177.557 177.557 177.809 -0.252 18792 12163 1 16 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.456 1.020 18792 12164 1 16 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.450 2.103 18792 12165 1 16 . 1 1 15 15 ASP H H 15 7.967 7.967 8.289 -0.322 18792 12166 1 16 . 1 1 16 16 PHE N N 16 119.864 119.864 118.164 1.700 18792 12167 1 16 . 1 1 16 16 PHE C C 16 178.252 178.252 178.467 -0.215 18792 12168 1 16 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.022 2.758 18792 12169 1 16 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.588 0.472 18792 12170 1 16 . 1 1 16 16 PHE H H 16 8.228 8.228 7.920 0.308 18792 12171 1 16 . 1 1 17 17 LEU N N 17 116.312 116.312 120.953 -4.641 18792 12172 1 16 . 1 1 17 17 LEU C C 17 179.649 179.649 178.760 0.889 18792 12173 1 16 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.016 -0.252 18792 12174 1 16 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.815 -1.730 18792 12175 1 16 . 1 1 17 17 LEU H H 17 8.766 8.766 8.292 0.474 18792 12176 1 16 . 1 1 18 18 SER N N 18 113.715 113.715 114.717 -1.002 18792 12177 1 16 . 1 1 18 18 SER C C 18 177.362 177.362 176.840 0.522 18792 12178 1 16 . 1 1 18 18 SER CA C 18 61.948 61.948 61.421 0.527 18792 12179 1 16 . 1 1 18 18 SER CB C 18 63.003 63.003 63.490 -0.487 18792 12180 1 16 . 1 1 18 18 SER H H 18 8.384 8.384 8.268 0.116 18792 12181 1 16 . 1 1 19 19 TYR N N 19 124.570 124.570 121.584 2.986 18792 12182 1 16 . 1 1 19 19 TYR C C 19 178.415 178.415 177.612 0.803 18792 12183 1 16 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.196 -1.432 18792 12184 1 16 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.562 -1.546 18792 12185 1 16 . 1 1 19 19 TYR H H 19 8.155 8.155 9.030 -0.875 18792 12186 1 16 . 1 1 20 20 LYS N N 20 119.739 119.739 120.882 -1.143 18792 12187 1 16 . 1 1 20 20 LYS C C 20 180.456 180.456 179.032 1.424 18792 12188 1 16 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.340 -2.852 18792 12189 1 16 . 1 1 20 20 LYS CB C 20 28.159 28.159 31.651 -3.492 18792 12190 1 16 . 1 1 20 20 LYS H H 20 8.224 8.224 8.601 -0.377 18792 12191 1 16 . 1 1 21 21 LEU N N 21 118.092 118.092 121.405 -3.313 18792 12192 1 16 . 1 1 21 21 LEU C C 21 179.989 179.989 178.529 1.460 18792 12193 1 16 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.016 0.110 18792 12194 1 16 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.657 -2.049 18792 12195 1 16 . 1 1 21 21 LEU H H 21 8.586 8.586 7.664 0.922 18792 12196 1 16 . 1 1 22 22 SER N N 22 117.304 117.304 114.605 2.699 18792 12197 1 16 . 1 1 22 22 SER C C 22 180.152 180.152 177.175 2.977 18792 12198 1 16 . 1 1 22 22 SER CA C 22 61.287 61.287 61.995 -0.708 18792 12199 1 16 . 1 1 22 22 SER H H 22 8.266 8.266 7.763 0.503 18792 12200 1 16 . 1 1 23 23 GLN N N 23 122.497 122.497 120.817 1.680 18792 12201 1 16 . 1 1 23 23 GLN C C 23 177.297 177.297 177.485 -0.188 18792 12202 1 16 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.388 -0.446 18792 12203 1 16 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.487 -0.676 18792 12204 1 16 . 1 1 23 23 GLN H H 23 7.571 7.571 8.347 -0.776 18792 12205 1 16 . 1 1 24 24 LYS N N 24 116.038 116.038 119.101 -3.063 18792 12206 1 16 . 1 1 24 24 LYS C C 24 175.704 175.704 177.028 -1.324 18792 12207 1 16 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.809 -3.314 18792 12208 1 16 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.390 -2.161 18792 12209 1 16 . 1 1 24 24 LYS H H 24 7.134 7.134 7.746 -0.612 18792 12210 1 16 . 1 1 25 25 GLY N N 25 105.283 105.283 105.604 -0.321 18792 12211 1 16 . 1 1 25 25 GLY C C 25 174.013 174.013 173.370 0.643 18792 12212 1 16 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.548 0.231 18792 12213 1 16 . 1 1 25 25 GLY H H 25 7.483 7.483 7.911 -0.428 18792 12214 1 16 . 1 1 26 26 TYR N N 26 119.547 119.547 119.848 -0.301 18792 12215 1 16 . 1 1 26 26 TYR C C 26 175.122 175.122 173.780 1.342 18792 12216 1 16 . 1 1 26 26 TYR CA C 26 55.132 55.132 57.014 -1.882 18792 12217 1 16 . 1 1 26 26 TYR CB C 26 40.080 40.080 40.743 -0.663 18792 12218 1 16 . 1 1 26 26 TYR H H 26 7.788 7.788 7.705 0.083 18792 12219 1 16 . 1 1 27 27 SER N N 27 115.088 115.088 116.093 -1.005 18792 12220 1 16 . 1 1 27 27 SER C C 27 174.452 174.452 175.719 -1.267 18792 12221 1 16 . 1 1 27 27 SER CA C 27 56.306 56.306 55.823 0.483 18792 12222 1 16 . 1 1 27 27 SER CB C 27 63.921 63.921 65.654 -1.733 18792 12223 1 16 . 1 1 27 27 SER H H 27 8.473 8.473 8.013 0.460 18792 12224 1 16 . 1 1 28 28 TRP N N 28 127.014 127.014 123.308 3.706 18792 12225 1 16 . 1 1 28 28 TRP C C 28 177.002 177.002 176.967 0.035 18792 12226 1 16 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.380 0.092 18792 12227 1 16 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.700 1.130 18792 12228 1 16 . 1 1 28 28 TRP H H 28 8.897 8.897 8.839 0.058 18792 12229 1 16 . 1 1 29 29 SER N N 29 112.044 112.044 115.480 -3.436 18792 12230 1 16 . 1 1 29 29 SER C C 29 175.106 175.106 176.105 -0.999 18792 12231 1 16 . 1 1 29 29 SER CA C 29 59.472 59.472 59.835 -0.363 18792 12232 1 16 . 1 1 29 29 SER CB C 29 62.226 62.226 62.647 -0.421 18792 12233 1 16 . 1 1 29 29 SER H H 29 8.129 8.129 6.967 1.162 18792 12234 1 16 . 1 1 30 30 GLN N N 30 119.160 119.160 121.402 -2.242 18792 12235 1 16 . 1 1 30 30 GLN C C 30 176.218 176.218 178.673 -2.455 18792 12236 1 16 . 1 1 30 30 GLN CA C 30 56.412 56.412 58.297 -1.885 18792 12237 1 16 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.846 -1.268 18792 12238 1 16 . 1 1 30 30 GLN H H 30 7.370 7.370 7.874 -0.504 18792 12239 1 16 . 1 1 31 31 PHE N N 31 116.277 116.277 119.097 -2.820 18792 12240 1 16 . 1 1 31 31 PHE C C 31 175.217 175.217 175.949 -0.732 18792 12241 1 16 . 1 1 31 31 PHE CA C 31 56.234 56.234 60.507 -4.273 18792 12242 1 16 . 1 1 31 31 PHE CB C 31 39.066 39.066 39.919 -0.853 18792 12243 1 16 . 1 1 31 31 PHE H H 31 7.248 7.248 8.238 -0.990 18792 12244 1 16 . 1 1 32 32 SER N N 32 113.683 113.683 115.218 -1.535 18792 12245 1 16 . 1 1 32 32 SER C C 32 173.793 173.793 173.966 -0.173 18792 12246 1 16 . 1 1 32 32 SER CA C 32 57.124 57.124 57.264 -0.140 18792 12247 1 16 . 1 1 32 32 SER CB C 32 63.081 63.081 63.916 -0.835 18792 12248 1 16 . 1 1 32 32 SER H H 32 7.242 7.242 7.784 -0.542 18792 12249 1 16 . 1 1 33 33 ASP N N 33 122.195 122.195 126.401 -4.206 18792 12250 1 16 . 1 1 33 33 ASP C C 33 176.394 176.394 177.041 -0.647 18792 12251 1 16 . 1 1 33 33 ASP CA C 33 53.748 53.748 56.425 -2.677 18792 12252 1 16 . 1 1 33 33 ASP CB C 33 40.398 40.398 41.062 -0.664 18792 12253 1 16 . 1 1 33 33 ASP H H 33 8.257 8.257 9.015 -0.758 18792 12254 1 16 . 1 1 34 34 VAL N N 34 118.913 118.913 118.013 0.900 18792 12255 1 16 . 1 1 34 34 VAL C C 34 176.328 176.328 176.483 -0.155 18792 12256 1 16 . 1 1 34 34 VAL CA C 34 61.891 61.891 61.443 0.448 18792 12257 1 16 . 1 1 34 34 VAL CB C 34 32.015 32.015 31.506 0.509 18792 12258 1 16 . 1 1 34 34 VAL H H 34 7.852 7.852 7.831 0.021 18792 12259 1 16 . 1 1 35 35 GLU N N 35 124.205 124.205 120.911 3.294 18792 12260 1 16 . 1 1 35 35 GLU C C 35 176.586 176.586 177.132 -0.546 18792 12261 1 16 . 1 1 35 35 GLU CA C 35 56.057 56.057 58.699 -2.642 18792 12262 1 16 . 1 1 35 35 GLU CB C 35 28.898 28.898 30.257 -1.359 18792 12263 1 16 . 1 1 35 35 GLU H H 35 8.401 8.401 8.015 0.386 18792 12264 1 16 . 1 1 36 36 GLU N N 36 121.670 121.670 115.296 6.374 18792 12265 1 16 . 1 1 36 36 GLU C C 36 176.218 176.218 175.603 0.615 18792 12266 1 16 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.711 -0.723 18792 12267 1 16 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.358 -0.916 18792 12268 1 16 . 1 1 36 36 GLU H H 36 8.239 8.239 8.928 -0.689 18792 12269 1 16 . 1 1 37 37 ASN N N 37 119.252 119.252 116.888 2.364 18792 12270 1 16 . 1 1 37 37 ASN C C 37 175.003 175.003 173.960 1.043 18792 12271 1 16 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.091 -0.436 18792 12272 1 16 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.437 -1.225 18792 12273 1 16 . 1 1 37 37 ASN H H 37 8.412 8.412 8.234 0.178 18792 12274 1 16 . 1 1 38 38 ARG N N 38 121.622 121.622 120.686 0.936 18792 12275 1 16 . 1 1 38 38 ARG C C 38 176.610 176.610 175.814 0.796 18792 12276 1 16 . 1 1 38 38 ARG CA C 38 55.364 55.364 55.461 -0.097 18792 12277 1 16 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.374 -1.955 18792 12278 1 16 . 1 1 38 38 ARG H H 38 8.227 8.227 8.589 -0.362 18792 12279 1 16 . 1 1 39 39 THR N N 39 115.681 115.681 113.748 1.933 18792 12280 1 16 . 1 1 39 39 THR C C 39 174.500 174.500 173.986 0.514 18792 12281 1 16 . 1 1 39 39 THR CA C 39 61.606 61.606 63.105 -1.499 18792 12282 1 16 . 1 1 39 39 THR CB C 39 69.163 69.163 69.123 0.040 18792 12283 1 16 . 1 1 39 39 THR H H 39 8.173 8.173 8.717 -0.544 18792 12284 1 16 . 1 1 40 40 GLU N N 40 122.708 122.708 118.728 3.980 18792 12285 1 16 . 1 1 40 40 GLU C C 40 175.728 175.728 174.963 0.765 18792 12286 1 16 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.464 -0.692 18792 12287 1 16 . 1 1 40 40 GLU CB C 40 29.054 29.054 28.468 0.586 18792 12288 1 16 . 1 1 40 40 GLU H H 40 8.298 8.298 8.407 -0.109 18792 12289 1 16 . 1 1 41 41 ALA N N 41 125.922 125.922 122.366 3.556 18792 12290 1 16 . 1 1 41 41 ALA C C 41 175.557 175.557 175.984 -0.427 18792 12291 1 16 . 1 1 41 41 ALA CA C 41 49.973 49.973 50.386 -0.413 18792 12292 1 16 . 1 1 41 41 ALA CB C 41 17.245 17.245 18.859 -1.614 18792 12293 1 16 . 1 1 41 41 ALA H H 41 8.212 8.212 8.105 0.107 18792 12294 1 16 . 1 1 43 43 GLU N N 43 120.783 120.783 119.659 1.124 18792 12295 1 16 . 1 1 43 43 GLU C C 43 177.174 177.174 176.353 0.821 18792 12296 1 16 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.994 -0.653 18792 12297 1 16 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.583 -1.296 18792 12298 1 16 . 1 1 43 43 GLU H H 43 8.519 8.519 8.946 -0.427 18792 12299 1 16 . 1 1 44 44 GLY N N 44 110.022 110.022 108.811 1.211 18792 12300 1 16 . 1 1 44 44 GLY C C 44 174.773 174.773 174.660 0.113 18792 12301 1 16 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.162 -0.134 18792 12302 1 16 . 1 1 44 44 GLY H H 44 8.429 8.429 8.346 0.083 18792 12303 1 16 . 1 1 45 45 THR N N 45 112.790 112.790 112.684 0.106 18792 12304 1 16 . 1 1 45 45 THR C C 45 175.726 175.726 174.668 1.058 18792 12305 1 16 . 1 1 45 45 THR CA C 45 61.987 61.987 63.078 -1.091 18792 12306 1 16 . 1 1 45 45 THR CB C 45 69.304 69.304 68.902 0.402 18792 12307 1 16 . 1 1 45 45 THR H H 45 8.125 8.125 8.219 -0.094 18792 12308 1 16 . 1 1 46 46 GLU N N 46 122.752 122.752 119.818 2.934 18792 12309 1 16 . 1 1 46 46 GLU C C 46 177.419 177.419 175.832 1.587 18792 12310 1 16 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.516 0.716 18792 12311 1 16 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.896 -1.697 18792 12312 1 16 . 1 1 46 46 GLU H H 46 8.765 8.765 8.479 0.286 18792 12313 1 16 . 1 1 47 47 SER N N 47 114.895 114.895 112.557 2.338 18792 12314 1 16 . 1 1 47 47 SER C C 47 175.826 175.826 175.086 0.740 18792 12315 1 16 . 1 1 47 47 SER CA C 47 58.582 58.582 58.121 0.461 18792 12316 1 16 . 1 1 47 47 SER CB C 47 62.537 62.537 63.641 -1.104 18792 12317 1 16 . 1 1 47 47 SER H H 47 8.355 8.355 7.989 0.366 18792 12318 1 16 . 1 1 48 48 GLU N N 48 122.429 122.429 121.788 0.641 18792 12319 1 16 . 1 1 48 48 GLU C C 48 178.099 178.099 177.519 0.580 18792 12320 1 16 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.140 -0.522 18792 12321 1 16 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.283 -0.808 18792 12322 1 16 . 1 1 48 48 GLU H H 48 8.139 8.139 8.622 -0.483 18792 12323 1 16 . 1 1 49 49 ALA N N 49 120.374 120.374 123.631 -3.257 18792 12324 1 16 . 1 1 49 49 ALA C C 49 180.843 180.843 179.183 1.660 18792 12325 1 16 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.685 -0.202 18792 12326 1 16 . 1 1 49 49 ALA CB C 49 17.435 17.435 17.981 -0.546 18792 12327 1 16 . 1 1 49 49 ALA H H 49 8.079 8.079 8.335 -0.256 18792 12328 1 16 . 1 1 50 50 VAL N N 50 118.599 118.599 118.519 0.080 18792 12329 1 16 . 1 1 50 50 VAL C C 50 176.921 176.921 177.380 -0.459 18792 12330 1 16 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.011 -0.451 18792 12331 1 16 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.390 -1.093 18792 12332 1 16 . 1 1 50 50 VAL H H 50 7.419 7.419 7.965 -0.546 18792 12333 1 16 . 1 1 51 51 LYS N N 51 117.469 117.469 120.309 -2.840 18792 12334 1 16 . 1 1 51 51 LYS C C 51 179.061 179.061 178.665 0.396 18792 12335 1 16 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.350 -0.127 18792 12336 1 16 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.789 -0.793 18792 12337 1 16 . 1 1 51 51 LYS H H 51 7.359 7.359 7.572 -0.213 18792 12338 1 16 . 1 1 52 52 GLN N N 52 115.930 115.930 117.696 -1.766 18792 12339 1 16 . 1 1 52 52 GLN C C 52 177.713 177.713 178.478 -0.765 18792 12340 1 16 . 1 1 52 52 GLN CA C 52 58.476 58.476 59.028 -0.552 18792 12341 1 16 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.634 -2.066 18792 12342 1 16 . 1 1 52 52 GLN H H 52 8.025 8.025 7.919 0.106 18792 12343 1 16 . 1 1 53 53 ALA N N 53 119.782 119.782 122.263 -2.481 18792 12344 1 16 . 1 1 53 53 ALA C C 53 180.008 180.008 179.016 0.992 18792 12345 1 16 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.537 -0.152 18792 12346 1 16 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.627 -1.112 18792 12347 1 16 . 1 1 53 53 ALA H H 53 7.655 7.655 7.965 -0.310 18792 12348 1 16 . 1 1 54 54 LEU N N 54 120.443 120.443 118.455 1.988 18792 12349 1 16 . 1 1 54 54 LEU C C 54 179.330 179.330 178.247 1.083 18792 12350 1 16 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.715 1.298 18792 12351 1 16 . 1 1 54 54 LEU CB C 54 40.862 40.862 42.605 -1.743 18792 12352 1 16 . 1 1 54 54 LEU H H 54 8.419 8.419 7.945 0.474 18792 12353 1 16 . 1 1 55 55 ARG N N 55 118.423 118.423 120.799 -2.376 18792 12354 1 16 . 1 1 55 55 ARG C C 55 178.767 178.767 178.410 0.357 18792 12355 1 16 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.528 0.869 18792 12356 1 16 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.079 -1.337 18792 12357 1 16 . 1 1 55 55 ARG H H 55 8.062 8.062 8.451 -0.389 18792 12358 1 16 . 1 1 56 56 GLU N N 56 115.988 115.988 118.777 -2.789 18792 12359 1 16 . 1 1 56 56 GLU C C 56 180.090 180.090 178.708 1.382 18792 12360 1 16 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.073 -0.313 18792 12361 1 16 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.289 -0.935 18792 12362 1 16 . 1 1 56 56 GLU H H 56 7.772 7.772 8.390 -0.618 18792 12363 1 16 . 1 1 57 57 ALA N N 57 122.837 122.837 121.181 1.656 18792 12364 1 16 . 1 1 57 57 ALA C C 57 181.861 181.861 179.659 2.202 18792 12365 1 16 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.565 0.069 18792 12366 1 16 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.172 0.301 18792 12367 1 16 . 1 1 57 57 ALA H H 57 8.774 8.774 7.537 1.237 18792 12368 1 16 . 1 1 58 58 GLY N N 58 108.409 108.409 106.242 2.167 18792 12369 1 16 . 1 1 58 58 GLY C C 58 175.331 175.331 175.712 -0.381 18792 12370 1 16 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.449 0.219 18792 12371 1 16 . 1 1 58 58 GLY H H 58 9.073 9.073 7.984 1.089 18792 12372 1 16 . 1 1 59 59 ASP N N 59 122.074 122.074 122.931 -0.857 18792 12373 1 16 . 1 1 59 59 ASP C C 59 179.023 179.023 177.912 1.111 18792 12374 1 16 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.319 -0.017 18792 12375 1 16 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.365 -2.523 18792 12376 1 16 . 1 1 59 59 ASP H H 59 8.049 8.049 8.171 -0.122 18792 12377 1 16 . 1 1 60 60 GLU N N 60 120.131 120.131 119.935 0.196 18792 12378 1 16 . 1 1 60 60 GLU C C 60 178.522 178.522 179.097 -0.575 18792 12379 1 16 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.577 -0.568 18792 12380 1 16 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.775 -1.576 18792 12381 1 16 . 1 1 60 60 GLU H H 60 8.136 8.136 8.286 -0.150 18792 12382 1 16 . 1 1 61 61 PHE N N 61 121.309 121.309 118.517 2.792 18792 12383 1 16 . 1 1 61 61 PHE C C 61 176.904 176.904 177.686 -0.782 18792 12384 1 16 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.061 0.261 18792 12385 1 16 . 1 1 61 61 PHE CB C 61 38.609 38.609 38.824 -0.215 18792 12386 1 16 . 1 1 61 61 PHE H H 61 8.523 8.523 8.122 0.401 18792 12387 1 16 . 1 1 62 62 GLU N N 62 115.971 115.971 120.341 -4.370 18792 12388 1 16 . 1 1 62 62 GLU C C 62 177.713 177.713 178.552 -0.839 18792 12389 1 16 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.329 -1.138 18792 12390 1 16 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.738 -1.462 18792 12391 1 16 . 1 1 62 62 GLU H H 62 7.969 7.969 8.151 -0.182 18792 12392 1 16 . 1 1 63 63 LEU N N 63 116.703 116.703 118.903 -2.200 18792 12393 1 16 . 1 1 63 63 LEU C C 63 178.963 178.963 178.342 0.621 18792 12394 1 16 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.028 -0.616 18792 12395 1 16 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.233 -0.827 18792 12396 1 16 . 1 1 63 63 LEU H H 63 7.347 7.347 8.135 -0.788 18792 12397 1 16 . 1 1 64 64 ARG N N 64 117.453 117.453 116.162 1.291 18792 12398 1 16 . 1 1 64 64 ARG C C 64 177.297 177.297 178.255 -0.958 18792 12399 1 16 . 1 1 64 64 ARG CA C 64 57.337 57.337 56.084 1.253 18792 12400 1 16 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.318 -0.721 18792 12401 1 16 . 1 1 64 64 ARG H H 64 7.995 7.995 7.658 0.337 18792 12402 1 16 . 1 1 65 65 TYR N N 65 118.956 118.956 121.675 -2.719 18792 12403 1 16 . 1 1 65 65 TYR C C 65 175.278 175.278 176.076 -0.798 18792 12404 1 16 . 1 1 65 65 TYR CA C 65 55.701 55.701 60.727 -5.026 18792 12405 1 16 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.052 -3.066 18792 12406 1 16 . 1 1 65 65 TYR H H 65 7.909 7.909 7.845 0.064 18792 12407 1 16 . 1 1 66 66 ARG N N 66 119.438 119.438 115.425 4.013 18792 12408 1 16 . 1 1 66 66 ARG C C 66 178.424 178.424 176.602 1.822 18792 12409 1 16 . 1 1 66 66 ARG CA C 66 58.476 58.476 55.867 2.609 18792 12410 1 16 . 1 1 66 66 ARG CB C 66 28.821 28.821 32.881 -4.060 18792 12411 1 16 . 1 1 66 66 ARG H H 66 7.244 7.244 7.693 -0.449 18792 12412 1 16 . 1 1 67 67 ARG N N 67 118.936 118.936 120.783 -1.847 18792 12413 1 16 . 1 1 67 67 ARG C C 67 177.542 177.542 177.910 -0.368 18792 12414 1 16 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.080 -1.636 18792 12415 1 16 . 1 1 67 67 ARG CB C 67 28.121 28.121 30.431 -2.310 18792 12416 1 16 . 1 1 67 67 ARG H H 67 8.417 8.417 8.847 -0.430 18792 12417 1 16 . 1 1 68 68 ALA N N 68 121.797 121.797 122.024 -0.227 18792 12418 1 16 . 1 1 68 68 ALA C C 68 180.337 180.337 179.478 0.859 18792 12419 1 16 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.753 -0.617 18792 12420 1 16 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.006 -0.539 18792 12421 1 16 . 1 1 68 68 ALA H H 68 7.827 7.827 8.503 -0.676 18792 12422 1 16 . 1 1 69 69 PHE N N 69 115.986 115.986 116.851 -0.865 18792 12423 1 16 . 1 1 69 69 PHE C C 69 177.468 177.468 177.882 -0.414 18792 12424 1 16 . 1 1 69 69 PHE CA C 69 58.049 58.049 62.090 -4.041 18792 12425 1 16 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.747 -1.148 18792 12426 1 16 . 1 1 69 69 PHE H H 69 8.517 8.517 7.954 0.563 18792 12427 1 16 . 1 1 70 70 SER N N 70 116.526 116.526 114.656 1.870 18792 12428 1 16 . 1 1 70 70 SER C C 70 177.640 177.640 176.137 1.503 18792 12429 1 16 . 1 1 70 70 SER CA C 70 61.073 61.073 60.933 0.140 18792 12430 1 16 . 1 1 70 70 SER CB C 70 61.993 61.993 63.194 -1.201 18792 12431 1 16 . 1 1 70 70 SER H H 70 8.152 8.152 7.920 0.232 18792 12432 1 16 . 1 1 71 71 ASP N N 71 121.181 121.181 122.789 -1.608 18792 12433 1 16 . 1 1 71 71 ASP C C 71 178.546 178.546 178.115 0.431 18792 12434 1 16 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.104 -0.656 18792 12435 1 16 . 1 1 71 71 ASP CB C 71 39.231 39.231 41.185 -1.954 18792 12436 1 16 . 1 1 71 71 ASP H H 71 8.356 8.356 7.560 0.796 18792 12437 1 16 . 1 1 72 72 LEU N N 72 120.747 120.747 120.859 -0.112 18792 12438 1 16 . 1 1 72 72 LEU C C 72 178.963 178.963 178.377 0.586 18792 12439 1 16 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.527 -1.083 18792 12440 1 16 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.149 -1.132 18792 12441 1 16 . 1 1 72 72 LEU H H 72 7.738 7.738 8.329 -0.591 18792 12442 1 16 . 1 1 73 73 THR N N 73 109.432 109.432 111.705 -2.273 18792 12443 1 16 . 1 1 73 73 THR C C 73 177.481 177.481 176.272 1.209 18792 12444 1 16 . 1 1 73 73 THR CA C 73 65.128 65.128 65.402 -0.274 18792 12445 1 16 . 1 1 73 73 THR CB C 73 67.720 67.720 67.868 -0.148 18792 12446 1 16 . 1 1 73 73 THR H H 73 8.296 8.296 7.664 0.632 18792 12447 1 16 . 1 1 74 74 SER N N 74 115.862 115.862 115.867 -0.005 18792 12448 1 16 . 1 1 74 74 SER C C 74 175.361 175.361 175.269 0.092 18792 12449 1 16 . 1 1 74 74 SER CA C 74 60.112 60.112 60.291 -0.179 18792 12450 1 16 . 1 1 74 74 SER CB C 74 62.537 62.537 62.682 -0.145 18792 12451 1 16 . 1 1 74 74 SER H H 74 7.629 7.629 7.524 0.105 18792 12452 1 16 . 1 1 75 75 GLN N N 75 118.551 118.551 118.580 -0.029 18792 12453 1 16 . 1 1 75 75 GLN C C 75 176.316 176.316 177.469 -1.153 18792 12454 1 16 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.257 0.547 18792 12455 1 16 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.092 -0.815 18792 12456 1 16 . 1 1 75 75 GLN H H 75 7.640 7.640 7.928 -0.288 18792 12457 1 16 . 1 1 76 76 LEU N N 76 118.313 118.313 120.571 -2.258 18792 12458 1 16 . 1 1 76 76 LEU C C 76 174.160 174.160 176.904 -2.744 18792 12459 1 16 . 1 1 76 76 LEU CA C 76 54.740 54.740 56.717 -1.976 18792 12460 1 16 . 1 1 76 76 LEU CB C 76 42.727 42.727 42.545 0.182 18792 12461 1 16 . 1 1 76 76 LEU H H 76 7.411 7.411 7.680 -0.269 18792 12462 1 16 . 1 1 77 77 HIS N N 77 120.104 120.104 113.667 6.437 18792 12463 1 16 . 1 1 77 77 HIS C C 77 174.528 174.528 175.036 -0.508 18792 12464 1 16 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.552 -1.345 18792 12465 1 16 . 1 1 77 77 HIS CB C 77 27.966 27.966 27.097 0.869 18792 12466 1 16 . 1 1 77 77 HIS H H 77 8.117 8.117 7.385 0.732 18792 12467 1 16 . 1 1 78 78 ILE N N 78 122.298 122.298 114.802 7.496 18792 12468 1 16 . 1 1 78 78 ILE C C 78 174.240 174.240 175.906 -1.666 18792 12469 1 16 . 1 1 78 78 ILE CA C 78 61.402 61.402 62.396 -0.994 18792 12470 1 16 . 1 1 78 78 ILE CB C 78 37.591 37.591 38.271 -0.680 18792 12471 1 16 . 1 1 78 78 ILE H H 78 8.655 8.655 7.885 0.770 18792 12472 1 16 . 1 1 79 79 THR N N 79 116.442 116.442 112.673 3.769 18792 12473 1 16 . 1 1 79 79 THR C C 79 174.291 174.291 173.024 1.267 18792 12474 1 16 . 1 1 79 79 THR CA C 79 61.632 61.632 58.783 2.849 18792 12475 1 16 . 1 1 79 79 THR CB C 79 68.704 68.704 69.322 -0.618 18792 12476 1 16 . 1 1 79 79 THR H H 79 8.245 8.245 8.139 0.106 18792 12477 1 16 . 1 1 84 84 TYR N N 84 120.888 120.888 120.153 0.735 18792 12478 1 16 . 1 1 84 84 TYR C C 84 176.708 176.708 176.932 -0.224 18792 12479 1 16 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.278 -0.846 18792 12480 1 16 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.698 -0.953 18792 12481 1 16 . 1 1 84 84 TYR H H 84 8.733 8.733 8.644 0.089 18792 12482 1 16 . 1 1 85 85 GLN N N 85 114.530 114.530 119.870 -5.340 18792 12483 1 16 . 1 1 85 85 GLN C C 85 178.473 178.473 178.339 0.134 18792 12484 1 16 . 1 1 85 85 GLN CA C 85 59.294 59.294 58.998 0.296 18792 12485 1 16 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.861 -1.060 18792 12486 1 16 . 1 1 85 85 GLN H H 85 8.413 8.413 7.839 0.574 18792 12487 1 16 . 1 1 86 86 SER N N 86 114.032 114.032 116.165 -2.133 18792 12488 1 16 . 1 1 86 86 SER C C 86 178.473 178.473 176.647 1.826 18792 12489 1 16 . 1 1 86 86 SER CA C 86 62.175 62.175 61.524 0.651 18792 12490 1 16 . 1 1 86 86 SER CB C 86 63.252 63.252 63.150 0.102 18792 12491 1 16 . 1 1 86 86 SER H H 86 7.258 7.258 7.609 -0.351 18792 12492 1 16 . 1 1 88 88 GLU N N 88 119.386 119.386 119.393 -0.007 18792 12493 1 16 . 1 1 88 88 GLU C C 88 177.199 177.199 178.950 -1.751 18792 12494 1 16 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.937 -1.355 18792 12495 1 16 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.310 -0.334 18792 12496 1 16 . 1 1 88 88 GLU H H 88 8.534 8.534 8.837 -0.303 18792 12497 1 16 . 1 1 89 89 GLN N N 89 114.678 114.678 119.097 -4.419 18792 12498 1 16 . 1 1 89 89 GLN C C 89 178.669 178.669 178.681 -0.012 18792 12499 1 16 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.954 -0.372 18792 12500 1 16 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.856 -1.434 18792 12501 1 16 . 1 1 89 89 GLN H H 89 7.500 7.500 7.676 -0.176 18792 12502 1 16 . 1 1 90 90 VAL N N 90 118.174 118.174 119.301 -1.127 18792 12503 1 16 . 1 1 90 90 VAL C C 90 178.081 178.081 177.868 0.213 18792 12504 1 16 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.702 -0.147 18792 12505 1 16 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.047 -0.439 18792 12506 1 16 . 1 1 90 90 VAL H H 90 7.017 7.017 7.639 -0.622 18792 12507 1 16 . 1 1 91 91 VAL N N 91 119.489 119.489 121.397 -1.908 18792 12508 1 16 . 1 1 91 91 VAL C C 91 177.914 177.914 177.495 0.419 18792 12509 1 16 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.918 -1.149 18792 12510 1 16 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.219 -0.928 18792 12511 1 16 . 1 1 91 91 VAL H H 91 7.833 7.833 8.360 -0.527 18792 12512 1 16 . 1 1 92 92 ASN N N 92 117.180 117.180 116.978 0.202 18792 12513 1 16 . 1 1 92 92 ASN C C 92 179.110 179.110 176.429 2.681 18792 12514 1 16 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.209 -1.292 18792 12515 1 16 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.632 -2.664 18792 12516 1 16 . 1 1 92 92 ASN H H 92 8.368 8.368 8.209 0.159 18792 12517 1 16 . 1 1 93 93 GLU N N 93 118.476 118.476 119.369 -0.893 18792 12518 1 16 . 1 1 93 93 GLU C C 93 179.355 179.355 179.410 -0.055 18792 12519 1 16 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.828 -0.423 18792 12520 1 16 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.717 -1.984 18792 12521 1 16 . 1 1 93 93 GLU H H 93 7.213 7.213 7.570 -0.357 18792 12522 1 16 . 1 1 94 94 LEU N N 94 120.889 120.889 121.046 -0.157 18792 12523 1 16 . 1 1 94 94 LEU C C 94 178.473 178.473 176.480 1.993 18792 12524 1 16 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.043 -0.026 18792 12525 1 16 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.941 -2.011 18792 12526 1 16 . 1 1 94 94 LEU H H 94 7.446 7.446 7.811 -0.365 18792 12527 1 16 . 1 1 95 95 PHE N N 95 112.902 112.902 111.717 1.185 18792 12528 1 16 . 1 1 95 95 PHE C C 95 176.586 176.586 175.841 0.745 18792 12529 1 16 . 1 1 95 95 PHE CA C 95 57.159 57.159 54.999 2.160 18792 12530 1 16 . 1 1 95 95 PHE CB C 95 38.221 38.221 37.972 0.249 18792 12531 1 16 . 1 1 95 95 PHE H H 95 6.916 6.916 7.156 -0.240 18792 12532 1 16 . 1 1 96 96 ARG N N 96 123.729 123.729 120.568 3.161 18792 12533 1 16 . 1 1 96 96 ARG C C 96 177.272 177.272 176.814 0.458 18792 12534 1 16 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.552 0.671 18792 12535 1 16 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.314 -1.882 18792 12536 1 16 . 1 1 96 96 ARG H H 96 7.126 7.126 7.485 -0.359 18792 12537 1 16 . 1 1 97 97 ASP N N 97 116.576 116.576 116.794 -0.218 18792 12538 1 16 . 1 1 97 97 ASP C C 97 175.687 175.687 174.465 1.222 18792 12539 1 16 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.578 -0.905 18792 12540 1 16 . 1 1 97 97 ASP CB C 97 40.045 40.045 41.898 -1.853 18792 12541 1 16 . 1 1 97 97 ASP H H 97 8.644 8.644 8.105 0.539 18792 12542 1 16 . 1 1 98 98 GLY N N 98 108.551 108.551 108.028 0.523 18792 12543 1 16 . 1 1 98 98 GLY C C 98 172.690 172.690 172.385 0.305 18792 12544 1 16 . 1 1 98 98 GLY CA C 98 43.250 43.250 44.852 -1.602 18792 12545 1 16 . 1 1 98 98 GLY H H 98 7.463 7.463 7.843 -0.380 18792 12546 1 16 . 1 1 99 99 VAL N N 99 120.630 120.630 119.377 1.253 18792 12547 1 16 . 1 1 99 99 VAL C C 99 174.503 174.503 174.611 -0.108 18792 12548 1 16 . 1 1 99 99 VAL CA C 99 62.318 62.318 59.379 2.939 18792 12549 1 16 . 1 1 99 99 VAL CB C 99 30.763 30.763 35.113 -4.350 18792 12550 1 16 . 1 1 99 99 VAL H H 99 8.184 8.184 7.875 0.309 18792 12551 1 16 . 1 1 100 100 ASN N N 100 115.485 115.485 116.335 -0.850 18792 12552 1 16 . 1 1 100 100 ASN C C 100 175.239 175.239 177.144 -1.905 18792 12553 1 16 . 1 1 100 100 ASN CA C 100 51.361 51.361 56.019 -4.658 18792 12554 1 16 . 1 1 100 100 ASN CB C 100 38.920 38.920 36.859 2.061 18792 12555 1 16 . 1 1 100 100 ASN H H 100 6.241 6.241 8.627 -2.386 18792 12556 1 16 . 1 1 101 101 TRP N N 101 118.266 118.266 122.778 -4.512 18792 12557 1 16 . 1 1 101 101 TRP C C 101 178.301 178.301 176.637 1.664 18792 12558 1 16 . 1 1 101 101 TRP CA C 101 60.539 60.539 57.949 2.591 18792 12559 1 16 . 1 1 101 101 TRP CB C 101 29.830 29.830 29.066 0.764 18792 12560 1 16 . 1 1 101 101 TRP H H 101 8.409 8.409 8.569 -0.160 18792 12561 1 16 . 1 1 102 102 GLY N N 102 106.147 106.147 106.586 -0.439 18792 12562 1 16 . 1 1 102 102 GLY C C 102 177.640 177.640 175.165 2.475 18792 12563 1 16 . 1 1 102 102 GLY CA C 102 46.914 46.914 45.115 1.799 18792 12564 1 16 . 1 1 102 102 GLY H H 102 8.504 8.504 7.161 1.343 18792 12565 1 16 . 1 1 103 103 ARG N N 103 121.347 121.347 121.545 -0.198 18792 12566 1 16 . 1 1 103 103 ARG C C 103 177.738 177.738 178.230 -0.492 18792 12567 1 16 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.974 -1.032 18792 12568 1 16 . 1 1 103 103 ARG CB C 103 30.219 30.219 29.958 0.261 18792 12569 1 16 . 1 1 103 103 ARG H H 103 8.099 8.099 8.095 0.004 18792 12570 1 16 . 1 1 104 104 ILE N N 104 120.930 120.930 119.879 1.051 18792 12571 1 16 . 1 1 104 104 ILE C C 104 178.197 178.197 177.838 0.359 18792 12572 1 16 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.497 2.038 18792 12573 1 16 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.154 -2.109 18792 12574 1 16 . 1 1 104 104 ILE H H 104 7.690 7.690 7.724 -0.034 18792 12575 1 16 . 1 1 105 105 VAL N N 105 120.938 120.938 119.584 1.354 18792 12576 1 16 . 1 1 105 105 VAL C C 105 177.854 177.854 178.027 -0.173 18792 12577 1 16 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.313 1.145 18792 12578 1 16 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.818 -0.444 18792 12579 1 16 . 1 1 105 105 VAL H H 105 8.245 8.245 7.453 0.792 18792 12580 1 16 . 1 1 106 106 ALA N N 106 121.165 121.165 121.316 -0.151 18792 12581 1 16 . 1 1 106 106 ALA C C 106 178.284 178.284 179.079 -0.795 18792 12582 1 16 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.433 0.165 18792 12583 1 16 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.657 -1.142 18792 12584 1 16 . 1 1 106 106 ALA H H 106 7.529 7.529 7.621 -0.092 18792 12585 1 16 . 1 1 107 107 PHE N N 107 119.242 119.242 121.357 -2.115 18792 12586 1 16 . 1 1 107 107 PHE C C 107 176.390 176.390 177.054 -0.664 18792 12587 1 16 . 1 1 107 107 PHE CA C 107 60.173 60.173 61.343 -1.170 18792 12588 1 16 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.090 -2.003 18792 12589 1 16 . 1 1 107 107 PHE H H 107 7.974 7.974 7.937 0.037 18792 12590 1 16 . 1 1 108 108 PHE N N 108 120.009 120.009 117.380 2.629 18792 12591 1 16 . 1 1 108 108 PHE C C 108 177.640 177.640 177.762 -0.122 18792 12592 1 16 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.585 0.839 18792 12593 1 16 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.635 -3.289 18792 12594 1 16 . 1 1 108 108 PHE H H 108 7.946 7.946 8.488 -0.542 18792 12595 1 16 . 1 1 109 109 SER N N 109 114.631 114.631 115.589 -0.958 18792 12596 1 16 . 1 1 109 109 SER C C 109 177.770 177.770 176.342 1.428 18792 12597 1 16 . 1 1 109 109 SER CA C 109 63.349 63.349 61.234 2.115 18792 12598 1 16 . 1 1 109 109 SER H H 109 8.424 8.424 7.893 0.531 18792 12599 1 16 . 1 1 110 110 PHE N N 110 124.230 124.230 123.360 0.870 18792 12600 1 16 . 1 1 110 110 PHE C C 110 176.708 176.708 177.556 -0.848 18792 12601 1 16 . 1 1 110 110 PHE CA C 110 59.614 59.614 60.855 -1.241 18792 12602 1 16 . 1 1 110 110 PHE CB C 110 37.444 37.444 39.299 -1.855 18792 12603 1 16 . 1 1 110 110 PHE H H 110 9.052 9.052 8.832 0.220 18792 12604 1 16 . 1 1 111 111 GLY N N 111 105.893 105.893 105.864 0.029 18792 12605 1 16 . 1 1 111 111 GLY C C 111 176.795 176.795 175.728 1.067 18792 12606 1 16 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.448 0.928 18792 12607 1 16 . 1 1 111 111 GLY H H 111 7.926 7.926 8.784 -0.858 18792 12608 1 16 . 1 1 112 112 GLY N N 112 107.410 107.410 109.676 -2.266 18792 12609 1 16 . 1 1 112 112 GLY C C 112 174.650 174.650 175.825 -1.175 18792 12610 1 16 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.227 1.078 18792 12611 1 16 . 1 1 112 112 GLY H H 112 8.799 8.799 7.821 0.978 18792 12612 1 16 . 1 1 113 113 ALA N N 113 124.313 124.313 124.371 -0.058 18792 12613 1 16 . 1 1 113 113 ALA C C 113 181.300 181.300 178.525 2.775 18792 12614 1 16 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.599 -0.072 18792 12615 1 16 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.617 -1.134 18792 12616 1 16 . 1 1 113 113 ALA H H 113 8.212 8.212 8.140 0.072 18792 12617 1 16 . 1 1 114 114 LEU N N 114 118.878 118.878 119.600 -0.722 18792 12618 1 16 . 1 1 114 114 LEU C C 114 180.286 180.286 177.913 2.373 18792 12619 1 16 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.289 -0.307 18792 12620 1 16 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.659 -0.642 18792 12621 1 16 . 1 1 114 114 LEU H H 114 8.161 8.161 7.866 0.295 18792 12622 1 16 . 1 1 115 115 CYS N N 115 119.002 119.002 117.802 1.200 18792 12623 1 16 . 1 1 115 115 CYS C C 115 176.087 176.087 176.596 -0.509 18792 12624 1 16 . 1 1 115 115 CYS CA C 115 63.944 63.944 61.810 2.134 18792 12625 1 16 . 1 1 115 115 CYS CB C 115 25.635 25.635 25.825 -0.190 18792 12626 1 16 . 1 1 115 115 CYS H H 115 8.070 8.070 8.181 -0.111 18792 12627 1 16 . 1 1 116 116 VAL N N 116 118.737 118.737 122.072 -3.335 18792 12628 1 16 . 1 1 116 116 VAL C C 116 177.494 177.494 177.967 -0.473 18792 12629 1 16 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.429 0.333 18792 12630 1 16 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.401 -0.638 18792 12631 1 16 . 1 1 116 116 VAL H H 116 7.995 7.995 7.316 0.679 18792 12632 1 16 . 1 1 117 117 GLU N N 117 118.886 118.886 119.807 -0.921 18792 12633 1 16 . 1 1 117 117 GLU C C 117 178.424 178.424 179.137 -0.713 18792 12634 1 16 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.698 -0.938 18792 12635 1 16 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.471 -1.417 18792 12636 1 16 . 1 1 117 117 GLU H H 117 8.059 8.059 7.907 0.152 18792 12637 1 16 . 1 1 118 118 SER N N 118 113.417 113.417 115.724 -2.307 18792 12638 1 16 . 1 1 118 118 SER C C 118 175.607 175.607 176.183 -0.576 18792 12639 1 16 . 1 1 118 118 SER CA C 118 62.638 62.638 62.247 0.391 18792 12640 1 16 . 1 1 118 118 SER CB C 118 61.061 61.061 63.097 -2.036 18792 12641 1 16 . 1 1 118 118 SER H H 118 7.626 7.626 7.904 -0.278 18792 12642 1 16 . 1 1 119 119 VAL N N 119 120.612 120.612 121.789 -1.177 18792 12643 1 16 . 1 1 119 119 VAL C C 119 179.713 179.713 178.025 1.688 18792 12644 1 16 . 1 1 119 119 VAL CA C 119 66.225 66.225 66.111 0.114 18792 12645 1 16 . 1 1 119 119 VAL CB C 119 30.079 30.079 30.708 -0.629 18792 12646 1 16 . 1 1 119 119 VAL H H 119 7.297 7.297 7.641 -0.344 18792 12647 1 16 . 1 1 120 120 ASP N N 120 122.546 122.546 119.993 2.553 18792 12648 1 16 . 1 1 120 120 ASP C C 120 178.057 178.057 177.302 0.755 18792 12649 1 16 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.755 0.234 18792 12650 1 16 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.751 -0.828 18792 12651 1 16 . 1 1 120 120 ASP H H 120 8.264 8.264 7.662 0.602 18792 12652 1 16 . 1 1 121 121 LYS N N 121 115.636 115.636 118.322 -2.686 18792 12653 1 16 . 1 1 121 121 LYS C C 121 175.159 175.159 175.456 -0.297 18792 12654 1 16 . 1 1 121 121 LYS CA C 121 55.260 55.260 55.791 -0.531 18792 12655 1 16 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.395 -1.620 18792 12656 1 16 . 1 1 121 121 LYS H H 121 7.558 7.558 7.204 0.354 18792 12657 1 16 . 1 1 122 122 GLU N N 122 113.915 113.915 113.578 0.337 18792 12658 1 16 . 1 1 122 122 GLU C C 122 176.109 176.109 176.259 -0.150 18792 12659 1 16 . 1 1 122 122 GLU CA C 122 57.307 57.307 58.076 -0.769 18792 12660 1 16 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.029 -1.697 18792 12661 1 16 . 1 1 122 122 GLU H H 122 7.826 7.826 7.959 -0.133 18792 12662 1 16 . 1 1 124 124 GLN N N 124 119.233 119.233 120.686 -1.453 18792 12663 1 16 . 1 1 124 124 GLN C C 124 177.640 177.640 176.841 0.799 18792 12664 1 16 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.727 0.745 18792 12665 1 16 . 1 1 124 124 GLN CB C 124 26.490 26.490 27.040 -0.550 18792 12666 1 16 . 1 1 124 124 GLN H H 124 8.626 8.626 8.445 0.181 18792 12667 1 16 . 1 1 125 125 VAL N N 125 117.011 117.011 119.535 -2.524 18792 12668 1 16 . 1 1 125 125 VAL C C 125 175.826 175.826 176.583 -0.757 18792 12669 1 16 . 1 1 125 125 VAL CA C 125 63.136 63.136 64.636 -1.500 18792 12670 1 16 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.102 -0.805 18792 12671 1 16 . 1 1 125 125 VAL H H 125 7.870 7.870 7.861 0.009 18792 12672 1 16 . 1 1 126 126 LEU N N 126 117.058 117.058 118.649 -1.591 18792 12673 1 16 . 1 1 126 126 LEU C C 126 178.096 178.096 178.122 -0.026 18792 12674 1 16 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.597 -2.512 18792 12675 1 16 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.048 -1.775 18792 12676 1 16 . 1 1 126 126 LEU H H 126 7.747 7.747 7.956 -0.209 18792 12677 1 16 . 1 1 127 127 VAL N N 127 119.457 119.457 119.825 -0.368 18792 12678 1 16 . 1 1 127 127 VAL C C 127 177.150 177.150 177.904 -0.754 18792 12679 1 16 . 1 1 127 127 VAL CA C 127 67.156 67.156 65.717 1.439 18792 12680 1 16 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.494 -0.741 18792 12681 1 16 . 1 1 127 127 VAL H H 127 7.306 7.306 7.719 -0.413 18792 12682 1 16 . 1 1 128 128 SER N N 128 110.647 110.647 114.899 -4.252 18792 12683 1 16 . 1 1 128 128 SER C C 128 177.222 177.222 176.695 0.527 18792 12684 1 16 . 1 1 128 128 SER CA C 128 60.752 60.752 61.302 -0.550 18792 12685 1 16 . 1 1 128 128 SER CB C 128 61.605 61.605 62.800 -1.195 18792 12686 1 16 . 1 1 128 128 SER H H 128 8.237 8.237 7.712 0.525 18792 12687 1 16 . 1 1 129 129 ARG N N 129 123.100 123.100 121.928 1.172 18792 12688 1 16 . 1 1 129 129 ARG C C 129 175.802 175.802 178.462 -2.660 18792 12689 1 16 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.044 0.184 18792 12690 1 16 . 1 1 129 129 ARG CB C 129 28.199 28.199 29.596 -1.397 18792 12691 1 16 . 1 1 129 129 ARG H H 129 6.564 6.564 7.789 -1.225 18792 12692 1 16 . 1 1 130 130 ILE N N 130 118.182 118.182 117.204 0.978 18792 12693 1 16 . 1 1 130 130 ILE C C 130 178.156 178.156 177.568 0.588 18792 12694 1 16 . 1 1 130 130 ILE CA C 130 64.346 64.346 64.903 -0.557 18792 12695 1 16 . 1 1 130 130 ILE CB C 130 36.682 36.682 36.999 -0.317 18792 12696 1 16 . 1 1 130 130 ILE H H 130 7.955 7.955 8.172 -0.217 18792 12697 1 16 . 1 1 131 131 ALA N N 131 119.029 119.029 122.161 -3.132 18792 12698 1 16 . 1 1 131 131 ALA C C 131 179.593 179.593 179.416 0.177 18792 12699 1 16 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.144 -0.546 18792 12700 1 16 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.153 -0.765 18792 12701 1 16 . 1 1 131 131 ALA H H 131 7.582 7.582 8.053 -0.471 18792 12702 1 16 . 1 1 132 132 ALA N N 132 120.336 120.336 122.033 -1.697 18792 12703 1 16 . 1 1 132 132 ALA C C 132 181.095 181.095 179.729 1.366 18792 12704 1 16 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.905 -0.307 18792 12705 1 16 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.805 -2.104 18792 12706 1 16 . 1 1 132 132 ALA H H 132 7.224 7.224 7.801 -0.577 18792 12707 1 16 . 1 1 133 133 TRP N N 133 121.194 121.194 120.198 0.996 18792 12708 1 16 . 1 1 133 133 TRP C C 133 179.698 179.698 178.304 1.394 18792 12709 1 16 . 1 1 133 133 TRP CA C 133 57.302 57.302 59.963 -2.661 18792 12710 1 16 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.774 -2.119 18792 12711 1 16 . 1 1 133 133 TRP H H 133 8.925 8.925 8.902 0.023 18792 12712 1 16 . 1 1 134 134 MET N N 134 116.987 116.987 119.266 -2.279 18792 12713 1 16 . 1 1 134 134 MET C C 134 178.277 178.277 177.967 0.310 18792 12714 1 16 . 1 1 134 134 MET CA C 134 59.578 59.578 57.704 1.874 18792 12715 1 16 . 1 1 134 134 MET CB C 134 33.559 33.559 32.427 1.132 18792 12716 1 16 . 1 1 134 134 MET H H 134 8.863 8.863 8.385 0.478 18792 12717 1 16 . 1 1 135 135 ALA N N 135 120.523 120.523 120.723 -0.200 18792 12718 1 16 . 1 1 135 135 ALA C C 135 179.298 179.298 179.621 -0.323 18792 12719 1 16 . 1 1 135 135 ALA CA C 135 55.433 55.433 54.956 0.477 18792 12720 1 16 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.153 -1.516 18792 12721 1 16 . 1 1 135 135 ALA H H 135 8.152 8.152 8.328 -0.176 18792 12722 1 16 . 1 1 136 136 THR N N 136 116.715 116.715 117.504 -0.789 18792 12723 1 16 . 1 1 136 136 THR C C 136 175.106 175.106 176.772 -1.666 18792 12724 1 16 . 1 1 136 136 THR CA C 136 66.729 66.729 67.383 -0.654 18792 12725 1 16 . 1 1 136 136 THR CB C 136 68.441 68.441 68.847 -0.406 18792 12726 1 16 . 1 1 136 136 THR H H 136 8.532 8.532 8.143 0.389 18792 12727 1 16 . 1 1 137 137 TYR N N 137 123.204 123.204 119.971 3.233 18792 12728 1 16 . 1 1 137 137 TYR C C 137 179.592 179.592 178.181 1.411 18792 12729 1 16 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.159 1.906 18792 12730 1 16 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.968 0.020 18792 12731 1 16 . 1 1 137 137 TYR H H 137 8.809 8.809 7.768 1.041 18792 12732 1 16 . 1 1 138 138 LEU N N 138 119.247 119.247 121.592 -2.345 18792 12733 1 16 . 1 1 138 138 LEU C C 138 178.385 178.385 177.904 0.481 18792 12734 1 16 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.246 0.692 18792 12735 1 16 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.348 -0.640 18792 12736 1 16 . 1 1 138 138 LEU H H 138 8.742 8.742 8.385 0.357 18792 12737 1 16 . 1 1 139 139 ASN N N 139 117.122 117.122 116.374 0.748 18792 12738 1 16 . 1 1 139 139 ASN C C 139 176.417 176.417 177.483 -1.066 18792 12739 1 16 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.935 0.513 18792 12740 1 16 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.279 0.373 18792 12741 1 16 . 1 1 139 139 ASN H H 139 8.307 8.307 7.983 0.324 18792 12742 1 16 . 1 1 140 140 ASP N N 140 115.394 115.394 118.417 -3.023 18792 12743 1 16 . 1 1 140 140 ASP C C 140 177.919 177.919 176.256 1.663 18792 12744 1 16 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.683 -0.730 18792 12745 1 16 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.714 -1.328 18792 12746 1 16 . 1 1 140 140 ASP H H 140 8.439 8.439 7.834 0.605 18792 12747 1 16 . 1 1 141 141 HIS N N 141 111.695 111.695 113.475 -1.780 18792 12748 1 16 . 1 1 141 141 HIS C C 141 175.949 175.949 176.435 -0.486 18792 12749 1 16 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.047 0.010 18792 12750 1 16 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.314 -2.406 18792 12751 1 16 . 1 1 141 141 HIS H H 141 8.043 8.043 7.471 0.572 18792 12752 1 16 . 1 1 142 142 LEU N N 142 117.054 117.054 122.909 -5.855 18792 12753 1 16 . 1 1 142 142 LEU C C 142 176.530 176.530 178.003 -1.473 18792 12754 1 16 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.965 -2.656 18792 12755 1 16 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.361 0.977 18792 12756 1 16 . 1 1 142 142 LEU H H 142 7.198 7.198 8.597 -1.399 18792 12757 1 16 . 1 1 143 143 GLU N N 143 121.335 121.335 119.977 1.358 18792 12758 1 16 . 1 1 143 143 GLU C C 143 173.964 173.964 175.686 -1.722 18792 12759 1 16 . 1 1 143 143 GLU CA C 143 60.254 60.254 61.479 -1.225 18792 12760 1 16 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.223 -1.966 18792 12761 1 16 . 1 1 143 143 GLU H H 143 8.565 8.565 7.958 0.607 18792 12762 1 16 . 1 1 145 145 TRP N N 145 117.973 117.973 119.939 -1.966 18792 12763 1 16 . 1 1 145 145 TRP C C 145 179.526 179.526 177.913 1.613 18792 12764 1 16 . 1 1 145 145 TRP CA C 145 61.606 61.606 59.660 1.946 18792 12765 1 16 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.905 -2.017 18792 12766 1 16 . 1 1 145 145 TRP H H 145 7.078 7.078 8.029 -0.951 18792 12767 1 16 . 1 1 146 146 ILE N N 146 122.101 122.101 111.034 11.067 18792 12768 1 16 . 1 1 146 146 ILE C C 146 179.110 179.110 177.188 1.922 18792 12769 1 16 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.006 4.328 18792 12770 1 16 . 1 1 146 146 ILE CB C 146 36.822 36.822 37.937 -1.115 18792 12771 1 16 . 1 1 146 146 ILE H H 146 8.389 8.389 7.542 0.847 18792 12772 1 16 . 1 1 147 147 GLN N N 147 116.344 116.344 121.342 -4.998 18792 12773 1 16 . 1 1 147 147 GLN C C 147 179.526 179.526 177.389 2.137 18792 12774 1 16 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.972 -0.959 18792 12775 1 16 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.692 -0.969 18792 12776 1 16 . 1 1 147 147 GLN H H 147 8.376 8.376 8.030 0.346 18792 12777 1 16 . 1 1 148 148 GLU N N 148 118.913 118.913 120.139 -1.226 18792 12778 1 16 . 1 1 148 148 GLU C C 148 176.880 176.880 178.306 -1.426 18792 12779 1 16 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.425 -3.052 18792 12780 1 16 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.604 -1.172 18792 12781 1 16 . 1 1 148 148 GLU H H 148 7.504 7.504 7.950 -0.446 18792 12782 1 16 . 1 1 149 149 ASN N N 149 116.616 116.616 113.841 2.775 18792 12783 1 16 . 1 1 149 149 ASN C C 149 173.964 173.964 176.707 -2.743 18792 12784 1 16 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.496 -0.251 18792 12785 1 16 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.340 -2.207 18792 12786 1 16 . 1 1 149 149 ASN H H 149 7.070 7.070 8.219 -1.149 18792 12787 1 16 . 1 1 150 150 GLY N N 150 104.750 104.750 105.638 -0.888 18792 12788 1 16 . 1 1 150 150 GLY C C 150 176.022 176.022 174.098 1.924 18792 12789 1 16 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.636 -0.394 18792 12790 1 16 . 1 1 150 150 GLY H H 150 7.313 7.313 8.115 -0.802 18792 12791 1 16 . 1 1 151 151 GLY N N 151 108.385 108.385 108.357 0.028 18792 12792 1 16 . 1 1 151 151 GLY C C 151 173.449 173.449 174.457 -1.008 18792 12793 1 16 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.431 -0.399 18792 12794 1 16 . 1 1 151 151 GLY H H 151 8.452 8.452 7.318 1.134 18792 12795 1 16 . 1 1 152 152 TRP N N 152 118.092 118.092 121.610 -3.518 18792 12796 1 16 . 1 1 152 152 TRP C C 152 178.571 178.571 178.126 0.445 18792 12797 1 16 . 1 1 152 152 TRP CA C 152 60.077 60.077 59.920 0.157 18792 12798 1 16 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.808 -1.220 18792 12799 1 16 . 1 1 152 152 TRP H H 152 8.644 8.644 8.257 0.388 18792 12800 1 16 . 1 1 153 153 ASP N N 153 117.758 117.758 118.159 -0.401 18792 12801 1 16 . 1 1 153 153 ASP C C 153 179.796 179.796 178.428 1.368 18792 12802 1 16 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.771 -0.469 18792 12803 1 16 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.054 -1.823 18792 12804 1 16 . 1 1 153 153 ASP H H 153 8.827 8.827 8.321 0.506 18792 12805 1 16 . 1 1 154 154 THR N N 154 116.817 116.817 117.497 -0.680 18792 12806 1 16 . 1 1 154 154 THR C C 154 175.352 175.352 176.526 -1.174 18792 12807 1 16 . 1 1 154 154 THR CA C 154 65.910 65.910 66.934 -1.024 18792 12808 1 16 . 1 1 154 154 THR CB C 154 67.712 67.712 68.970 -1.258 18792 12809 1 16 . 1 1 154 154 THR H H 154 7.494 7.494 7.628 -0.134 18792 12810 1 16 . 1 1 155 155 PHE N N 155 122.196 122.196 121.536 0.660 18792 12811 1 16 . 1 1 155 155 PHE C C 155 176.831 176.831 177.724 -0.893 18792 12812 1 16 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.790 0.496 18792 12813 1 16 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.435 -1.768 18792 12814 1 16 . 1 1 155 155 PHE H H 155 6.477 6.477 8.892 -2.415 18792 12815 1 16 . 1 1 156 156 VAL N N 156 117.387 117.387 118.333 -0.946 18792 12816 1 16 . 1 1 156 156 VAL C C 156 178.497 178.497 177.531 0.966 18792 12817 1 16 . 1 1 156 156 VAL CA C 156 66.231 66.231 65.793 0.438 18792 12818 1 16 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.208 -0.523 18792 12819 1 16 . 1 1 156 156 VAL H H 156 7.788 7.788 8.134 -0.346 18792 12820 1 16 . 1 1 157 157 GLU N N 157 119.876 119.876 119.690 0.186 18792 12821 1 16 . 1 1 157 157 GLU C C 157 178.399 178.399 178.233 0.166 18792 12822 1 16 . 1 1 157 157 GLU CA C 157 58.760 58.760 58.888 -0.128 18792 12823 1 16 . 1 1 157 157 GLU CB C 157 28.277 28.277 30.305 -2.027 18792 12824 1 16 . 1 1 157 157 GLU H H 157 7.409 7.409 8.050 -0.641 18792 12825 1 16 . 1 1 158 158 LEU N N 158 117.194 117.194 119.030 -1.836 18792 12826 1 16 . 1 1 158 158 LEU C C 158 178.595 178.595 176.625 1.970 18792 12827 1 16 . 1 1 158 158 LEU CA C 158 56.377 56.377 54.857 1.520 18792 12828 1 16 . 1 1 158 158 LEU CB C 158 42.571 42.571 41.745 0.826 18792 12829 1 16 . 1 1 158 158 LEU H H 158 7.584 7.584 8.016 -0.432 18792 12830 1 16 . 1 1 159 159 TYR N N 159 115.549 115.549 115.532 0.017 18792 12831 1 16 . 1 1 159 159 TYR C C 159 177.032 177.032 175.337 1.695 18792 12832 1 16 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.215 -0.099 18792 12833 1 16 . 1 1 159 159 TYR CB C 159 37.599 37.599 36.457 1.142 18792 12834 1 16 . 1 1 159 159 TYR H H 159 8.099 8.099 7.318 0.781 18792 12835 1 16 . 1 1 160 160 GLY N N 160 108.334 108.334 104.361 3.973 18792 12836 1 16 . 1 1 160 160 GLY C C 160 173.973 173.973 172.994 0.979 18792 12837 1 16 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.427 0.637 18792 12838 1 16 . 1 1 160 160 GLY H H 160 8.020 8.020 7.931 0.089 18792 12839 1 16 . 1 1 161 161 ASN N N 161 118.189 118.189 117.631 0.558 18792 12840 1 16 . 1 1 161 161 ASN C C 161 175.513 175.513 173.961 1.552 18792 12841 1 16 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.879 -1.775 18792 12842 1 16 . 1 1 161 161 ASN CB C 161 38.203 38.203 38.474 -0.271 18792 12843 1 16 . 1 1 161 161 ASN H H 161 8.327 8.327 8.062 0.265 18792 12844 1 16 . 1 1 162 162 ASN N N 162 119.022 119.022 116.263 2.759 18792 12845 1 16 . 1 1 162 162 ASN C C 162 175.690 175.690 173.915 1.775 18792 12846 1 16 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.708 -0.284 18792 12847 1 16 . 1 1 162 162 ASN CB C 162 38.203 38.203 38.136 0.067 18792 12848 1 16 . 1 1 162 162 ASN H H 162 8.363 8.363 8.718 -0.355 18792 12849 1 16 . 1 1 163 163 ALA N N 163 123.275 123.275 125.760 -2.485 18792 12850 1 16 . 1 1 163 163 ALA C C 163 178.598 178.598 178.115 0.483 18792 12851 1 16 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.834 0.404 18792 12852 1 16 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.374 -1.763 18792 12853 1 16 . 1 1 163 163 ALA H H 163 8.103 8.103 8.557 -0.454 18792 12854 1 16 . 1 1 164 164 ALA N N 164 121.521 121.521 122.386 -0.865 18792 12855 1 16 . 1 1 164 164 ALA C C 164 178.642 178.642 178.383 0.259 18792 12856 1 16 . 1 1 164 164 ALA CA C 164 52.584 52.584 53.355 -0.771 18792 12857 1 16 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.527 -0.708 18792 12858 1 16 . 1 1 164 164 ALA H H 164 8.053 8.053 8.369 -0.316 18792 12859 1 16 . 1 1 165 165 ALA N N 165 122.101 122.101 121.097 1.004 18792 12860 1 16 . 1 1 165 165 ALA C C 165 179.124 179.124 178.386 0.738 18792 12861 1 16 . 1 1 165 165 ALA CA C 165 53.139 53.139 51.596 1.543 18792 12862 1 16 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.182 -0.204 18792 12863 1 16 . 1 1 165 165 ALA H H 165 7.949 7.949 8.305 -0.356 18792 12864 1 16 . 1 1 166 166 GLU N N 166 118.381 118.381 120.350 -1.969 18792 12865 1 16 . 1 1 166 166 GLU C C 166 177.664 177.664 177.643 0.021 18792 12866 1 16 . 1 1 166 166 GLU CA C 166 57.088 57.088 58.663 -1.575 18792 12867 1 16 . 1 1 166 166 GLU CB C 166 28.354 28.354 28.559 -0.205 18792 12868 1 16 . 1 1 166 166 GLU H H 166 8.202 8.202 8.276 -0.074 18792 12869 1 16 . 1 1 167 167 SER N N 167 115.193 115.193 114.540 0.653 18792 12870 1 16 . 1 1 167 167 SER C C 167 175.312 175.312 174.875 0.437 18792 12871 1 16 . 1 1 167 167 SER CA C 167 58.831 58.831 59.770 -0.939 18792 12872 1 16 . 1 1 167 167 SER CB C 167 62.537 62.537 63.252 -0.715 18792 12873 1 16 . 1 1 167 167 SER H H 167 8.029 8.029 8.198 -0.169 18792 12874 1 16 . 1 1 168 168 ARG N N 168 121.696 121.696 117.778 3.918 18792 12875 1 16 . 1 1 168 168 ARG C C 168 176.880 176.880 176.092 0.788 18792 12876 1 16 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.978 -0.815 18792 12877 1 16 . 1 1 168 168 ARG CB C 168 29.209 29.209 28.793 0.416 18792 12878 1 16 . 1 1 168 168 ARG H H 168 7.967 7.967 7.863 0.104 18792 12879 1 16 . 1 1 169 169 LYS N N 169 120.917 120.917 119.174 1.743 18792 12880 1 16 . 1 1 169 169 LYS C C 169 177.640 177.640 176.950 0.690 18792 12881 1 16 . 1 1 169 169 LYS CA C 169 56.697 56.697 57.933 -1.236 18792 12882 1 16 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.559 -1.097 18792 12883 1 16 . 1 1 169 169 LYS H H 169 8.011 8.011 8.092 -0.081 18792 12884 1 16 . 1 1 170 170 GLY N N 170 109.155 109.155 106.430 2.725 18792 12885 1 16 . 1 1 170 170 GLY C C 170 174.479 174.479 173.222 1.257 18792 12886 1 16 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.188 -0.124 18792 12887 1 16 . 1 1 170 170 GLY H H 170 8.329 8.329 7.989 0.340 18792 12888 1 16 . 1 1 171 171 GLN N N 171 119.292 119.292 123.343 -4.051 18792 12889 1 16 . 1 1 171 171 GLN C C 171 176.463 176.463 174.383 2.080 18792 12890 1 16 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.530 0.136 18792 12891 1 16 . 1 1 171 171 GLN CB C 171 28.199 28.199 29.596 -1.397 18792 12892 1 16 . 1 1 171 171 GLN H H 171 8.035 8.035 8.477 -0.442 18792 12893 1 16 . 1 1 172 172 GLU N N 172 121.703 121.703 120.638 1.065 18792 12894 1 16 . 1 1 172 172 GLU C C 172 176.414 176.414 174.866 1.548 18792 12895 1 16 . 1 1 172 172 GLU CA C 172 56.341 56.341 56.597 -0.256 18792 12896 1 16 . 1 1 172 172 GLU CB C 172 28.821 28.821 32.209 -3.388 18792 12897 1 16 . 1 1 172 172 GLU H H 172 8.405 8.405 8.176 0.229 18792 12898 1 16 . 1 1 173 173 ARG N N 173 121.852 121.852 124.838 -2.986 18792 12899 1 16 . 1 1 173 173 ARG C C 173 176.365 176.365 174.630 1.735 18792 12900 1 16 . 1 1 173 173 ARG CA C 173 56.199 56.199 56.485 -0.286 18792 12901 1 16 . 1 1 173 173 ARG CB C 173 29.131 29.131 30.388 -1.257 18792 12902 1 16 . 1 1 173 173 ARG H H 173 8.335 8.335 8.669 -0.334 18792 12903 1 16 . 1 1 174 174 LEU N N 174 122.640 122.640 121.715 0.925 18792 12904 1 16 . 1 1 174 174 LEU C C 174 176.523 176.523 176.688 -0.165 18792 12905 1 16 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.627 -0.859 18792 12906 1 16 . 1 1 174 174 LEU CB C 174 40.784 40.784 41.737 -0.953 18792 12907 1 16 . 1 1 174 174 LEU H H 174 8.082 8.082 8.388 -0.306 18792 12908 1 16 . 1 1 175 175 GLU N N 175 125.909 125.909 118.084 7.825 18792 12909 1 16 . 1 1 175 175 GLU C C 175 181.029 181.029 175.267 5.762 18792 12910 1 16 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.914 1.484 18792 12911 1 16 . 1 1 175 175 GLU CB C 175 30.050 30.050 32.169 -2.119 18792 12912 1 16 . 1 1 175 175 GLU H H 175 7.785 7.785 7.947 -0.162 18792 12913 1 17 . 1 1 4 4 ALA N N 4 124.786 124.786 122.939 1.847 18792 12914 1 17 . 1 1 4 4 ALA C C 4 178.272 178.272 179.438 -1.166 18792 12915 1 17 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.882 -2.316 18792 12916 1 17 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.822 -0.588 18792 12917 1 17 . 1 1 4 4 ALA H H 4 8.414 8.414 8.480 -0.066 18792 12918 1 17 . 1 1 5 5 MET N N 5 119.681 119.681 118.090 1.591 18792 12919 1 17 . 1 1 5 5 MET C C 5 176.929 176.929 178.464 -1.535 18792 12920 1 17 . 1 1 5 5 MET CA C 5 55.594 55.594 56.459 -0.865 18792 12921 1 17 . 1 1 5 5 MET CB C 5 31.540 31.540 31.699 -0.159 18792 12922 1 17 . 1 1 5 5 MET H H 5 8.336 8.336 8.407 -0.071 18792 12923 1 17 . 1 1 6 6 SER N N 6 116.162 116.162 116.968 -0.806 18792 12924 1 17 . 1 1 6 6 SER C C 6 175.924 175.924 176.376 -0.452 18792 12925 1 17 . 1 1 6 6 SER CA C 6 59.009 59.009 61.721 -2.712 18792 12926 1 17 . 1 1 6 6 SER CB C 6 62.537 62.537 62.442 0.095 18792 12927 1 17 . 1 1 6 6 SER H H 6 8.272 8.272 8.372 -0.100 18792 12928 1 17 . 1 1 7 7 GLN N N 7 122.263 122.263 119.881 2.382 18792 12929 1 17 . 1 1 7 7 GLN C C 7 177.027 177.027 178.147 -1.120 18792 12930 1 17 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.809 -2.539 18792 12931 1 17 . 1 1 7 7 GLN CB C 7 27.739 27.739 27.883 -0.144 18792 12932 1 17 . 1 1 7 7 GLN H H 7 8.314 8.314 8.244 0.070 18792 12933 1 17 . 1 1 8 8 SER N N 8 116.625 116.625 116.635 -0.010 18792 12934 1 17 . 1 1 8 8 SER C C 8 176.457 176.457 176.602 -0.145 18792 12935 1 17 . 1 1 8 8 SER CA C 8 59.650 59.650 62.177 -2.527 18792 12936 1 17 . 1 1 8 8 SER CB C 8 62.226 62.226 62.653 -0.427 18792 12937 1 17 . 1 1 8 8 SER H H 8 8.333 8.333 8.302 0.031 18792 12938 1 17 . 1 1 9 9 ASN N N 9 121.307 121.307 119.861 1.446 18792 12939 1 17 . 1 1 9 9 ASN C C 9 177.419 177.419 177.028 0.391 18792 12940 1 17 . 1 1 9 9 ASN CA C 9 55.487 55.487 55.862 -0.375 18792 12941 1 17 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.653 -1.520 18792 12942 1 17 . 1 1 9 9 ASN H H 9 8.611 8.611 7.588 1.023 18792 12943 1 17 . 1 1 10 10 ARG N N 10 119.830 119.830 120.848 -1.018 18792 12944 1 17 . 1 1 10 10 ARG C C 10 177.615 177.615 178.528 -0.913 18792 12945 1 17 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.583 -0.325 18792 12946 1 17 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.023 -1.824 18792 12947 1 17 . 1 1 10 10 ARG H H 10 7.996 7.996 8.400 -0.404 18792 12948 1 17 . 1 1 11 11 GLU N N 11 117.270 117.270 119.836 -2.566 18792 12949 1 17 . 1 1 11 11 GLU C C 11 179.649 179.649 178.587 1.062 18792 12950 1 17 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.138 -0.129 18792 12951 1 17 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.509 -1.388 18792 12952 1 17 . 1 1 11 11 GLU H H 11 7.885 7.885 8.352 -0.467 18792 12953 1 17 . 1 1 12 12 LEU N N 12 119.900 119.900 121.473 -1.573 18792 12954 1 17 . 1 1 12 12 LEU C C 12 178.473 178.473 178.355 0.118 18792 12955 1 17 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.049 -0.356 18792 12956 1 17 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.642 -1.013 18792 12957 1 17 . 1 1 12 12 LEU H H 12 7.691 7.691 7.958 -0.267 18792 12958 1 17 . 1 1 13 13 VAL N N 13 117.320 117.320 118.963 -1.643 18792 12959 1 17 . 1 1 13 13 VAL C C 13 177.272 177.272 177.508 -0.236 18792 12960 1 17 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.267 0.889 18792 12961 1 17 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.922 -0.693 18792 12962 1 17 . 1 1 13 13 VAL H H 13 7.629 7.629 8.095 -0.466 18792 12963 1 17 . 1 1 14 14 VAL N N 14 116.659 116.659 120.166 -3.507 18792 12964 1 17 . 1 1 14 14 VAL C C 14 178.718 178.718 176.870 1.848 18792 12965 1 17 . 1 1 14 14 VAL CA C 14 66.516 66.516 65.950 0.566 18792 12966 1 17 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.624 -1.250 18792 12967 1 17 . 1 1 14 14 VAL H H 14 8.210 8.210 7.678 0.532 18792 12968 1 17 . 1 1 15 15 ASP N N 15 120.374 120.374 121.616 -1.242 18792 12969 1 17 . 1 1 15 15 ASP C C 15 177.557 177.557 178.070 -0.513 18792 12970 1 17 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.745 0.731 18792 12971 1 17 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.635 1.918 18792 12972 1 17 . 1 1 15 15 ASP H H 15 7.967 7.967 8.414 -0.447 18792 12973 1 17 . 1 1 16 16 PHE N N 16 119.864 119.864 117.872 1.992 18792 12974 1 17 . 1 1 16 16 PHE C C 16 178.252 178.252 177.959 0.293 18792 12975 1 17 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.371 2.409 18792 12976 1 17 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.840 0.220 18792 12977 1 17 . 1 1 16 16 PHE H H 16 8.228 8.228 7.520 0.708 18792 12978 1 17 . 1 1 17 17 LEU N N 17 116.312 116.312 121.213 -4.901 18792 12979 1 17 . 1 1 17 17 LEU C C 17 179.649 179.649 178.284 1.365 18792 12980 1 17 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.172 -0.408 18792 12981 1 17 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.456 -1.371 18792 12982 1 17 . 1 1 17 17 LEU H H 17 8.766 8.766 8.395 0.371 18792 12983 1 17 . 1 1 18 18 SER N N 18 113.715 113.715 115.510 -1.795 18792 12984 1 17 . 1 1 18 18 SER C C 18 177.362 177.362 176.582 0.780 18792 12985 1 17 . 1 1 18 18 SER CA C 18 61.948 61.948 62.376 -0.428 18792 12986 1 17 . 1 1 18 18 SER CB C 18 63.003 63.003 63.273 -0.270 18792 12987 1 17 . 1 1 18 18 SER H H 18 8.384 8.384 8.064 0.320 18792 12988 1 17 . 1 1 19 19 TYR N N 19 124.570 124.570 122.912 1.658 18792 12989 1 17 . 1 1 19 19 TYR C C 19 178.415 178.415 177.192 1.223 18792 12990 1 17 . 1 1 19 19 TYR CA C 19 59.764 59.764 59.812 -0.048 18792 12991 1 17 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.664 -1.648 18792 12992 1 17 . 1 1 19 19 TYR H H 19 8.155 8.155 8.710 -0.555 18792 12993 1 17 . 1 1 20 20 LYS N N 20 119.739 119.739 120.893 -1.154 18792 12994 1 17 . 1 1 20 20 LYS C C 20 180.456 180.456 178.339 2.117 18792 12995 1 17 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.429 -1.941 18792 12996 1 17 . 1 1 20 20 LYS CB C 20 28.159 28.159 31.853 -3.694 18792 12997 1 17 . 1 1 20 20 LYS H H 20 8.224 8.224 7.986 0.238 18792 12998 1 17 . 1 1 21 21 LEU N N 21 118.092 118.092 120.012 -1.920 18792 12999 1 17 . 1 1 21 21 LEU C C 21 179.989 179.989 178.058 1.931 18792 13000 1 17 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.179 -0.053 18792 13001 1 17 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.784 -2.176 18792 13002 1 17 . 1 1 21 21 LEU H H 21 8.586 8.586 7.879 0.707 18792 13003 1 17 . 1 1 22 22 SER N N 22 117.304 117.304 112.459 4.845 18792 13004 1 17 . 1 1 22 22 SER C C 22 180.152 180.152 176.941 3.211 18792 13005 1 17 . 1 1 22 22 SER CA C 22 61.287 61.287 60.371 0.916 18792 13006 1 17 . 1 1 22 22 SER H H 22 8.266 8.266 7.312 0.954 18792 13007 1 17 . 1 1 23 23 GLN N N 23 122.497 122.497 121.188 1.309 18792 13008 1 17 . 1 1 23 23 GLN C C 23 177.297 177.297 176.975 0.322 18792 13009 1 17 . 1 1 23 23 GLN CA C 23 57.942 57.942 57.063 0.879 18792 13010 1 17 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.537 -0.726 18792 13011 1 17 . 1 1 23 23 GLN H H 23 7.571 7.571 7.596 -0.025 18792 13012 1 17 . 1 1 24 24 LYS N N 24 116.038 116.038 117.582 -1.544 18792 13013 1 17 . 1 1 24 24 LYS C C 24 175.704 175.704 175.644 0.060 18792 13014 1 17 . 1 1 24 24 LYS CA C 24 53.495 53.495 55.158 -1.663 18792 13015 1 17 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.075 -1.846 18792 13016 1 17 . 1 1 24 24 LYS H H 24 7.134 7.134 7.572 -0.438 18792 13017 1 17 . 1 1 25 25 GLY N N 25 105.283 105.283 106.206 -0.923 18792 13018 1 17 . 1 1 25 25 GLY C C 25 174.013 174.013 173.326 0.687 18792 13019 1 17 . 1 1 25 25 GLY CA C 25 44.779 44.779 45.810 -1.031 18792 13020 1 17 . 1 1 25 25 GLY H H 25 7.483 7.483 7.563 -0.080 18792 13021 1 17 . 1 1 26 26 TYR N N 26 119.547 119.547 120.142 -0.595 18792 13022 1 17 . 1 1 26 26 TYR C C 26 175.122 175.122 174.154 0.968 18792 13023 1 17 . 1 1 26 26 TYR CA C 26 55.132 55.132 57.338 -2.206 18792 13024 1 17 . 1 1 26 26 TYR CB C 26 40.080 40.080 41.081 -1.001 18792 13025 1 17 . 1 1 26 26 TYR H H 26 7.788 7.788 7.579 0.209 18792 13026 1 17 . 1 1 27 27 SER N N 27 115.088 115.088 122.000 -6.912 18792 13027 1 17 . 1 1 27 27 SER C C 27 174.452 174.452 175.950 -1.498 18792 13028 1 17 . 1 1 27 27 SER CA C 27 56.306 56.306 59.170 -2.864 18792 13029 1 17 . 1 1 27 27 SER CB C 27 63.921 63.921 63.352 0.569 18792 13030 1 17 . 1 1 27 27 SER H H 27 8.473 8.473 9.055 -0.582 18792 13031 1 17 . 1 1 28 28 TRP N N 28 127.014 127.014 126.827 0.187 18792 13032 1 17 . 1 1 28 28 TRP C C 28 177.002 177.002 178.766 -1.764 18792 13033 1 17 . 1 1 28 28 TRP CA C 28 59.472 59.472 60.420 -0.948 18792 13034 1 17 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.624 1.206 18792 13035 1 17 . 1 1 28 28 TRP H H 28 8.897 8.897 8.323 0.574 18792 13036 1 17 . 1 1 29 29 SER N N 29 112.044 112.044 114.026 -1.982 18792 13037 1 17 . 1 1 29 29 SER C C 29 175.106 175.106 175.990 -0.884 18792 13038 1 17 . 1 1 29 29 SER CA C 29 59.472 59.472 60.388 -0.916 18792 13039 1 17 . 1 1 29 29 SER CB C 29 62.226 62.226 62.863 -0.637 18792 13040 1 17 . 1 1 29 29 SER H H 29 8.129 8.129 8.268 -0.139 18792 13041 1 17 . 1 1 30 30 GLN N N 30 119.160 119.160 119.809 -0.649 18792 13042 1 17 . 1 1 30 30 GLN C C 30 176.218 176.218 176.350 -0.132 18792 13043 1 17 . 1 1 30 30 GLN CA C 30 56.412 56.412 57.267 -0.855 18792 13044 1 17 . 1 1 30 30 GLN CB C 30 27.578 27.578 29.033 -1.455 18792 13045 1 17 . 1 1 30 30 GLN H H 30 7.370 7.370 7.812 -0.442 18792 13046 1 17 . 1 1 31 31 PHE N N 31 116.277 116.277 117.594 -1.317 18792 13047 1 17 . 1 1 31 31 PHE C C 31 175.217 175.217 175.292 -0.075 18792 13048 1 17 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.596 -2.362 18792 13049 1 17 . 1 1 31 31 PHE CB C 31 39.066 39.066 37.408 1.658 18792 13050 1 17 . 1 1 31 31 PHE H H 31 7.248 7.248 7.640 -0.392 18792 13051 1 17 . 1 1 32 32 SER N N 32 113.683 113.683 117.096 -3.413 18792 13052 1 17 . 1 1 32 32 SER C C 32 173.793 173.793 175.022 -1.229 18792 13053 1 17 . 1 1 32 32 SER CA C 32 57.124 57.124 60.356 -3.232 18792 13054 1 17 . 1 1 32 32 SER CB C 32 63.081 63.081 62.459 0.622 18792 13055 1 17 . 1 1 32 32 SER H H 32 7.242 7.242 8.310 -1.068 18792 13056 1 17 . 1 1 33 33 ASP N N 33 122.195 122.195 126.915 -4.720 18792 13057 1 17 . 1 1 33 33 ASP C C 33 176.394 176.394 175.745 0.649 18792 13058 1 17 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.339 -1.591 18792 13059 1 17 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.138 0.260 18792 13060 1 17 . 1 1 33 33 ASP H H 33 8.257 8.257 8.700 -0.443 18792 13061 1 17 . 1 1 34 34 VAL N N 34 118.913 118.913 113.798 5.115 18792 13062 1 17 . 1 1 34 34 VAL C C 34 176.328 176.328 176.133 0.195 18792 13063 1 17 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.780 -0.889 18792 13064 1 17 . 1 1 34 34 VAL CB C 34 32.015 32.015 30.113 1.902 18792 13065 1 17 . 1 1 34 34 VAL H H 34 7.852 7.852 7.871 -0.019 18792 13066 1 17 . 1 1 35 35 GLU N N 35 124.205 124.205 117.704 6.501 18792 13067 1 17 . 1 1 35 35 GLU C C 35 176.586 176.586 175.987 0.599 18792 13068 1 17 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.822 -1.765 18792 13069 1 17 . 1 1 35 35 GLU CB C 35 28.898 28.898 29.512 -0.614 18792 13070 1 17 . 1 1 35 35 GLU H H 35 8.401 8.401 7.585 0.816 18792 13071 1 17 . 1 1 36 36 GLU N N 36 121.670 121.670 118.502 3.168 18792 13072 1 17 . 1 1 36 36 GLU C C 36 176.218 176.218 176.037 0.181 18792 13073 1 17 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.931 -0.943 18792 13074 1 17 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.458 -1.016 18792 13075 1 17 . 1 1 36 36 GLU H H 36 8.239 8.239 8.833 -0.594 18792 13076 1 17 . 1 1 37 37 ASN N N 37 119.252 119.252 118.315 0.937 18792 13077 1 17 . 1 1 37 37 ASN C C 37 175.003 175.003 174.106 0.897 18792 13078 1 17 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.533 -0.878 18792 13079 1 17 . 1 1 37 37 ASN CB C 37 38.212 38.212 38.425 -0.213 18792 13080 1 17 . 1 1 37 37 ASN H H 37 8.412 8.412 8.248 0.164 18792 13081 1 17 . 1 1 38 38 ARG N N 38 121.622 121.622 120.892 0.730 18792 13082 1 17 . 1 1 38 38 ARG C C 38 176.610 176.610 174.638 1.972 18792 13083 1 17 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.180 -0.816 18792 13084 1 17 . 1 1 38 38 ARG CB C 38 29.419 29.419 32.916 -3.497 18792 13085 1 17 . 1 1 38 38 ARG H H 38 8.227 8.227 7.856 0.371 18792 13086 1 17 . 1 1 39 39 THR N N 39 115.681 115.681 111.842 3.839 18792 13087 1 17 . 1 1 39 39 THR C C 39 174.500 174.500 173.335 1.165 18792 13088 1 17 . 1 1 39 39 THR CA C 39 61.606 61.606 61.715 -0.109 18792 13089 1 17 . 1 1 39 39 THR CB C 39 69.163 69.163 69.021 0.142 18792 13090 1 17 . 1 1 39 39 THR H H 39 8.173 8.173 8.085 0.088 18792 13091 1 17 . 1 1 40 40 GLU N N 40 122.708 122.708 121.196 1.512 18792 13092 1 17 . 1 1 40 40 GLU C C 40 175.728 175.728 174.654 1.074 18792 13093 1 17 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.538 -0.766 18792 13094 1 17 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.164 -0.110 18792 13095 1 17 . 1 1 40 40 GLU H H 40 8.298 8.298 8.345 -0.047 18792 13096 1 17 . 1 1 41 41 ALA N N 41 125.922 125.922 121.155 4.767 18792 13097 1 17 . 1 1 41 41 ALA C C 41 175.557 175.557 176.299 -0.742 18792 13098 1 17 . 1 1 41 41 ALA CA C 41 49.973 49.973 50.244 -0.271 18792 13099 1 17 . 1 1 41 41 ALA CB C 41 17.245 17.245 18.977 -1.732 18792 13100 1 17 . 1 1 41 41 ALA H H 41 8.212 8.212 7.901 0.311 18792 13101 1 17 . 1 1 43 43 GLU N N 43 120.783 120.783 118.073 2.710 18792 13102 1 17 . 1 1 43 43 GLU C C 43 177.174 177.174 176.593 0.581 18792 13103 1 17 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.764 -0.423 18792 13104 1 17 . 1 1 43 43 GLU CB C 43 29.287 29.287 28.242 1.045 18792 13105 1 17 . 1 1 43 43 GLU H H 43 8.519 8.519 8.366 0.153 18792 13106 1 17 . 1 1 44 44 GLY N N 44 110.022 110.022 108.506 1.516 18792 13107 1 17 . 1 1 44 44 GLY C C 44 174.773 174.773 174.114 0.659 18792 13108 1 17 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.275 -0.247 18792 13109 1 17 . 1 1 44 44 GLY H H 44 8.429 8.429 8.490 -0.061 18792 13110 1 17 . 1 1 45 45 THR N N 45 112.790 112.790 112.006 0.784 18792 13111 1 17 . 1 1 45 45 THR C C 45 175.726 175.726 174.262 1.464 18792 13112 1 17 . 1 1 45 45 THR CA C 45 61.987 61.987 62.287 -0.300 18792 13113 1 17 . 1 1 45 45 THR CB C 45 69.304 69.304 69.675 -0.371 18792 13114 1 17 . 1 1 45 45 THR H H 45 8.125 8.125 7.954 0.171 18792 13115 1 17 . 1 1 46 46 GLU N N 46 122.752 122.752 120.831 1.921 18792 13116 1 17 . 1 1 46 46 GLU C C 46 177.419 177.419 176.077 1.342 18792 13117 1 17 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.747 0.484 18792 13118 1 17 . 1 1 46 46 GLU CB C 46 28.199 28.199 30.011 -1.812 18792 13119 1 17 . 1 1 46 46 GLU H H 46 8.765 8.765 8.427 0.338 18792 13120 1 17 . 1 1 47 47 SER N N 47 114.895 114.895 112.576 2.319 18792 13121 1 17 . 1 1 47 47 SER C C 47 175.826 175.826 174.991 0.835 18792 13122 1 17 . 1 1 47 47 SER CA C 47 58.582 58.582 58.275 0.307 18792 13123 1 17 . 1 1 47 47 SER CB C 47 62.537 62.537 63.151 -0.614 18792 13124 1 17 . 1 1 47 47 SER H H 47 8.355 8.355 7.990 0.365 18792 13125 1 17 . 1 1 48 48 GLU N N 48 122.429 122.429 122.971 -0.542 18792 13126 1 17 . 1 1 48 48 GLU C C 48 178.099 178.099 177.520 0.579 18792 13127 1 17 . 1 1 48 48 GLU CA C 48 58.618 58.618 58.511 0.106 18792 13128 1 17 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.257 -0.782 18792 13129 1 17 . 1 1 48 48 GLU H H 48 8.139 8.139 9.024 -0.885 18792 13130 1 17 . 1 1 49 49 ALA N N 49 120.374 120.374 123.130 -2.756 18792 13131 1 17 . 1 1 49 49 ALA C C 49 180.843 180.843 179.351 1.492 18792 13132 1 17 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.039 -0.556 18792 13133 1 17 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.223 -0.787 18792 13134 1 17 . 1 1 49 49 ALA H H 49 8.079 8.079 8.426 -0.347 18792 13135 1 17 . 1 1 50 50 VAL N N 50 118.599 118.599 118.520 0.079 18792 13136 1 17 . 1 1 50 50 VAL C C 50 176.921 176.921 177.738 -0.817 18792 13137 1 17 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.496 0.063 18792 13138 1 17 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.709 -0.412 18792 13139 1 17 . 1 1 50 50 VAL H H 50 7.419 7.419 8.106 -0.687 18792 13140 1 17 . 1 1 51 51 LYS N N 51 117.469 117.469 121.246 -3.777 18792 13141 1 17 . 1 1 51 51 LYS C C 51 179.061 179.061 178.418 0.643 18792 13142 1 17 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.913 -0.690 18792 13143 1 17 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.078 -1.082 18792 13144 1 17 . 1 1 51 51 LYS H H 51 7.359 7.359 7.877 -0.518 18792 13145 1 17 . 1 1 52 52 GLN N N 52 115.930 115.930 118.450 -2.520 18792 13146 1 17 . 1 1 52 52 GLN C C 52 177.713 177.713 177.497 0.216 18792 13147 1 17 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.480 -0.004 18792 13148 1 17 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.624 -2.056 18792 13149 1 17 . 1 1 52 52 GLN H H 52 8.025 8.025 8.022 0.003 18792 13150 1 17 . 1 1 53 53 ALA N N 53 119.782 119.782 121.622 -1.840 18792 13151 1 17 . 1 1 53 53 ALA C C 53 180.008 180.008 179.270 0.738 18792 13152 1 17 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.077 0.308 18792 13153 1 17 . 1 1 53 53 ALA CB C 53 17.515 17.515 17.794 -0.280 18792 13154 1 17 . 1 1 53 53 ALA H H 53 7.655 7.655 7.511 0.144 18792 13155 1 17 . 1 1 54 54 LEU N N 54 120.443 120.443 119.061 1.382 18792 13156 1 17 . 1 1 54 54 LEU C C 54 179.330 179.330 177.789 1.541 18792 13157 1 17 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.611 1.402 18792 13158 1 17 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.920 -1.058 18792 13159 1 17 . 1 1 54 54 LEU H H 54 8.419 8.419 7.969 0.450 18792 13160 1 17 . 1 1 55 55 ARG N N 55 118.423 118.423 120.121 -1.698 18792 13161 1 17 . 1 1 55 55 ARG C C 55 178.767 178.767 178.120 0.647 18792 13162 1 17 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.651 0.746 18792 13163 1 17 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.012 -1.269 18792 13164 1 17 . 1 1 55 55 ARG H H 55 8.062 8.062 8.076 -0.014 18792 13165 1 17 . 1 1 56 56 GLU N N 56 115.988 115.988 118.230 -2.242 18792 13166 1 17 . 1 1 56 56 GLU C C 56 180.090 180.090 178.451 1.639 18792 13167 1 17 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.322 -0.562 18792 13168 1 17 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.413 -1.059 18792 13169 1 17 . 1 1 56 56 GLU H H 56 7.772 7.772 8.324 -0.552 18792 13170 1 17 . 1 1 57 57 ALA N N 57 122.837 122.837 122.120 0.717 18792 13171 1 17 . 1 1 57 57 ALA C C 57 181.861 181.861 179.306 2.555 18792 13172 1 17 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.581 0.053 18792 13173 1 17 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.297 0.175 18792 13174 1 17 . 1 1 57 57 ALA H H 57 8.774 8.774 7.295 1.479 18792 13175 1 17 . 1 1 58 58 GLY N N 58 108.409 108.409 106.193 2.216 18792 13176 1 17 . 1 1 58 58 GLY C C 58 175.331 175.331 175.615 -0.284 18792 13177 1 17 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.505 0.163 18792 13178 1 17 . 1 1 58 58 GLY H H 58 9.073 9.073 7.936 1.137 18792 13179 1 17 . 1 1 59 59 ASP N N 59 122.074 122.074 121.909 0.165 18792 13180 1 17 . 1 1 59 59 ASP C C 59 179.023 179.023 177.780 1.243 18792 13181 1 17 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.547 -0.245 18792 13182 1 17 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.009 -2.167 18792 13183 1 17 . 1 1 59 59 ASP H H 59 8.049 8.049 7.947 0.102 18792 13184 1 17 . 1 1 60 60 GLU N N 60 120.131 120.131 120.191 -0.060 18792 13185 1 17 . 1 1 60 60 GLU C C 60 178.522 178.522 178.285 0.237 18792 13186 1 17 . 1 1 60 60 GLU CA C 60 59.009 59.009 58.914 0.095 18792 13187 1 17 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.467 -1.268 18792 13188 1 17 . 1 1 60 60 GLU H H 60 8.136 8.136 8.052 0.084 18792 13189 1 17 . 1 1 61 61 PHE N N 61 121.309 121.309 119.852 1.457 18792 13190 1 17 . 1 1 61 61 PHE C C 61 176.904 176.904 177.422 -0.518 18792 13191 1 17 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.476 -0.154 18792 13192 1 17 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.430 -0.821 18792 13193 1 17 . 1 1 61 61 PHE H H 61 8.523 8.523 7.983 0.540 18792 13194 1 17 . 1 1 62 62 GLU N N 62 115.971 115.971 119.300 -3.329 18792 13195 1 17 . 1 1 62 62 GLU C C 62 177.713 177.713 177.464 0.249 18792 13196 1 17 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.478 -0.287 18792 13197 1 17 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.062 -0.785 18792 13198 1 17 . 1 1 62 62 GLU H H 62 7.969 7.969 8.128 -0.159 18792 13199 1 17 . 1 1 63 63 LEU N N 63 116.703 116.703 119.936 -3.233 18792 13200 1 17 . 1 1 63 63 LEU C C 63 178.963 178.963 178.645 0.318 18792 13201 1 17 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.042 -0.630 18792 13202 1 17 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.608 -1.202 18792 13203 1 17 . 1 1 63 63 LEU H H 63 7.347 7.347 7.681 -0.334 18792 13204 1 17 . 1 1 64 64 ARG N N 64 117.453 117.453 117.910 -0.457 18792 13205 1 17 . 1 1 64 64 ARG C C 64 177.297 177.297 176.752 0.545 18792 13206 1 17 . 1 1 64 64 ARG CA C 64 57.337 57.337 57.371 -0.034 18792 13207 1 17 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.126 -1.529 18792 13208 1 17 . 1 1 64 64 ARG H H 64 7.995 7.995 7.792 0.203 18792 13209 1 17 . 1 1 65 65 TYR N N 65 118.956 118.956 116.678 2.278 18792 13210 1 17 . 1 1 65 65 TYR C C 65 175.278 175.278 175.319 -0.041 18792 13211 1 17 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.818 -3.117 18792 13212 1 17 . 1 1 65 65 TYR CB C 65 35.986 35.986 35.102 0.884 18792 13213 1 17 . 1 1 65 65 TYR H H 65 7.909 7.909 7.370 0.539 18792 13214 1 17 . 1 1 66 66 ARG N N 66 119.438 119.438 120.723 -1.285 18792 13215 1 17 . 1 1 66 66 ARG C C 66 178.424 178.424 177.822 0.602 18792 13216 1 17 . 1 1 66 66 ARG CA C 66 58.476 58.476 57.279 1.197 18792 13217 1 17 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.743 -1.922 18792 13218 1 17 . 1 1 66 66 ARG H H 66 7.244 7.244 7.545 -0.301 18792 13219 1 17 . 1 1 67 67 ARG N N 67 118.936 118.936 120.025 -1.089 18792 13220 1 17 . 1 1 67 67 ARG C C 67 177.542 177.542 178.219 -0.677 18792 13221 1 17 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.299 -1.855 18792 13222 1 17 . 1 1 67 67 ARG CB C 67 28.121 28.121 30.003 -1.882 18792 13223 1 17 . 1 1 67 67 ARG H H 67 8.417 8.417 8.851 -0.434 18792 13224 1 17 . 1 1 68 68 ALA N N 68 121.797 121.797 121.679 0.118 18792 13225 1 17 . 1 1 68 68 ALA C C 68 180.337 180.337 179.050 1.287 18792 13226 1 17 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.740 -0.604 18792 13227 1 17 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.644 -1.177 18792 13228 1 17 . 1 1 68 68 ALA H H 68 7.827 7.827 8.503 -0.676 18792 13229 1 17 . 1 1 69 69 PHE N N 69 115.986 115.986 118.397 -2.411 18792 13230 1 17 . 1 1 69 69 PHE C C 69 177.468 177.468 177.266 0.202 18792 13231 1 17 . 1 1 69 69 PHE CA C 69 58.049 58.049 60.840 -2.792 18792 13232 1 17 . 1 1 69 69 PHE CB C 69 37.599 37.599 39.839 -2.240 18792 13233 1 17 . 1 1 69 69 PHE H H 69 8.517 8.517 8.254 0.263 18792 13234 1 17 . 1 1 70 70 SER N N 70 116.526 116.526 117.271 -0.745 18792 13235 1 17 . 1 1 70 70 SER C C 70 177.640 177.640 176.359 1.281 18792 13236 1 17 . 1 1 70 70 SER CA C 70 61.073 61.073 62.285 -1.212 18792 13237 1 17 . 1 1 70 70 SER CB C 70 61.993 61.993 63.100 -1.107 18792 13238 1 17 . 1 1 70 70 SER H H 70 8.152 8.152 8.151 0.001 18792 13239 1 17 . 1 1 71 71 ASP N N 71 121.181 121.181 121.505 -0.324 18792 13240 1 17 . 1 1 71 71 ASP C C 71 178.546 178.546 178.630 -0.084 18792 13241 1 17 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.402 -0.954 18792 13242 1 17 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.758 -1.526 18792 13243 1 17 . 1 1 71 71 ASP H H 71 8.356 8.356 7.799 0.557 18792 13244 1 17 . 1 1 72 72 LEU N N 72 120.747 120.747 120.558 0.189 18792 13245 1 17 . 1 1 72 72 LEU C C 72 178.963 178.963 178.422 0.541 18792 13246 1 17 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.166 -0.722 18792 13247 1 17 . 1 1 72 72 LEU CB C 72 41.017 41.017 41.995 -0.978 18792 13248 1 17 . 1 1 72 72 LEU H H 72 7.738 7.738 7.453 0.285 18792 13249 1 17 . 1 1 73 73 THR N N 73 109.432 109.432 114.476 -5.044 18792 13250 1 17 . 1 1 73 73 THR C C 73 177.481 177.481 176.201 1.280 18792 13251 1 17 . 1 1 73 73 THR CA C 73 65.128 65.128 66.032 -0.904 18792 13252 1 17 . 1 1 73 73 THR CB C 73 67.720 67.720 68.393 -0.673 18792 13253 1 17 . 1 1 73 73 THR H H 73 8.296 8.296 7.980 0.316 18792 13254 1 17 . 1 1 74 74 SER N N 74 115.862 115.862 115.834 0.028 18792 13255 1 17 . 1 1 74 74 SER C C 74 175.361 175.361 175.682 -0.321 18792 13256 1 17 . 1 1 74 74 SER CA C 74 60.112 60.112 60.918 -0.806 18792 13257 1 17 . 1 1 74 74 SER CB C 74 62.537 62.537 63.024 -0.487 18792 13258 1 17 . 1 1 74 74 SER H H 74 7.629 7.629 8.138 -0.509 18792 13259 1 17 . 1 1 75 75 GLN N N 75 118.551 118.551 118.596 -0.045 18792 13260 1 17 . 1 1 75 75 GLN C C 75 176.316 176.316 176.088 0.228 18792 13261 1 17 . 1 1 75 75 GLN CA C 75 56.804 56.804 55.878 0.926 18792 13262 1 17 . 1 1 75 75 GLN CB C 75 28.277 28.277 28.962 -0.685 18792 13263 1 17 . 1 1 75 75 GLN H H 75 7.640 7.640 7.240 0.400 18792 13264 1 17 . 1 1 76 76 LEU N N 76 118.313 118.313 115.991 2.322 18792 13265 1 17 . 1 1 76 76 LEU C C 76 174.160 174.160 176.871 -2.711 18792 13266 1 17 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.408 -0.668 18792 13267 1 17 . 1 1 76 76 LEU CB C 76 42.727 42.727 38.469 4.258 18792 13268 1 17 . 1 1 76 76 LEU H H 76 7.411 7.411 7.364 0.047 18792 13269 1 17 . 1 1 77 77 HIS N N 77 120.104 120.104 115.968 4.136 18792 13270 1 17 . 1 1 77 77 HIS C C 77 174.528 174.528 175.692 -1.164 18792 13271 1 17 . 1 1 77 77 HIS CA C 77 54.207 54.207 58.883 -4.676 18792 13272 1 17 . 1 1 77 77 HIS CB C 77 27.966 27.966 30.146 -2.180 18792 13273 1 17 . 1 1 77 77 HIS H H 77 8.117 8.117 7.545 0.572 18792 13274 1 17 . 1 1 78 78 ILE N N 78 122.298 122.298 115.066 7.232 18792 13275 1 17 . 1 1 78 78 ILE C C 78 174.240 174.240 174.392 -0.152 18792 13276 1 17 . 1 1 78 78 ILE CA C 78 61.402 61.402 60.485 0.917 18792 13277 1 17 . 1 1 78 78 ILE CB C 78 37.591 37.591 39.419 -1.827 18792 13278 1 17 . 1 1 78 78 ILE H H 78 8.655 8.655 7.645 1.010 18792 13279 1 17 . 1 1 79 79 THR N N 79 116.442 116.442 120.188 -3.746 18792 13280 1 17 . 1 1 79 79 THR C C 79 174.291 174.291 173.104 1.187 18792 13281 1 17 . 1 1 79 79 THR CA C 79 61.632 61.632 63.101 -1.469 18792 13282 1 17 . 1 1 79 79 THR CB C 79 68.704 68.704 68.397 0.307 18792 13283 1 17 . 1 1 79 79 THR H H 79 8.245 8.245 8.586 -0.341 18792 13284 1 17 . 1 1 84 84 TYR N N 84 120.888 120.888 122.483 -1.595 18792 13285 1 17 . 1 1 84 84 TYR C C 84 176.708 176.708 176.388 0.320 18792 13286 1 17 . 1 1 84 84 TYR CA C 84 60.432 60.432 59.770 0.662 18792 13287 1 17 . 1 1 84 84 TYR CB C 84 36.745 36.745 36.739 0.006 18792 13288 1 17 . 1 1 84 84 TYR H H 84 8.733 8.733 8.350 0.383 18792 13289 1 17 . 1 1 85 85 GLN N N 85 114.530 114.530 118.231 -3.701 18792 13290 1 17 . 1 1 85 85 GLN C C 85 178.473 178.473 178.293 0.180 18792 13291 1 17 . 1 1 85 85 GLN CA C 85 59.294 59.294 58.539 0.755 18792 13292 1 17 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.466 -0.665 18792 13293 1 17 . 1 1 85 85 GLN H H 85 8.413 8.413 7.494 0.919 18792 13294 1 17 . 1 1 86 86 SER N N 86 114.032 114.032 114.589 -0.557 18792 13295 1 17 . 1 1 86 86 SER C C 86 178.473 178.473 176.102 2.371 18792 13296 1 17 . 1 1 86 86 SER CA C 86 62.175 62.175 61.266 0.909 18792 13297 1 17 . 1 1 86 86 SER CB C 86 63.252 63.252 62.713 0.539 18792 13298 1 17 . 1 1 86 86 SER H H 86 7.258 7.258 7.249 0.009 18792 13299 1 17 . 1 1 88 88 GLU N N 88 119.386 119.386 119.367 0.019 18792 13300 1 17 . 1 1 88 88 GLU C C 88 177.199 177.199 179.182 -1.983 18792 13301 1 17 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.986 -1.405 18792 13302 1 17 . 1 1 88 88 GLU CB C 88 28.976 28.976 28.874 0.102 18792 13303 1 17 . 1 1 88 88 GLU H H 88 8.534 8.534 7.538 0.996 18792 13304 1 17 . 1 1 89 89 GLN N N 89 114.678 114.678 118.441 -3.763 18792 13305 1 17 . 1 1 89 89 GLN C C 89 178.669 178.669 178.801 -0.132 18792 13306 1 17 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.783 -0.201 18792 13307 1 17 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.633 -1.211 18792 13308 1 17 . 1 1 89 89 GLN H H 89 7.500 7.500 7.625 -0.125 18792 13309 1 17 . 1 1 90 90 VAL N N 90 118.174 118.174 120.655 -2.481 18792 13310 1 17 . 1 1 90 90 VAL C C 90 178.081 178.081 178.558 -0.477 18792 13311 1 17 . 1 1 90 90 VAL CA C 90 65.555 65.555 66.451 -0.896 18792 13312 1 17 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.590 -0.983 18792 13313 1 17 . 1 1 90 90 VAL H H 90 7.017 7.017 7.652 -0.635 18792 13314 1 17 . 1 1 91 91 VAL N N 91 119.489 119.489 120.895 -1.406 18792 13315 1 17 . 1 1 91 91 VAL C C 91 177.914 177.914 178.291 -0.377 18792 13316 1 17 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.631 -0.862 18792 13317 1 17 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.922 -0.631 18792 13318 1 17 . 1 1 91 91 VAL H H 91 7.833 7.833 8.710 -0.877 18792 13319 1 17 . 1 1 92 92 ASN N N 92 117.180 117.180 117.839 -0.659 18792 13320 1 17 . 1 1 92 92 ASN C C 92 179.110 179.110 177.177 1.933 18792 13321 1 17 . 1 1 92 92 ASN CA C 92 54.918 54.918 55.735 -0.817 18792 13322 1 17 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.797 -2.829 18792 13323 1 17 . 1 1 92 92 ASN H H 92 8.368 8.368 8.509 -0.141 18792 13324 1 17 . 1 1 93 93 GLU N N 93 118.476 118.476 119.666 -1.190 18792 13325 1 17 . 1 1 93 93 GLU C C 93 179.355 179.355 179.359 -0.004 18792 13326 1 17 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.204 -0.799 18792 13327 1 17 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.136 -2.403 18792 13328 1 17 . 1 1 93 93 GLU H H 93 7.213 7.213 8.036 -0.823 18792 13329 1 17 . 1 1 94 94 LEU N N 94 120.889 120.889 120.709 0.180 18792 13330 1 17 . 1 1 94 94 LEU C C 94 178.473 178.473 178.716 -0.243 18792 13331 1 17 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.354 -0.337 18792 13332 1 17 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.960 -2.030 18792 13333 1 17 . 1 1 94 94 LEU H H 94 7.446 7.446 8.453 -1.007 18792 13334 1 17 . 1 1 95 95 PHE N N 95 112.902 112.902 118.652 -5.750 18792 13335 1 17 . 1 1 95 95 PHE C C 95 176.586 176.586 176.144 0.442 18792 13336 1 17 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.998 -2.839 18792 13337 1 17 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.035 -0.814 18792 13338 1 17 . 1 1 95 95 PHE H H 95 6.916 6.916 8.052 -1.136 18792 13339 1 17 . 1 1 96 96 ARG N N 96 123.729 123.729 117.617 6.112 18792 13340 1 17 . 1 1 96 96 ARG C C 96 177.272 177.272 177.791 -0.519 18792 13341 1 17 . 1 1 96 96 ARG CA C 96 59.223 59.223 57.929 1.294 18792 13342 1 17 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.252 -1.820 18792 13343 1 17 . 1 1 96 96 ARG H H 96 7.126 7.126 7.617 -0.491 18792 13344 1 17 . 1 1 97 97 ASP N N 97 116.576 116.576 117.180 -0.604 18792 13345 1 17 . 1 1 97 97 ASP C C 97 175.687 175.687 176.544 -0.857 18792 13346 1 17 . 1 1 97 97 ASP CA C 97 53.673 53.673 55.869 -2.196 18792 13347 1 17 . 1 1 97 97 ASP CB C 97 40.045 40.045 41.244 -1.199 18792 13348 1 17 . 1 1 97 97 ASP H H 97 8.644 8.644 7.772 0.872 18792 13349 1 17 . 1 1 98 98 GLY N N 98 108.551 108.551 105.883 2.668 18792 13350 1 17 . 1 1 98 98 GLY C C 98 172.690 172.690 172.827 -0.137 18792 13351 1 17 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.553 -2.304 18792 13352 1 17 . 1 1 98 98 GLY H H 98 7.463 7.463 7.319 0.144 18792 13353 1 17 . 1 1 99 99 VAL N N 99 120.630 120.630 117.688 2.942 18792 13354 1 17 . 1 1 99 99 VAL C C 99 174.503 174.503 173.933 0.570 18792 13355 1 17 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.328 -1.010 18792 13356 1 17 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.950 -2.187 18792 13357 1 17 . 1 1 99 99 VAL H H 99 8.184 8.184 8.199 -0.015 18792 13358 1 17 . 1 1 100 100 ASN N N 100 115.485 115.485 117.491 -2.006 18792 13359 1 17 . 1 1 100 100 ASN C C 100 175.239 175.239 176.854 -1.615 18792 13360 1 17 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.419 -3.058 18792 13361 1 17 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.742 0.178 18792 13362 1 17 . 1 1 100 100 ASN H H 100 6.241 6.241 7.988 -1.747 18792 13363 1 17 . 1 1 101 101 TRP N N 101 118.266 118.266 120.561 -2.295 18792 13364 1 17 . 1 1 101 101 TRP C C 101 178.301 178.301 176.188 2.113 18792 13365 1 17 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.517 1.022 18792 13366 1 17 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.811 1.019 18792 13367 1 17 . 1 1 101 101 TRP H H 101 8.409 8.409 8.638 -0.229 18792 13368 1 17 . 1 1 102 102 GLY N N 102 106.147 106.147 107.278 -1.131 18792 13369 1 17 . 1 1 102 102 GLY C C 102 177.640 177.640 175.488 2.152 18792 13370 1 17 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.377 2.537 18792 13371 1 17 . 1 1 102 102 GLY H H 102 8.504 8.504 7.472 1.032 18792 13372 1 17 . 1 1 103 103 ARG N N 103 121.347 121.347 121.377 -0.030 18792 13373 1 17 . 1 1 103 103 ARG C C 103 177.738 177.738 178.058 -0.320 18792 13374 1 17 . 1 1 103 103 ARG CA C 103 57.942 57.942 59.431 -1.490 18792 13375 1 17 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.395 -0.176 18792 13376 1 17 . 1 1 103 103 ARG H H 103 8.099 8.099 8.149 -0.050 18792 13377 1 17 . 1 1 104 104 ILE N N 104 120.930 120.930 120.117 0.813 18792 13378 1 17 . 1 1 104 104 ILE C C 104 178.197 178.197 177.754 0.443 18792 13379 1 17 . 1 1 104 104 ILE CA C 104 66.535 66.535 65.084 1.451 18792 13380 1 17 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.233 -2.188 18792 13381 1 17 . 1 1 104 104 ILE H H 104 7.690 7.690 7.744 -0.054 18792 13382 1 17 . 1 1 105 105 VAL N N 105 120.938 120.938 118.783 2.155 18792 13383 1 17 . 1 1 105 105 VAL C C 105 177.854 177.854 177.399 0.455 18792 13384 1 17 . 1 1 105 105 VAL CA C 105 67.458 67.458 65.942 1.516 18792 13385 1 17 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.858 -0.484 18792 13386 1 17 . 1 1 105 105 VAL H H 105 8.245 8.245 7.498 0.747 18792 13387 1 17 . 1 1 106 106 ALA N N 106 121.165 121.165 120.589 0.576 18792 13388 1 17 . 1 1 106 106 ALA C C 106 178.284 178.284 178.439 -0.155 18792 13389 1 17 . 1 1 106 106 ALA CA C 106 54.598 54.598 53.252 1.346 18792 13390 1 17 . 1 1 106 106 ALA CB C 106 17.515 17.515 17.945 -0.430 18792 13391 1 17 . 1 1 106 106 ALA H H 106 7.529 7.529 7.200 0.329 18792 13392 1 17 . 1 1 107 107 PHE N N 107 119.242 119.242 119.750 -0.508 18792 13393 1 17 . 1 1 107 107 PHE C C 107 176.390 176.390 177.080 -0.690 18792 13394 1 17 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.171 0.002 18792 13395 1 17 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.705 -1.618 18792 13396 1 17 . 1 1 107 107 PHE H H 107 7.974 7.974 7.679 0.295 18792 13397 1 17 . 1 1 108 108 PHE N N 108 120.009 120.009 118.846 1.163 18792 13398 1 17 . 1 1 108 108 PHE C C 108 177.640 177.640 177.465 0.175 18792 13399 1 17 . 1 1 108 108 PHE CA C 108 62.424 62.424 62.256 0.168 18792 13400 1 17 . 1 1 108 108 PHE CB C 108 35.346 35.346 39.058 -3.712 18792 13401 1 17 . 1 1 108 108 PHE H H 108 7.946 7.946 8.192 -0.246 18792 13402 1 17 . 1 1 109 109 SER N N 109 114.631 114.631 115.374 -0.743 18792 13403 1 17 . 1 1 109 109 SER C C 109 177.770 177.770 176.574 1.196 18792 13404 1 17 . 1 1 109 109 SER CA C 109 63.349 63.349 61.147 2.202 18792 13405 1 17 . 1 1 109 109 SER H H 109 8.424 8.424 7.674 0.750 18792 13406 1 17 . 1 1 110 110 PHE N N 110 124.230 124.230 120.488 3.742 18792 13407 1 17 . 1 1 110 110 PHE C C 110 176.708 176.708 178.373 -1.665 18792 13408 1 17 . 1 1 110 110 PHE CA C 110 59.614 59.614 58.803 0.811 18792 13409 1 17 . 1 1 110 110 PHE CB C 110 37.444 37.444 37.971 -0.527 18792 13410 1 17 . 1 1 110 110 PHE H H 110 9.052 9.052 7.483 1.569 18792 13411 1 17 . 1 1 111 111 GLY N N 111 105.893 105.893 106.811 -0.918 18792 13412 1 17 . 1 1 111 111 GLY C C 111 176.795 176.795 175.974 0.821 18792 13413 1 17 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.307 1.069 18792 13414 1 17 . 1 1 111 111 GLY H H 111 7.926 7.926 8.667 -0.741 18792 13415 1 17 . 1 1 112 112 GLY N N 112 107.410 107.410 109.423 -2.013 18792 13416 1 17 . 1 1 112 112 GLY C C 112 174.650 174.650 175.384 -0.734 18792 13417 1 17 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.301 1.004 18792 13418 1 17 . 1 1 112 112 GLY H H 112 8.799 8.799 7.859 0.940 18792 13419 1 17 . 1 1 113 113 ALA N N 113 124.313 124.313 124.978 -0.665 18792 13420 1 17 . 1 1 113 113 ALA C C 113 181.300 181.300 178.971 2.329 18792 13421 1 17 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.999 -0.472 18792 13422 1 17 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.850 -1.367 18792 13423 1 17 . 1 1 113 113 ALA H H 113 8.212 8.212 7.809 0.403 18792 13424 1 17 . 1 1 114 114 LEU N N 114 118.878 118.878 118.662 0.216 18792 13425 1 17 . 1 1 114 114 LEU C C 114 180.286 180.286 178.844 1.442 18792 13426 1 17 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.711 -0.729 18792 13427 1 17 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.895 -0.878 18792 13428 1 17 . 1 1 114 114 LEU H H 114 8.161 8.161 7.838 0.323 18792 13429 1 17 . 1 1 115 115 CYS N N 115 119.002 119.002 116.859 2.143 18792 13430 1 17 . 1 1 115 115 CYS C C 115 176.087 176.087 177.001 -0.914 18792 13431 1 17 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.802 0.142 18792 13432 1 17 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.107 -1.472 18792 13433 1 17 . 1 1 115 115 CYS H H 115 8.070 8.070 7.811 0.259 18792 13434 1 17 . 1 1 116 116 VAL N N 116 118.737 118.737 120.430 -1.693 18792 13435 1 17 . 1 1 116 116 VAL C C 116 177.494 177.494 178.344 -0.850 18792 13436 1 17 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.448 0.314 18792 13437 1 17 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.171 -0.407 18792 13438 1 17 . 1 1 116 116 VAL H H 116 7.995 7.995 7.666 0.329 18792 13439 1 17 . 1 1 117 117 GLU N N 117 118.886 118.886 118.265 0.621 18792 13440 1 17 . 1 1 117 117 GLU C C 117 178.424 178.424 179.028 -0.604 18792 13441 1 17 . 1 1 117 117 GLU CA C 117 58.760 58.760 58.966 -0.206 18792 13442 1 17 . 1 1 117 117 GLU CB C 117 28.054 28.054 28.988 -0.934 18792 13443 1 17 . 1 1 117 117 GLU H H 117 8.059 8.059 7.895 0.164 18792 13444 1 17 . 1 1 118 118 SER N N 118 113.417 113.417 115.948 -2.531 18792 13445 1 17 . 1 1 118 118 SER C C 118 175.607 175.607 176.261 -0.654 18792 13446 1 17 . 1 1 118 118 SER CA C 118 62.638 62.638 61.496 1.142 18792 13447 1 17 . 1 1 118 118 SER CB C 118 61.061 61.061 62.834 -1.773 18792 13448 1 17 . 1 1 118 118 SER H H 118 7.626 7.626 7.730 -0.104 18792 13449 1 17 . 1 1 119 119 VAL N N 119 120.612 120.612 121.611 -0.999 18792 13450 1 17 . 1 1 119 119 VAL C C 119 179.713 179.713 177.890 1.823 18792 13451 1 17 . 1 1 119 119 VAL CA C 119 66.225 66.225 66.563 -0.338 18792 13452 1 17 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.138 -1.059 18792 13453 1 17 . 1 1 119 119 VAL H H 119 7.297 7.297 7.505 -0.208 18792 13454 1 17 . 1 1 120 120 ASP N N 120 122.546 122.546 118.707 3.839 18792 13455 1 17 . 1 1 120 120 ASP C C 120 178.057 178.057 177.623 0.434 18792 13456 1 17 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.643 0.346 18792 13457 1 17 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.557 -0.634 18792 13458 1 17 . 1 1 120 120 ASP H H 120 8.264 8.264 8.144 0.120 18792 13459 1 17 . 1 1 121 121 LYS N N 121 115.636 115.636 117.488 -1.852 18792 13460 1 17 . 1 1 121 121 LYS C C 121 175.159 175.159 175.927 -0.768 18792 13461 1 17 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.562 -1.302 18792 13462 1 17 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.061 -2.286 18792 13463 1 17 . 1 1 121 121 LYS H H 121 7.558 7.558 7.509 0.049 18792 13464 1 17 . 1 1 122 122 GLU N N 122 113.915 113.915 117.269 -3.354 18792 13465 1 17 . 1 1 122 122 GLU C C 122 176.109 176.109 175.592 0.517 18792 13466 1 17 . 1 1 122 122 GLU CA C 122 57.307 57.307 56.973 0.334 18792 13467 1 17 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.479 -3.147 18792 13468 1 17 . 1 1 122 122 GLU H H 122 7.826 7.826 7.748 0.078 18792 13469 1 17 . 1 1 124 124 GLN N N 124 119.233 119.233 119.153 0.080 18792 13470 1 17 . 1 1 124 124 GLN C C 124 177.640 177.640 177.609 0.031 18792 13471 1 17 . 1 1 124 124 GLN CA C 124 59.472 59.472 59.076 0.396 18792 13472 1 17 . 1 1 124 124 GLN CB C 124 26.490 26.490 29.231 -2.741 18792 13473 1 17 . 1 1 124 124 GLN H H 124 8.626 8.626 7.957 0.669 18792 13474 1 17 . 1 1 125 125 VAL N N 125 117.011 117.011 114.283 2.728 18792 13475 1 17 . 1 1 125 125 VAL C C 125 175.826 175.826 176.120 -0.294 18792 13476 1 17 . 1 1 125 125 VAL CA C 125 63.136 63.136 62.383 0.753 18792 13477 1 17 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.549 -1.252 18792 13478 1 17 . 1 1 125 125 VAL H H 125 7.870 7.870 7.906 -0.036 18792 13479 1 17 . 1 1 126 126 LEU N N 126 117.058 117.058 121.974 -4.916 18792 13480 1 17 . 1 1 126 126 LEU C C 126 178.096 178.096 178.308 -0.212 18792 13481 1 17 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.953 -2.868 18792 13482 1 17 . 1 1 126 126 LEU CB C 126 40.273 40.273 41.922 -1.649 18792 13483 1 17 . 1 1 126 126 LEU H H 126 7.747 7.747 8.160 -0.413 18792 13484 1 17 . 1 1 127 127 VAL N N 127 119.457 119.457 115.122 4.335 18792 13485 1 17 . 1 1 127 127 VAL C C 127 177.150 177.150 178.038 -0.888 18792 13486 1 17 . 1 1 127 127 VAL CA C 127 67.156 67.156 65.936 1.220 18792 13487 1 17 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.831 -1.078 18792 13488 1 17 . 1 1 127 127 VAL H H 127 7.306 7.306 8.406 -1.100 18792 13489 1 17 . 1 1 128 128 SER N N 128 110.647 110.647 115.467 -4.820 18792 13490 1 17 . 1 1 128 128 SER C C 128 177.222 177.222 176.686 0.536 18792 13491 1 17 . 1 1 128 128 SER CA C 128 60.752 60.752 61.658 -0.906 18792 13492 1 17 . 1 1 128 128 SER CB C 128 61.605 61.605 62.797 -1.192 18792 13493 1 17 . 1 1 128 128 SER H H 128 8.237 8.237 8.457 -0.220 18792 13494 1 17 . 1 1 129 129 ARG N N 129 123.100 123.100 122.137 0.963 18792 13495 1 17 . 1 1 129 129 ARG C C 129 175.802 175.802 178.708 -2.906 18792 13496 1 17 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.653 -0.426 18792 13497 1 17 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.255 -2.056 18792 13498 1 17 . 1 1 129 129 ARG H H 129 6.564 6.564 8.009 -1.445 18792 13499 1 17 . 1 1 130 130 ILE N N 130 118.182 118.182 120.256 -2.074 18792 13500 1 17 . 1 1 130 130 ILE C C 130 178.156 178.156 177.776 0.380 18792 13501 1 17 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.782 -1.436 18792 13502 1 17 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.679 -0.998 18792 13503 1 17 . 1 1 130 130 ILE H H 130 7.955 7.955 8.588 -0.633 18792 13504 1 17 . 1 1 131 131 ALA N N 131 119.029 119.029 121.422 -2.393 18792 13505 1 17 . 1 1 131 131 ALA C C 131 179.593 179.593 179.376 0.217 18792 13506 1 17 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.315 -0.717 18792 13507 1 17 . 1 1 131 131 ALA CB C 131 17.388 17.388 17.830 -0.442 18792 13508 1 17 . 1 1 131 131 ALA H H 131 7.582 7.582 8.716 -1.134 18792 13509 1 17 . 1 1 132 132 ALA N N 132 120.336 120.336 121.997 -1.661 18792 13510 1 17 . 1 1 132 132 ALA C C 132 181.095 181.095 179.112 1.983 18792 13511 1 17 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.697 -0.099 18792 13512 1 17 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.344 -1.643 18792 13513 1 17 . 1 1 132 132 ALA H H 132 7.224 7.224 7.518 -0.294 18792 13514 1 17 . 1 1 133 133 TRP N N 133 121.194 121.194 119.381 1.813 18792 13515 1 17 . 1 1 133 133 TRP C C 133 179.698 179.698 178.589 1.109 18792 13516 1 17 . 1 1 133 133 TRP CA C 133 57.302 57.302 59.900 -2.598 18792 13517 1 17 . 1 1 133 133 TRP CB C 133 27.655 27.655 30.011 -2.356 18792 13518 1 17 . 1 1 133 133 TRP H H 133 8.925 8.925 8.385 0.540 18792 13519 1 17 . 1 1 134 134 MET N N 134 116.987 116.987 119.723 -2.736 18792 13520 1 17 . 1 1 134 134 MET C C 134 178.277 178.277 177.747 0.530 18792 13521 1 17 . 1 1 134 134 MET CA C 134 59.578 59.578 59.206 0.372 18792 13522 1 17 . 1 1 134 134 MET CB C 134 33.559 33.559 32.648 0.911 18792 13523 1 17 . 1 1 134 134 MET H H 134 8.863 8.863 8.775 0.088 18792 13524 1 17 . 1 1 135 135 ALA N N 135 120.523 120.523 120.265 0.258 18792 13525 1 17 . 1 1 135 135 ALA C C 135 179.298 179.298 179.513 -0.215 18792 13526 1 17 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.077 0.356 18792 13527 1 17 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.136 -1.499 18792 13528 1 17 . 1 1 135 135 ALA H H 135 8.152 8.152 8.055 0.097 18792 13529 1 17 . 1 1 136 136 THR N N 136 116.715 116.715 117.863 -1.148 18792 13530 1 17 . 1 1 136 136 THR C C 136 175.106 175.106 176.458 -1.352 18792 13531 1 17 . 1 1 136 136 THR CA C 136 66.729 66.729 67.201 -0.472 18792 13532 1 17 . 1 1 136 136 THR CB C 136 68.441 68.441 69.129 -0.688 18792 13533 1 17 . 1 1 136 136 THR H H 136 8.532 8.532 7.732 0.800 18792 13534 1 17 . 1 1 137 137 TYR N N 137 123.204 123.204 122.581 0.623 18792 13535 1 17 . 1 1 137 137 TYR C C 137 179.592 179.592 177.716 1.876 18792 13536 1 17 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.812 1.253 18792 13537 1 17 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.591 -0.603 18792 13538 1 17 . 1 1 137 137 TYR H H 137 8.809 8.809 8.268 0.541 18792 13539 1 17 . 1 1 138 138 LEU N N 138 119.247 119.247 120.697 -1.450 18792 13540 1 17 . 1 1 138 138 LEU C C 138 178.385 178.385 178.218 0.167 18792 13541 1 17 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.415 0.523 18792 13542 1 17 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.202 -0.494 18792 13543 1 17 . 1 1 138 138 LEU H H 138 8.742 8.742 8.847 -0.105 18792 13544 1 17 . 1 1 139 139 ASN N N 139 117.122 117.122 116.645 0.477 18792 13545 1 17 . 1 1 139 139 ASN C C 139 176.417 176.417 177.087 -0.670 18792 13546 1 17 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.635 0.813 18792 13547 1 17 . 1 1 139 139 ASN CB C 139 38.652 38.652 37.790 0.862 18792 13548 1 17 . 1 1 139 139 ASN H H 139 8.307 8.307 8.050 0.257 18792 13549 1 17 . 1 1 140 140 ASP N N 140 115.394 115.394 120.026 -4.632 18792 13550 1 17 . 1 1 140 140 ASP C C 140 177.919 177.919 176.904 1.015 18792 13551 1 17 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.589 -0.636 18792 13552 1 17 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.825 -1.439 18792 13553 1 17 . 1 1 140 140 ASP H H 140 8.439 8.439 8.311 0.128 18792 13554 1 17 . 1 1 141 141 HIS N N 141 111.695 111.695 113.423 -1.728 18792 13555 1 17 . 1 1 141 141 HIS C C 141 175.949 175.949 175.924 0.025 18792 13556 1 17 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.379 -0.322 18792 13557 1 17 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.176 -2.268 18792 13558 1 17 . 1 1 141 141 HIS H H 141 8.043 8.043 7.378 0.665 18792 13559 1 17 . 1 1 142 142 LEU N N 142 117.054 117.054 122.504 -5.450 18792 13560 1 17 . 1 1 142 142 LEU C C 142 176.530 176.530 177.660 -1.130 18792 13561 1 17 . 1 1 142 142 LEU CA C 142 55.309 55.309 58.220 -2.911 18792 13562 1 17 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.962 0.376 18792 13563 1 17 . 1 1 142 142 LEU H H 142 7.198 7.198 8.072 -0.874 18792 13564 1 17 . 1 1 143 143 GLU N N 143 121.335 121.335 119.923 1.412 18792 13565 1 17 . 1 1 143 143 GLU C C 143 173.964 173.964 175.900 -1.936 18792 13566 1 17 . 1 1 143 143 GLU CA C 143 60.254 60.254 61.263 -1.009 18792 13567 1 17 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.161 -1.904 18792 13568 1 17 . 1 1 143 143 GLU H H 143 8.565 8.565 8.130 0.435 18792 13569 1 17 . 1 1 145 145 TRP N N 145 117.973 117.973 119.272 -1.299 18792 13570 1 17 . 1 1 145 145 TRP C C 145 179.526 179.526 177.466 2.060 18792 13571 1 17 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.536 1.069 18792 13572 1 17 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.518 -1.630 18792 13573 1 17 . 1 1 145 145 TRP H H 145 7.078 7.078 8.359 -1.281 18792 13574 1 17 . 1 1 146 146 ILE N N 146 122.101 122.101 110.922 11.179 18792 13575 1 17 . 1 1 146 146 ILE C C 146 179.110 179.110 177.356 1.754 18792 13576 1 17 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.182 4.152 18792 13577 1 17 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.705 -1.883 18792 13578 1 17 . 1 1 146 146 ILE H H 146 8.389 8.389 7.485 0.904 18792 13579 1 17 . 1 1 147 147 GLN N N 147 116.344 116.344 121.682 -5.338 18792 13580 1 17 . 1 1 147 147 GLN C C 147 179.526 179.526 178.024 1.502 18792 13581 1 17 . 1 1 147 147 GLN CA C 147 58.013 58.013 59.511 -1.498 18792 13582 1 17 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.414 -1.691 18792 13583 1 17 . 1 1 147 147 GLN H H 147 8.376 8.376 8.227 0.149 18792 13584 1 17 . 1 1 148 148 GLU N N 148 118.913 118.913 120.467 -1.554 18792 13585 1 17 . 1 1 148 148 GLU C C 148 176.880 176.880 178.553 -1.673 18792 13586 1 17 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.194 -2.821 18792 13587 1 17 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.326 -0.894 18792 13588 1 17 . 1 1 148 148 GLU H H 148 7.504 7.504 8.204 -0.700 18792 13589 1 17 . 1 1 149 149 ASN N N 149 116.616 116.616 113.324 3.292 18792 13590 1 17 . 1 1 149 149 ASN C C 149 173.964 173.964 176.721 -2.757 18792 13591 1 17 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.589 -0.343 18792 13592 1 17 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.240 -2.107 18792 13593 1 17 . 1 1 149 149 ASN H H 149 7.070 7.070 8.267 -1.197 18792 13594 1 17 . 1 1 150 150 GLY N N 150 104.750 104.750 106.069 -1.319 18792 13595 1 17 . 1 1 150 150 GLY C C 150 176.022 176.022 174.590 1.432 18792 13596 1 17 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.509 -0.267 18792 13597 1 17 . 1 1 150 150 GLY H H 150 7.313 7.313 8.165 -0.852 18792 13598 1 17 . 1 1 151 151 GLY N N 151 108.385 108.385 107.884 0.501 18792 13599 1 17 . 1 1 151 151 GLY C C 151 173.449 173.449 175.077 -1.628 18792 13600 1 17 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.968 -0.936 18792 13601 1 17 . 1 1 151 151 GLY H H 151 8.452 8.452 7.396 1.056 18792 13602 1 17 . 1 1 152 152 TRP N N 152 118.092 118.092 122.586 -4.494 18792 13603 1 17 . 1 1 152 152 TRP C C 152 178.571 178.571 178.002 0.569 18792 13604 1 17 . 1 1 152 152 TRP CA C 152 60.077 60.077 62.437 -2.360 18792 13605 1 17 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.846 -1.258 18792 13606 1 17 . 1 1 152 152 TRP H H 152 8.644 8.644 9.029 -0.385 18792 13607 1 17 . 1 1 153 153 ASP N N 153 117.758 117.758 117.833 -0.075 18792 13608 1 17 . 1 1 153 153 ASP C C 153 179.796 179.796 178.905 0.891 18792 13609 1 17 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.959 -0.657 18792 13610 1 17 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.759 -1.528 18792 13611 1 17 . 1 1 153 153 ASP H H 153 8.827 8.827 8.164 0.663 18792 13612 1 17 . 1 1 154 154 THR N N 154 116.817 116.817 117.646 -0.829 18792 13613 1 17 . 1 1 154 154 THR C C 154 175.352 175.352 176.417 -1.065 18792 13614 1 17 . 1 1 154 154 THR CA C 154 65.910 65.910 66.463 -0.553 18792 13615 1 17 . 1 1 154 154 THR CB C 154 67.712 67.712 69.173 -1.461 18792 13616 1 17 . 1 1 154 154 THR H H 154 7.494 7.494 7.637 -0.143 18792 13617 1 17 . 1 1 155 155 PHE N N 155 122.196 122.196 121.620 0.576 18792 13618 1 17 . 1 1 155 155 PHE C C 155 176.831 176.831 177.593 -0.762 18792 13619 1 17 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.604 0.682 18792 13620 1 17 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.130 -1.463 18792 13621 1 17 . 1 1 155 155 PHE H H 155 6.477 6.477 8.723 -2.246 18792 13622 1 17 . 1 1 156 156 VAL N N 156 117.387 117.387 119.093 -1.706 18792 13623 1 17 . 1 1 156 156 VAL C C 156 178.497 178.497 177.752 0.745 18792 13624 1 17 . 1 1 156 156 VAL CA C 156 66.231 66.231 67.196 -0.965 18792 13625 1 17 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.579 -0.894 18792 13626 1 17 . 1 1 156 156 VAL H H 156 7.788 7.788 8.248 -0.460 18792 13627 1 17 . 1 1 157 157 GLU N N 157 119.876 119.876 120.052 -0.176 18792 13628 1 17 . 1 1 157 157 GLU C C 157 178.399 178.399 179.279 -0.880 18792 13629 1 17 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.358 -0.598 18792 13630 1 17 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.934 -1.657 18792 13631 1 17 . 1 1 157 157 GLU H H 157 7.409 7.409 8.141 -0.732 18792 13632 1 17 . 1 1 158 158 LEU N N 158 117.194 117.194 120.441 -3.247 18792 13633 1 17 . 1 1 158 158 LEU C C 158 178.595 178.595 177.102 1.493 18792 13634 1 17 . 1 1 158 158 LEU CA C 158 56.377 56.377 56.992 -0.616 18792 13635 1 17 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.534 0.037 18792 13636 1 17 . 1 1 158 158 LEU H H 158 7.584 7.584 7.897 -0.313 18792 13637 1 17 . 1 1 159 159 TYR N N 159 115.549 115.549 114.863 0.686 18792 13638 1 17 . 1 1 159 159 TYR C C 159 177.032 177.032 176.580 0.452 18792 13639 1 17 . 1 1 159 159 TYR CA C 159 59.116 59.116 58.112 1.004 18792 13640 1 17 . 1 1 159 159 TYR CB C 159 37.599 37.599 39.214 -1.615 18792 13641 1 17 . 1 1 159 159 TYR H H 159 8.099 8.099 7.988 0.111 18792 13642 1 17 . 1 1 160 160 GLY N N 160 108.334 108.334 108.070 0.264 18792 13643 1 17 . 1 1 160 160 GLY C C 160 173.973 173.973 174.361 -0.388 18792 13644 1 17 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.928 0.136 18792 13645 1 17 . 1 1 160 160 GLY H H 160 8.020 8.020 7.544 0.476 18792 13646 1 17 . 1 1 161 161 ASN N N 161 118.189 118.189 119.401 -1.212 18792 13647 1 17 . 1 1 161 161 ASN C C 161 175.513 175.513 173.859 1.654 18792 13648 1 17 . 1 1 161 161 ASN CA C 161 53.104 53.104 52.921 0.183 18792 13649 1 17 . 1 1 161 161 ASN CB C 161 38.203 38.203 41.820 -3.617 18792 13650 1 17 . 1 1 161 161 ASN H H 161 8.327 8.327 7.838 0.489 18792 13651 1 17 . 1 1 162 162 ASN N N 162 119.022 119.022 119.508 -0.486 18792 13652 1 17 . 1 1 162 162 ASN C C 162 175.690 175.690 174.716 0.974 18792 13653 1 17 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.088 0.336 18792 13654 1 17 . 1 1 162 162 ASN CB C 162 38.203 38.203 38.555 -0.352 18792 13655 1 17 . 1 1 162 162 ASN H H 162 8.363 8.363 8.627 -0.264 18792 13656 1 17 . 1 1 163 163 ALA N N 163 123.275 123.275 122.843 0.432 18792 13657 1 17 . 1 1 163 163 ALA C C 163 178.598 178.598 177.377 1.221 18792 13658 1 17 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.865 0.373 18792 13659 1 17 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.366 -1.755 18792 13660 1 17 . 1 1 163 163 ALA H H 163 8.103 8.103 7.930 0.173 18792 13661 1 17 . 1 1 164 164 ALA N N 164 121.521 121.521 120.034 1.487 18792 13662 1 17 . 1 1 164 164 ALA C C 164 178.642 178.642 178.999 -0.357 18792 13663 1 17 . 1 1 164 164 ALA CA C 164 52.584 52.584 52.053 0.531 18792 13664 1 17 . 1 1 164 164 ALA CB C 164 17.819 17.819 19.034 -1.215 18792 13665 1 17 . 1 1 164 164 ALA H H 164 8.053 8.053 8.054 -0.001 18792 13666 1 17 . 1 1 165 165 ALA N N 165 122.101 122.101 121.532 0.569 18792 13667 1 17 . 1 1 165 165 ALA C C 165 179.124 179.124 178.834 0.290 18792 13668 1 17 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.282 -1.143 18792 13669 1 17 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.292 -0.314 18792 13670 1 17 . 1 1 165 165 ALA H H 165 7.949 7.949 8.585 -0.636 18792 13671 1 17 . 1 1 166 166 GLU N N 166 118.381 118.381 118.674 -0.293 18792 13672 1 17 . 1 1 166 166 GLU C C 166 177.664 177.664 177.197 0.467 18792 13673 1 17 . 1 1 166 166 GLU CA C 166 57.088 57.088 56.957 0.131 18792 13674 1 17 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.094 -0.740 18792 13675 1 17 . 1 1 166 166 GLU H H 166 8.202 8.202 8.686 -0.484 18792 13676 1 17 . 1 1 167 167 SER N N 167 115.193 115.193 115.239 -0.046 18792 13677 1 17 . 1 1 167 167 SER C C 167 175.312 175.312 175.313 -0.001 18792 13678 1 17 . 1 1 167 167 SER CA C 167 58.831 58.831 59.931 -1.100 18792 13679 1 17 . 1 1 167 167 SER CB C 167 62.537 62.537 64.269 -1.732 18792 13680 1 17 . 1 1 167 167 SER H H 167 8.029 8.029 7.814 0.215 18792 13681 1 17 . 1 1 168 168 ARG N N 168 121.696 121.696 119.605 2.091 18792 13682 1 17 . 1 1 168 168 ARG C C 168 176.880 176.880 174.299 2.581 18792 13683 1 17 . 1 1 168 168 ARG CA C 168 56.163 56.163 57.353 -1.190 18792 13684 1 17 . 1 1 168 168 ARG CB C 168 29.209 29.209 28.830 0.379 18792 13685 1 17 . 1 1 168 168 ARG H H 168 7.967 7.967 8.139 -0.172 18792 13686 1 17 . 1 1 169 169 LYS N N 169 120.917 120.917 118.435 2.482 18792 13687 1 17 . 1 1 169 169 LYS C C 169 177.640 177.640 175.130 2.510 18792 13688 1 17 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.022 0.675 18792 13689 1 17 . 1 1 169 169 LYS CB C 169 31.462 31.462 34.639 -3.177 18792 13690 1 17 . 1 1 169 169 LYS H H 169 8.011 8.011 7.767 0.244 18792 13691 1 17 . 1 1 170 170 GLY N N 170 109.155 109.155 109.418 -0.263 18792 13692 1 17 . 1 1 170 170 GLY C C 170 174.479 174.479 172.636 1.843 18792 13693 1 17 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.661 0.403 18792 13694 1 17 . 1 1 170 170 GLY H H 170 8.329 8.329 8.830 -0.501 18792 13695 1 17 . 1 1 171 171 GLN N N 171 119.292 119.292 118.577 0.715 18792 13696 1 17 . 1 1 171 171 GLN C C 171 176.463 176.463 174.401 2.062 18792 13697 1 17 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.246 0.420 18792 13698 1 17 . 1 1 171 171 GLN CB C 171 28.199 28.199 30.466 -2.267 18792 13699 1 17 . 1 1 171 171 GLN H H 171 8.035 8.035 8.784 -0.749 18792 13700 1 17 . 1 1 172 172 GLU N N 172 121.703 121.703 120.452 1.251 18792 13701 1 17 . 1 1 172 172 GLU C C 172 176.414 176.414 174.674 1.740 18792 13702 1 17 . 1 1 172 172 GLU CA C 172 56.341 56.341 56.938 -0.597 18792 13703 1 17 . 1 1 172 172 GLU CB C 172 28.821 28.821 29.844 -1.023 18792 13704 1 17 . 1 1 172 172 GLU H H 172 8.405 8.405 8.410 -0.005 18792 13705 1 17 . 1 1 173 173 ARG N N 173 121.852 121.852 122.380 -0.528 18792 13706 1 17 . 1 1 173 173 ARG C C 173 176.365 176.365 174.982 1.383 18792 13707 1 17 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.934 0.265 18792 13708 1 17 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.246 -2.115 18792 13709 1 17 . 1 1 173 173 ARG H H 173 8.335 8.335 8.318 0.017 18792 13710 1 17 . 1 1 174 174 LEU N N 174 122.640 122.640 123.680 -1.040 18792 13711 1 17 . 1 1 174 174 LEU C C 174 176.523 176.523 175.064 1.459 18792 13712 1 17 . 1 1 174 174 LEU CA C 174 54.768 54.768 55.747 -0.979 18792 13713 1 17 . 1 1 174 174 LEU CB C 174 40.784 40.784 43.741 -2.957 18792 13714 1 17 . 1 1 174 174 LEU H H 174 8.082 8.082 8.564 -0.482 18792 13715 1 17 . 1 1 175 175 GLU N N 175 125.909 125.909 124.873 1.036 18792 13716 1 17 . 1 1 175 175 GLU C C 175 181.029 181.029 174.667 6.362 18792 13717 1 17 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.020 1.378 18792 13718 1 17 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.823 -1.774 18792 13719 1 17 . 1 1 175 175 GLU H H 175 7.785 7.785 8.414 -0.629 18792 13720 1 18 . 1 1 4 4 ALA N N 4 124.786 124.786 122.808 1.978 18792 13721 1 18 . 1 1 4 4 ALA C C 4 178.272 178.272 178.526 -0.254 18792 13722 1 18 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.156 -1.590 18792 13723 1 18 . 1 1 4 4 ALA CB C 4 18.234 18.234 19.241 -1.008 18792 13724 1 18 . 1 1 4 4 ALA H H 4 8.414 8.414 8.352 0.062 18792 13725 1 18 . 1 1 5 5 MET N N 5 119.681 119.681 114.938 4.743 18792 13726 1 18 . 1 1 5 5 MET C C 5 176.929 176.929 176.528 0.401 18792 13727 1 18 . 1 1 5 5 MET CA C 5 55.594 55.594 55.594 0.000 18792 13728 1 18 . 1 1 5 5 MET CB C 5 31.540 31.540 32.536 -0.996 18792 13729 1 18 . 1 1 5 5 MET H H 5 8.336 8.336 8.038 0.298 18792 13730 1 18 . 1 1 6 6 SER N N 6 116.162 116.162 117.165 -1.003 18792 13731 1 18 . 1 1 6 6 SER C C 6 175.924 175.924 175.967 -0.043 18792 13732 1 18 . 1 1 6 6 SER CA C 6 59.009 59.009 61.035 -2.026 18792 13733 1 18 . 1 1 6 6 SER CB C 6 62.537 62.537 63.166 -0.630 18792 13734 1 18 . 1 1 6 6 SER H H 6 8.272 8.272 8.260 0.012 18792 13735 1 18 . 1 1 7 7 GLN N N 7 122.263 122.263 120.136 2.127 18792 13736 1 18 . 1 1 7 7 GLN C C 7 177.027 177.027 177.826 -0.799 18792 13737 1 18 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.863 -2.593 18792 13738 1 18 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.078 -0.339 18792 13739 1 18 . 1 1 7 7 GLN H H 7 8.314 8.314 8.248 0.066 18792 13740 1 18 . 1 1 8 8 SER N N 8 116.625 116.625 115.469 1.156 18792 13741 1 18 . 1 1 8 8 SER C C 8 176.457 176.457 176.374 0.083 18792 13742 1 18 . 1 1 8 8 SER CA C 8 59.650 59.650 61.488 -1.838 18792 13743 1 18 . 1 1 8 8 SER CB C 8 62.226 62.226 62.959 -0.733 18792 13744 1 18 . 1 1 8 8 SER H H 8 8.333 8.333 7.863 0.470 18792 13745 1 18 . 1 1 9 9 ASN N N 9 121.307 121.307 120.966 0.341 18792 13746 1 18 . 1 1 9 9 ASN C C 9 177.419 177.419 177.245 0.174 18792 13747 1 18 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.087 -0.599 18792 13748 1 18 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.225 -1.093 18792 13749 1 18 . 1 1 9 9 ASN H H 9 8.611 8.611 8.219 0.392 18792 13750 1 18 . 1 1 10 10 ARG N N 10 119.830 119.830 121.251 -1.421 18792 13751 1 18 . 1 1 10 10 ARG C C 10 177.615 177.615 178.321 -0.706 18792 13752 1 18 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.743 -0.485 18792 13753 1 18 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.340 -2.141 18792 13754 1 18 . 1 1 10 10 ARG H H 10 7.996 7.996 8.642 -0.646 18792 13755 1 18 . 1 1 11 11 GLU N N 11 117.270 117.270 119.023 -1.753 18792 13756 1 18 . 1 1 11 11 GLU C C 11 179.649 179.649 178.633 1.016 18792 13757 1 18 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.353 -0.344 18792 13758 1 18 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.453 -1.332 18792 13759 1 18 . 1 1 11 11 GLU H H 11 7.885 7.885 8.397 -0.512 18792 13760 1 18 . 1 1 12 12 LEU N N 12 119.900 119.900 121.131 -1.231 18792 13761 1 18 . 1 1 12 12 LEU C C 12 178.473 178.473 178.254 0.219 18792 13762 1 18 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.461 -0.767 18792 13763 1 18 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.900 -1.271 18792 13764 1 18 . 1 1 12 12 LEU H H 12 7.691 7.691 7.874 -0.183 18792 13765 1 18 . 1 1 13 13 VAL N N 13 117.320 117.320 118.276 -0.956 18792 13766 1 18 . 1 1 13 13 VAL C C 13 177.272 177.272 178.520 -1.248 18792 13767 1 18 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.696 0.460 18792 13768 1 18 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.112 0.117 18792 13769 1 18 . 1 1 13 13 VAL H H 13 7.629 7.629 7.674 -0.045 18792 13770 1 18 . 1 1 14 14 VAL N N 14 116.659 116.659 120.347 -3.688 18792 13771 1 18 . 1 1 14 14 VAL C C 14 178.718 178.718 177.964 0.754 18792 13772 1 18 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.855 -0.339 18792 13773 1 18 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.478 -1.104 18792 13774 1 18 . 1 1 14 14 VAL H H 14 8.210 8.210 7.883 0.327 18792 13775 1 18 . 1 1 15 15 ASP N N 15 120.374 120.374 121.264 -0.890 18792 13776 1 18 . 1 1 15 15 ASP C C 15 177.557 177.557 178.605 -1.048 18792 13777 1 18 . 1 1 15 15 ASP CA C 15 58.476 58.476 56.907 1.569 18792 13778 1 18 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.596 1.958 18792 13779 1 18 . 1 1 15 15 ASP H H 15 7.967 7.967 8.642 -0.675 18792 13780 1 18 . 1 1 16 16 PHE N N 16 119.864 119.864 121.565 -1.701 18792 13781 1 18 . 1 1 16 16 PHE C C 16 178.252 178.252 177.184 1.068 18792 13782 1 18 . 1 1 16 16 PHE CA C 16 62.780 62.780 60.643 2.137 18792 13783 1 18 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.970 0.090 18792 13784 1 18 . 1 1 16 16 PHE H H 16 8.228 8.228 8.155 0.073 18792 13785 1 18 . 1 1 17 17 LEU N N 17 116.312 116.312 118.934 -2.622 18792 13786 1 18 . 1 1 17 17 LEU C C 17 179.649 179.649 178.790 0.859 18792 13787 1 18 . 1 1 17 17 LEU CA C 17 57.764 57.764 57.906 -0.142 18792 13788 1 18 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.481 -1.396 18792 13789 1 18 . 1 1 17 17 LEU H H 17 8.766 8.766 8.159 0.607 18792 13790 1 18 . 1 1 18 18 SER N N 18 113.715 113.715 116.456 -2.741 18792 13791 1 18 . 1 1 18 18 SER C C 18 177.362 177.362 176.780 0.582 18792 13792 1 18 . 1 1 18 18 SER CA C 18 61.948 61.948 61.410 0.538 18792 13793 1 18 . 1 1 18 18 SER CB C 18 63.003 63.003 63.387 -0.384 18792 13794 1 18 . 1 1 18 18 SER H H 18 8.384 8.384 8.098 0.286 18792 13795 1 18 . 1 1 19 19 TYR N N 19 124.570 124.570 122.995 1.575 18792 13796 1 18 . 1 1 19 19 TYR C C 19 178.415 178.415 177.963 0.452 18792 13797 1 18 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.194 -1.430 18792 13798 1 18 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.157 -1.141 18792 13799 1 18 . 1 1 19 19 TYR H H 19 8.155 8.155 8.704 -0.549 18792 13800 1 18 . 1 1 20 20 LYS N N 20 119.739 119.739 120.033 -0.294 18792 13801 1 18 . 1 1 20 20 LYS C C 20 180.456 180.456 178.748 1.708 18792 13802 1 18 . 1 1 20 20 LYS CA C 20 56.488 56.488 58.077 -1.589 18792 13803 1 18 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.045 -3.886 18792 13804 1 18 . 1 1 20 20 LYS H H 20 8.224 8.224 7.776 0.448 18792 13805 1 18 . 1 1 21 21 LEU N N 21 118.092 118.092 120.397 -2.305 18792 13806 1 18 . 1 1 21 21 LEU C C 21 179.989 179.989 177.850 2.139 18792 13807 1 18 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.276 -0.150 18792 13808 1 18 . 1 1 21 21 LEU CB C 21 39.608 39.608 42.004 -2.396 18792 13809 1 18 . 1 1 21 21 LEU H H 21 8.586 8.586 7.754 0.832 18792 13810 1 18 . 1 1 22 22 SER N N 22 117.304 117.304 112.924 4.380 18792 13811 1 18 . 1 1 22 22 SER C C 22 180.152 180.152 177.321 2.831 18792 13812 1 18 . 1 1 22 22 SER CA C 22 61.287 61.287 60.475 0.812 18792 13813 1 18 . 1 1 22 22 SER H H 22 8.266 8.266 7.643 0.623 18792 13814 1 18 . 1 1 23 23 GLN N N 23 122.497 122.497 120.024 2.473 18792 13815 1 18 . 1 1 23 23 GLN C C 23 177.297 177.297 176.924 0.373 18792 13816 1 18 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.088 -0.146 18792 13817 1 18 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.928 -1.117 18792 13818 1 18 . 1 1 23 23 GLN H H 23 7.571 7.571 7.949 -0.378 18792 13819 1 18 . 1 1 24 24 LYS N N 24 116.038 116.038 117.314 -1.276 18792 13820 1 18 . 1 1 24 24 LYS C C 24 175.704 175.704 175.679 0.025 18792 13821 1 18 . 1 1 24 24 LYS CA C 24 53.495 53.495 55.819 -2.324 18792 13822 1 18 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.130 -1.901 18792 13823 1 18 . 1 1 24 24 LYS H H 24 7.134 7.134 7.482 -0.348 18792 13824 1 18 . 1 1 25 25 GLY N N 25 105.283 105.283 108.118 -2.835 18792 13825 1 18 . 1 1 25 25 GLY C C 25 174.013 174.013 173.742 0.271 18792 13826 1 18 . 1 1 25 25 GLY CA C 25 44.779 44.779 45.533 -0.755 18792 13827 1 18 . 1 1 25 25 GLY H H 25 7.483 7.483 7.872 -0.389 18792 13828 1 18 . 1 1 26 26 TYR N N 26 119.547 119.547 119.366 0.181 18792 13829 1 18 . 1 1 26 26 TYR C C 26 175.122 175.122 174.050 1.072 18792 13830 1 18 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.892 -1.760 18792 13831 1 18 . 1 1 26 26 TYR CB C 26 40.080 40.080 41.888 -1.808 18792 13832 1 18 . 1 1 26 26 TYR H H 26 7.788 7.788 7.683 0.105 18792 13833 1 18 . 1 1 27 27 SER N N 27 115.088 115.088 118.938 -3.850 18792 13834 1 18 . 1 1 27 27 SER C C 27 174.452 174.452 175.595 -1.143 18792 13835 1 18 . 1 1 27 27 SER CA C 27 56.306 56.306 58.744 -2.438 18792 13836 1 18 . 1 1 27 27 SER CB C 27 63.921 63.921 63.653 0.268 18792 13837 1 18 . 1 1 27 27 SER H H 27 8.473 8.473 8.936 -0.463 18792 13838 1 18 . 1 1 28 28 TRP N N 28 127.014 127.014 127.772 -0.758 18792 13839 1 18 . 1 1 28 28 TRP C C 28 177.002 177.002 177.944 -0.942 18792 13840 1 18 . 1 1 28 28 TRP CA C 28 59.472 59.472 60.037 -0.565 18792 13841 1 18 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.007 0.823 18792 13842 1 18 . 1 1 28 28 TRP H H 28 8.897 8.897 8.894 0.003 18792 13843 1 18 . 1 1 29 29 SER N N 29 112.044 112.044 109.624 2.420 18792 13844 1 18 . 1 1 29 29 SER C C 29 175.106 175.106 175.334 -0.228 18792 13845 1 18 . 1 1 29 29 SER CA C 29 59.472 59.472 59.383 0.089 18792 13846 1 18 . 1 1 29 29 SER CB C 29 62.226 62.226 62.519 -0.293 18792 13847 1 18 . 1 1 29 29 SER H H 29 8.129 8.129 8.188 -0.059 18792 13848 1 18 . 1 1 30 30 GLN N N 30 119.160 119.160 120.557 -1.397 18792 13849 1 18 . 1 1 30 30 GLN C C 30 176.218 176.218 175.480 0.738 18792 13850 1 18 . 1 1 30 30 GLN CA C 30 56.412 56.412 56.357 0.055 18792 13851 1 18 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.885 -1.307 18792 13852 1 18 . 1 1 30 30 GLN H H 30 7.370 7.370 7.517 -0.147 18792 13853 1 18 . 1 1 31 31 PHE N N 31 116.277 116.277 115.768 0.509 18792 13854 1 18 . 1 1 31 31 PHE C C 31 175.217 175.217 174.880 0.337 18792 13855 1 18 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.930 -2.696 18792 13856 1 18 . 1 1 31 31 PHE CB C 31 39.066 39.066 35.906 3.160 18792 13857 1 18 . 1 1 31 31 PHE H H 31 7.248 7.248 7.174 0.074 18792 13858 1 18 . 1 1 32 32 SER N N 32 113.683 113.683 117.104 -3.421 18792 13859 1 18 . 1 1 32 32 SER C C 32 173.793 173.793 173.866 -0.073 18792 13860 1 18 . 1 1 32 32 SER CA C 32 57.124 57.124 57.449 -0.325 18792 13861 1 18 . 1 1 32 32 SER CB C 32 63.081 63.081 63.053 0.028 18792 13862 1 18 . 1 1 32 32 SER H H 32 7.242 7.242 7.859 -0.617 18792 13863 1 18 . 1 1 33 33 ASP N N 33 122.195 122.195 123.731 -1.536 18792 13864 1 18 . 1 1 33 33 ASP C C 33 176.394 176.394 175.072 1.322 18792 13865 1 18 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.372 -1.624 18792 13866 1 18 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.145 0.253 18792 13867 1 18 . 1 1 33 33 ASP H H 33 8.257 8.257 8.790 -0.533 18792 13868 1 18 . 1 1 34 34 VAL N N 34 118.913 118.913 117.648 1.265 18792 13869 1 18 . 1 1 34 34 VAL C C 34 176.328 176.328 175.543 0.785 18792 13870 1 18 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.014 -0.124 18792 13871 1 18 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.168 -0.153 18792 13872 1 18 . 1 1 34 34 VAL H H 34 7.852 7.852 7.806 0.046 18792 13873 1 18 . 1 1 35 35 GLU N N 35 124.205 124.205 118.795 5.410 18792 13874 1 18 . 1 1 35 35 GLU C C 35 176.586 176.586 175.364 1.222 18792 13875 1 18 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.832 -1.775 18792 13876 1 18 . 1 1 35 35 GLU CB C 35 28.898 28.898 29.707 -0.809 18792 13877 1 18 . 1 1 35 35 GLU H H 35 8.401 8.401 8.017 0.384 18792 13878 1 18 . 1 1 36 36 GLU N N 36 121.670 121.670 119.853 1.817 18792 13879 1 18 . 1 1 36 36 GLU C C 36 176.218 176.218 175.583 0.635 18792 13880 1 18 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.623 -0.635 18792 13881 1 18 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.204 -0.762 18792 13882 1 18 . 1 1 36 36 GLU H H 36 8.239 8.239 8.559 -0.320 18792 13883 1 18 . 1 1 37 37 ASN N N 37 119.252 119.252 122.589 -3.337 18792 13884 1 18 . 1 1 37 37 ASN C C 37 175.003 175.003 175.743 -0.740 18792 13885 1 18 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.403 -0.748 18792 13886 1 18 . 1 1 37 37 ASN CB C 37 38.212 38.212 38.977 -0.765 18792 13887 1 18 . 1 1 37 37 ASN H H 37 8.412 8.412 8.662 -0.250 18792 13888 1 18 . 1 1 38 38 ARG N N 38 121.622 121.622 120.766 0.856 18792 13889 1 18 . 1 1 38 38 ARG C C 38 176.610 176.610 176.641 -0.031 18792 13890 1 18 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.986 -1.622 18792 13891 1 18 . 1 1 38 38 ARG CB C 38 29.419 29.419 30.765 -1.346 18792 13892 1 18 . 1 1 38 38 ARG H H 38 8.227 8.227 8.205 0.022 18792 13893 1 18 . 1 1 39 39 THR N N 39 115.681 115.681 111.131 4.550 18792 13894 1 18 . 1 1 39 39 THR C C 39 174.500 174.500 174.076 0.424 18792 13895 1 18 . 1 1 39 39 THR CA C 39 61.606 61.606 62.022 -0.416 18792 13896 1 18 . 1 1 39 39 THR CB C 39 69.163 69.163 69.778 -0.614 18792 13897 1 18 . 1 1 39 39 THR H H 39 8.173 8.173 8.260 -0.087 18792 13898 1 18 . 1 1 40 40 GLU N N 40 122.708 122.708 120.611 2.097 18792 13899 1 18 . 1 1 40 40 GLU C C 40 175.728 175.728 174.732 0.996 18792 13900 1 18 . 1 1 40 40 GLU CA C 40 55.772 55.772 57.118 -1.346 18792 13901 1 18 . 1 1 40 40 GLU CB C 40 29.054 29.054 30.159 -1.105 18792 13902 1 18 . 1 1 40 40 GLU H H 40 8.298 8.298 8.342 -0.044 18792 13903 1 18 . 1 1 41 41 ALA N N 41 125.922 125.922 124.525 1.397 18792 13904 1 18 . 1 1 41 41 ALA C C 41 175.557 175.557 175.642 -0.085 18792 13905 1 18 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.105 -1.132 18792 13906 1 18 . 1 1 41 41 ALA CB C 41 17.245 17.245 19.513 -2.268 18792 13907 1 18 . 1 1 41 41 ALA H H 41 8.212 8.212 8.295 -0.083 18792 13908 1 18 . 1 1 43 43 GLU N N 43 120.783 120.783 119.174 1.609 18792 13909 1 18 . 1 1 43 43 GLU C C 43 177.174 177.174 177.524 -0.350 18792 13910 1 18 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.821 -0.480 18792 13911 1 18 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.815 -0.528 18792 13912 1 18 . 1 1 43 43 GLU H H 43 8.519 8.519 8.870 -0.350 18792 13913 1 18 . 1 1 44 44 GLY N N 44 110.022 110.022 107.499 2.523 18792 13914 1 18 . 1 1 44 44 GLY C C 44 174.773 174.773 174.191 0.582 18792 13915 1 18 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.443 -0.415 18792 13916 1 18 . 1 1 44 44 GLY H H 44 8.429 8.429 8.496 -0.067 18792 13917 1 18 . 1 1 45 45 THR N N 45 112.790 112.790 113.370 -0.580 18792 13918 1 18 . 1 1 45 45 THR C C 45 175.726 175.726 174.963 0.763 18792 13919 1 18 . 1 1 45 45 THR CA C 45 61.987 61.987 61.070 0.917 18792 13920 1 18 . 1 1 45 45 THR CB C 45 69.304 69.304 69.263 0.041 18792 13921 1 18 . 1 1 45 45 THR H H 45 8.125 8.125 7.676 0.449 18792 13922 1 18 . 1 1 46 46 GLU N N 46 122.752 122.752 125.937 -3.185 18792 13923 1 18 . 1 1 46 46 GLU C C 46 177.419 177.419 177.211 0.208 18792 13924 1 18 . 1 1 46 46 GLU CA C 46 57.231 57.231 59.509 -2.278 18792 13925 1 18 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.792 -1.593 18792 13926 1 18 . 1 1 46 46 GLU H H 46 8.765 8.765 8.748 0.017 18792 13927 1 18 . 1 1 47 47 SER N N 47 114.895 114.895 110.810 4.085 18792 13928 1 18 . 1 1 47 47 SER C C 47 175.826 175.826 175.012 0.814 18792 13929 1 18 . 1 1 47 47 SER CA C 47 58.582 58.582 59.139 -0.557 18792 13930 1 18 . 1 1 47 47 SER CB C 47 62.537 62.537 61.552 0.985 18792 13931 1 18 . 1 1 47 47 SER H H 47 8.355 8.355 8.311 0.044 18792 13932 1 18 . 1 1 48 48 GLU N N 48 122.429 122.429 120.203 2.226 18792 13933 1 18 . 1 1 48 48 GLU C C 48 178.099 178.099 177.529 0.570 18792 13934 1 18 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.254 -0.636 18792 13935 1 18 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.635 -1.160 18792 13936 1 18 . 1 1 48 48 GLU H H 48 8.139 8.139 8.483 -0.344 18792 13937 1 18 . 1 1 49 49 ALA N N 49 120.374 120.374 122.084 -1.710 18792 13938 1 18 . 1 1 49 49 ALA C C 49 180.843 180.843 179.021 1.822 18792 13939 1 18 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.200 -0.717 18792 13940 1 18 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.175 -0.740 18792 13941 1 18 . 1 1 49 49 ALA H H 49 8.079 8.079 8.283 -0.204 18792 13942 1 18 . 1 1 50 50 VAL N N 50 118.599 118.599 118.482 0.117 18792 13943 1 18 . 1 1 50 50 VAL C C 50 176.921 176.921 177.785 -0.864 18792 13944 1 18 . 1 1 50 50 VAL CA C 50 65.560 65.560 66.064 -0.504 18792 13945 1 18 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.127 -0.830 18792 13946 1 18 . 1 1 50 50 VAL H H 50 7.419 7.419 7.508 -0.089 18792 13947 1 18 . 1 1 51 51 LYS N N 51 117.469 117.469 120.289 -2.820 18792 13948 1 18 . 1 1 51 51 LYS C C 51 179.061 179.061 178.533 0.528 18792 13949 1 18 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.856 -0.633 18792 13950 1 18 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.069 -1.073 18792 13951 1 18 . 1 1 51 51 LYS H H 51 7.359 7.359 8.120 -0.761 18792 13952 1 18 . 1 1 52 52 GLN N N 52 115.930 115.930 118.687 -2.757 18792 13953 1 18 . 1 1 52 52 GLN C C 52 177.713 177.713 177.927 -0.214 18792 13954 1 18 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.662 -0.186 18792 13955 1 18 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.630 -2.062 18792 13956 1 18 . 1 1 52 52 GLN H H 52 8.025 8.025 7.953 0.072 18792 13957 1 18 . 1 1 53 53 ALA N N 53 119.782 119.782 121.697 -1.915 18792 13958 1 18 . 1 1 53 53 ALA C C 53 180.008 180.008 178.762 1.246 18792 13959 1 18 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.044 0.341 18792 13960 1 18 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.214 -0.699 18792 13961 1 18 . 1 1 53 53 ALA H H 53 7.655 7.655 7.689 -0.034 18792 13962 1 18 . 1 1 54 54 LEU N N 54 120.443 120.443 120.044 0.399 18792 13963 1 18 . 1 1 54 54 LEU C C 54 179.330 179.330 177.539 1.791 18792 13964 1 18 . 1 1 54 54 LEU CA C 54 58.013 58.013 57.020 0.993 18792 13965 1 18 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.723 -0.861 18792 13966 1 18 . 1 1 54 54 LEU H H 54 8.419 8.419 7.832 0.587 18792 13967 1 18 . 1 1 55 55 ARG N N 55 118.423 118.423 119.733 -1.310 18792 13968 1 18 . 1 1 55 55 ARG C C 55 178.767 178.767 178.356 0.411 18792 13969 1 18 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.184 1.213 18792 13970 1 18 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.643 -0.900 18792 13971 1 18 . 1 1 55 55 ARG H H 55 8.062 8.062 8.094 -0.032 18792 13972 1 18 . 1 1 56 56 GLU N N 56 115.988 115.988 118.173 -2.185 18792 13973 1 18 . 1 1 56 56 GLU C C 56 180.090 180.090 178.579 1.511 18792 13974 1 18 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.140 -0.380 18792 13975 1 18 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.422 -1.068 18792 13976 1 18 . 1 1 56 56 GLU H H 56 7.772 7.772 7.974 -0.202 18792 13977 1 18 . 1 1 57 57 ALA N N 57 122.837 122.837 122.090 0.747 18792 13978 1 18 . 1 1 57 57 ALA C C 57 181.861 181.861 179.819 2.042 18792 13979 1 18 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.847 -0.213 18792 13980 1 18 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.709 -0.236 18792 13981 1 18 . 1 1 57 57 ALA H H 57 8.774 8.774 7.447 1.327 18792 13982 1 18 . 1 1 58 58 GLY N N 58 108.409 108.409 106.655 1.754 18792 13983 1 18 . 1 1 58 58 GLY C C 58 175.331 175.331 175.831 -0.500 18792 13984 1 18 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.983 -0.315 18792 13985 1 18 . 1 1 58 58 GLY H H 58 9.073 9.073 8.359 0.714 18792 13986 1 18 . 1 1 59 59 ASP N N 59 122.074 122.074 122.920 -0.846 18792 13987 1 18 . 1 1 59 59 ASP C C 59 179.023 179.023 178.256 0.767 18792 13988 1 18 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.733 -0.432 18792 13989 1 18 . 1 1 59 59 ASP CB C 59 38.842 38.842 41.097 -2.255 18792 13990 1 18 . 1 1 59 59 ASP H H 59 8.049 8.049 8.326 -0.277 18792 13991 1 18 . 1 1 60 60 GLU N N 60 120.131 120.131 119.750 0.381 18792 13992 1 18 . 1 1 60 60 GLU C C 60 178.522 178.522 179.334 -0.812 18792 13993 1 18 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.005 0.004 18792 13994 1 18 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.956 -1.758 18792 13995 1 18 . 1 1 60 60 GLU H H 60 8.136 8.136 8.013 0.123 18792 13996 1 18 . 1 1 61 61 PHE N N 61 121.309 121.309 119.394 1.915 18792 13997 1 18 . 1 1 61 61 PHE C C 61 176.904 176.904 177.375 -0.471 18792 13998 1 18 . 1 1 61 61 PHE CA C 61 61.322 61.322 62.220 -0.898 18792 13999 1 18 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.650 -1.041 18792 14000 1 18 . 1 1 61 61 PHE H H 61 8.523 8.523 8.170 0.353 18792 14001 1 18 . 1 1 62 62 GLU N N 62 115.971 115.971 119.101 -3.130 18792 14002 1 18 . 1 1 62 62 GLU C C 62 177.713 177.713 178.187 -0.474 18792 14003 1 18 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.045 -0.854 18792 14004 1 18 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.709 -1.432 18792 14005 1 18 . 1 1 62 62 GLU H H 62 7.969 7.969 8.571 -0.602 18792 14006 1 18 . 1 1 63 63 LEU N N 63 116.703 116.703 120.961 -4.258 18792 14007 1 18 . 1 1 63 63 LEU C C 63 178.963 178.963 178.772 0.191 18792 14008 1 18 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.092 -0.680 18792 14009 1 18 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.371 -0.965 18792 14010 1 18 . 1 1 63 63 LEU H H 63 7.347 7.347 8.163 -0.816 18792 14011 1 18 . 1 1 64 64 ARG N N 64 117.453 117.453 117.371 0.082 18792 14012 1 18 . 1 1 64 64 ARG C C 64 177.297 177.297 176.991 0.306 18792 14013 1 18 . 1 1 64 64 ARG CA C 64 57.337 57.337 57.001 0.336 18792 14014 1 18 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.493 -0.896 18792 14015 1 18 . 1 1 64 64 ARG H H 64 7.995 7.995 7.719 0.276 18792 14016 1 18 . 1 1 65 65 TYR N N 65 118.956 118.956 119.237 -0.281 18792 14017 1 18 . 1 1 65 65 TYR C C 65 175.278 175.278 174.868 0.410 18792 14018 1 18 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.858 -3.157 18792 14019 1 18 . 1 1 65 65 TYR CB C 65 35.986 35.986 36.456 -0.470 18792 14020 1 18 . 1 1 65 65 TYR H H 65 7.909 7.909 7.710 0.199 18792 14021 1 18 . 1 1 66 66 ARG N N 66 119.438 119.438 122.240 -2.802 18792 14022 1 18 . 1 1 66 66 ARG C C 66 178.424 178.424 176.718 1.706 18792 14023 1 18 . 1 1 66 66 ARG CA C 66 58.476 58.476 57.433 1.043 18792 14024 1 18 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.830 -2.009 18792 14025 1 18 . 1 1 66 66 ARG H H 66 7.244 7.244 8.180 -0.936 18792 14026 1 18 . 1 1 67 67 ARG N N 67 118.936 118.936 121.456 -2.520 18792 14027 1 18 . 1 1 67 67 ARG C C 67 177.542 177.542 177.844 -0.302 18792 14028 1 18 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.298 -1.854 18792 14029 1 18 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.955 -1.834 18792 14030 1 18 . 1 1 67 67 ARG H H 67 8.417 8.417 8.640 -0.223 18792 14031 1 18 . 1 1 68 68 ALA N N 68 121.797 121.797 120.190 1.607 18792 14032 1 18 . 1 1 68 68 ALA C C 68 180.337 180.337 179.184 1.153 18792 14033 1 18 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.674 -0.538 18792 14034 1 18 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.213 -0.746 18792 14035 1 18 . 1 1 68 68 ALA H H 68 7.827 7.827 8.142 -0.315 18792 14036 1 18 . 1 1 69 69 PHE N N 69 115.986 115.986 115.429 0.557 18792 14037 1 18 . 1 1 69 69 PHE C C 69 177.468 177.468 177.631 -0.163 18792 14038 1 18 . 1 1 69 69 PHE CA C 69 58.049 58.049 57.565 0.484 18792 14039 1 18 . 1 1 69 69 PHE CB C 69 37.599 37.599 37.397 0.202 18792 14040 1 18 . 1 1 69 69 PHE H H 69 8.517 8.517 7.013 1.504 18792 14041 1 18 . 1 1 70 70 SER N N 70 116.526 116.526 117.571 -1.045 18792 14042 1 18 . 1 1 70 70 SER C C 70 177.640 177.640 176.711 0.929 18792 14043 1 18 . 1 1 70 70 SER CA C 70 61.073 61.073 61.493 -0.420 18792 14044 1 18 . 1 1 70 70 SER CB C 70 61.993 61.993 62.779 -0.785 18792 14045 1 18 . 1 1 70 70 SER H H 70 8.152 8.152 7.627 0.525 18792 14046 1 18 . 1 1 71 71 ASP N N 71 121.181 121.181 120.929 0.252 18792 14047 1 18 . 1 1 71 71 ASP C C 71 178.546 178.546 178.648 -0.102 18792 14048 1 18 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.282 -0.834 18792 14049 1 18 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.679 -1.448 18792 14050 1 18 . 1 1 71 71 ASP H H 71 8.356 8.356 7.586 0.770 18792 14051 1 18 . 1 1 72 72 LEU N N 72 120.747 120.747 119.615 1.132 18792 14052 1 18 . 1 1 72 72 LEU C C 72 178.963 178.963 179.017 -0.054 18792 14053 1 18 . 1 1 72 72 LEU CA C 72 57.444 57.444 57.900 -0.456 18792 14054 1 18 . 1 1 72 72 LEU CB C 72 41.017 41.017 41.470 -0.453 18792 14055 1 18 . 1 1 72 72 LEU H H 72 7.738 7.738 7.370 0.368 18792 14056 1 18 . 1 1 73 73 THR N N 73 109.432 109.432 110.258 -0.826 18792 14057 1 18 . 1 1 73 73 THR C C 73 177.481 177.481 176.347 1.134 18792 14058 1 18 . 1 1 73 73 THR CA C 73 65.128 65.128 65.236 -0.108 18792 14059 1 18 . 1 1 73 73 THR CB C 73 67.720 67.720 68.946 -1.226 18792 14060 1 18 . 1 1 73 73 THR H H 73 8.296 8.296 8.483 -0.187 18792 14061 1 18 . 1 1 74 74 SER N N 74 115.862 115.862 114.208 1.654 18792 14062 1 18 . 1 1 74 74 SER C C 74 175.361 175.361 175.976 -0.615 18792 14063 1 18 . 1 1 74 74 SER CA C 74 60.112 60.112 59.616 0.496 18792 14064 1 18 . 1 1 74 74 SER CB C 74 62.537 62.537 63.402 -0.865 18792 14065 1 18 . 1 1 74 74 SER H H 74 7.629 7.629 8.144 -0.515 18792 14066 1 18 . 1 1 75 75 GLN N N 75 118.551 118.551 118.974 -0.423 18792 14067 1 18 . 1 1 75 75 GLN C C 75 176.316 176.316 176.370 -0.054 18792 14068 1 18 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.632 0.172 18792 14069 1 18 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.698 -1.421 18792 14070 1 18 . 1 1 75 75 GLN H H 75 7.640 7.640 7.492 0.148 18792 14071 1 18 . 1 1 76 76 LEU N N 76 118.313 118.313 115.280 3.033 18792 14072 1 18 . 1 1 76 76 LEU C C 76 174.160 174.160 175.979 -1.819 18792 14073 1 18 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.542 -0.802 18792 14074 1 18 . 1 1 76 76 LEU CB C 76 42.727 42.727 39.385 3.342 18792 14075 1 18 . 1 1 76 76 LEU H H 76 7.411 7.411 7.635 -0.224 18792 14076 1 18 . 1 1 77 77 HIS N N 77 120.104 120.104 118.803 1.301 18792 14077 1 18 . 1 1 77 77 HIS C C 77 174.528 174.528 174.473 0.055 18792 14078 1 18 . 1 1 77 77 HIS CA C 77 54.207 54.207 57.510 -3.303 18792 14079 1 18 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.069 -0.103 18792 14080 1 18 . 1 1 77 77 HIS H H 77 8.117 8.117 8.616 -0.499 18792 14081 1 18 . 1 1 78 78 ILE N N 78 122.298 122.298 124.665 -2.367 18792 14082 1 18 . 1 1 78 78 ILE C C 78 174.240 174.240 174.503 -0.263 18792 14083 1 18 . 1 1 78 78 ILE CA C 78 61.402 61.402 60.842 0.560 18792 14084 1 18 . 1 1 78 78 ILE CB C 78 37.591 37.591 40.629 -3.038 18792 14085 1 18 . 1 1 78 78 ILE H H 78 8.655 8.655 8.167 0.488 18792 14086 1 18 . 1 1 79 79 THR N N 79 116.442 116.442 121.223 -4.781 18792 14087 1 18 . 1 1 79 79 THR C C 79 174.291 174.291 172.122 2.169 18792 14088 1 18 . 1 1 79 79 THR CA C 79 61.632 61.632 58.327 3.305 18792 14089 1 18 . 1 1 79 79 THR CB C 79 68.704 68.704 70.154 -1.450 18792 14090 1 18 . 1 1 79 79 THR H H 79 8.245 8.245 8.323 -0.078 18792 14091 1 18 . 1 1 84 84 TYR N N 84 120.888 120.888 121.840 -0.952 18792 14092 1 18 . 1 1 84 84 TYR C C 84 176.708 176.708 176.841 -0.133 18792 14093 1 18 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.725 -1.293 18792 14094 1 18 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.384 -1.639 18792 14095 1 18 . 1 1 84 84 TYR H H 84 8.733 8.733 7.876 0.857 18792 14096 1 18 . 1 1 85 85 GLN N N 85 114.530 114.530 118.199 -3.669 18792 14097 1 18 . 1 1 85 85 GLN C C 85 178.473 178.473 178.227 0.246 18792 14098 1 18 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.894 -0.600 18792 14099 1 18 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.340 -1.539 18792 14100 1 18 . 1 1 85 85 GLN H H 85 8.413 8.413 8.779 -0.366 18792 14101 1 18 . 1 1 86 86 SER N N 86 114.032 114.032 115.227 -1.195 18792 14102 1 18 . 1 1 86 86 SER C C 86 178.473 178.473 176.895 1.578 18792 14103 1 18 . 1 1 86 86 SER CA C 86 62.175 62.175 61.504 0.671 18792 14104 1 18 . 1 1 86 86 SER CB C 86 63.252 63.252 63.294 -0.042 18792 14105 1 18 . 1 1 86 86 SER H H 86 7.258 7.258 8.503 -1.245 18792 14106 1 18 . 1 1 88 88 GLU N N 88 119.386 119.386 120.715 -1.329 18792 14107 1 18 . 1 1 88 88 GLU C C 88 177.199 177.199 178.849 -1.650 18792 14108 1 18 . 1 1 88 88 GLU CA C 88 58.582 58.582 60.232 -1.650 18792 14109 1 18 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.200 -0.224 18792 14110 1 18 . 1 1 88 88 GLU H H 88 8.534 8.534 8.613 -0.079 18792 14111 1 18 . 1 1 89 89 GLN N N 89 114.678 114.678 118.972 -4.294 18792 14112 1 18 . 1 1 89 89 GLN C C 89 178.669 178.669 178.801 -0.132 18792 14113 1 18 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.305 -0.723 18792 14114 1 18 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.683 -1.261 18792 14115 1 18 . 1 1 89 89 GLN H H 89 7.500 7.500 7.888 -0.388 18792 14116 1 18 . 1 1 90 90 VAL N N 90 118.174 118.174 120.115 -1.941 18792 14117 1 18 . 1 1 90 90 VAL C C 90 178.081 178.081 178.014 0.067 18792 14118 1 18 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.448 0.107 18792 14119 1 18 . 1 1 90 90 VAL CB C 90 30.607 30.607 30.855 -0.248 18792 14120 1 18 . 1 1 90 90 VAL H H 90 7.017 7.017 7.734 -0.717 18792 14121 1 18 . 1 1 91 91 VAL N N 91 119.489 119.489 121.488 -1.999 18792 14122 1 18 . 1 1 91 91 VAL C C 91 177.914 177.914 178.399 -0.485 18792 14123 1 18 . 1 1 91 91 VAL CA C 91 65.769 65.769 67.072 -1.303 18792 14124 1 18 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.125 -0.834 18792 14125 1 18 . 1 1 91 91 VAL H H 91 7.833 7.833 8.721 -0.888 18792 14126 1 18 . 1 1 92 92 ASN N N 92 117.180 117.180 116.672 0.508 18792 14127 1 18 . 1 1 92 92 ASN C C 92 179.110 179.110 176.545 2.565 18792 14128 1 18 . 1 1 92 92 ASN CA C 92 54.918 54.918 55.857 -0.939 18792 14129 1 18 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.102 -2.134 18792 14130 1 18 . 1 1 92 92 ASN H H 92 8.368 8.368 8.662 -0.294 18792 14131 1 18 . 1 1 93 93 GLU N N 93 118.476 118.476 119.344 -0.868 18792 14132 1 18 . 1 1 93 93 GLU C C 93 179.355 179.355 178.780 0.575 18792 14133 1 18 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.639 -0.234 18792 14134 1 18 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.210 -2.477 18792 14135 1 18 . 1 1 93 93 GLU H H 93 7.213 7.213 7.705 -0.492 18792 14136 1 18 . 1 1 94 94 LEU N N 94 120.889 120.889 119.284 1.605 18792 14137 1 18 . 1 1 94 94 LEU C C 94 178.473 178.473 179.311 -0.838 18792 14138 1 18 . 1 1 94 94 LEU CA C 94 57.017 57.017 56.630 0.387 18792 14139 1 18 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.713 -1.783 18792 14140 1 18 . 1 1 94 94 LEU H H 94 7.446 7.446 8.089 -0.643 18792 14141 1 18 . 1 1 95 95 PHE N N 95 112.902 112.902 119.911 -7.009 18792 14142 1 18 . 1 1 95 95 PHE C C 95 176.586 176.586 175.988 0.598 18792 14143 1 18 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.350 -2.191 18792 14144 1 18 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.050 -0.829 18792 14145 1 18 . 1 1 95 95 PHE H H 95 6.916 6.916 8.083 -1.167 18792 14146 1 18 . 1 1 96 96 ARG N N 96 123.729 123.729 118.275 5.454 18792 14147 1 18 . 1 1 96 96 ARG C C 96 177.272 177.272 177.860 -0.588 18792 14148 1 18 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.161 1.062 18792 14149 1 18 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.134 -1.702 18792 14150 1 18 . 1 1 96 96 ARG H H 96 7.126 7.126 7.585 -0.460 18792 14151 1 18 . 1 1 97 97 ASP N N 97 116.576 116.576 117.187 -0.611 18792 14152 1 18 . 1 1 97 97 ASP C C 97 175.687 175.687 176.464 -0.777 18792 14153 1 18 . 1 1 97 97 ASP CA C 97 53.673 53.673 55.235 -1.562 18792 14154 1 18 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.223 -2.178 18792 14155 1 18 . 1 1 97 97 ASP H H 97 8.644 8.644 7.767 0.877 18792 14156 1 18 . 1 1 98 98 GLY N N 98 108.551 108.551 106.343 2.208 18792 14157 1 18 . 1 1 98 98 GLY C C 98 172.690 172.690 172.503 0.187 18792 14158 1 18 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.363 -2.113 18792 14159 1 18 . 1 1 98 98 GLY H H 98 7.463 7.463 7.216 0.247 18792 14160 1 18 . 1 1 99 99 VAL N N 99 120.630 120.630 118.216 2.414 18792 14161 1 18 . 1 1 99 99 VAL C C 99 174.503 174.503 174.384 0.119 18792 14162 1 18 . 1 1 99 99 VAL CA C 99 62.318 62.318 63.511 -1.193 18792 14163 1 18 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.885 -2.122 18792 14164 1 18 . 1 1 99 99 VAL H H 99 8.184 8.184 8.284 -0.100 18792 14165 1 18 . 1 1 100 100 ASN N N 100 115.485 115.485 115.915 -0.430 18792 14166 1 18 . 1 1 100 100 ASN C C 100 175.239 175.239 176.682 -1.443 18792 14167 1 18 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.373 -3.012 18792 14168 1 18 . 1 1 100 100 ASN CB C 100 38.920 38.920 37.660 1.260 18792 14169 1 18 . 1 1 100 100 ASN H H 100 6.241 6.241 8.106 -1.865 18792 14170 1 18 . 1 1 101 101 TRP N N 101 118.266 118.266 121.211 -2.945 18792 14171 1 18 . 1 1 101 101 TRP C C 101 178.301 178.301 177.426 0.875 18792 14172 1 18 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.370 1.169 18792 14173 1 18 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.965 0.865 18792 14174 1 18 . 1 1 101 101 TRP H H 101 8.409 8.409 8.086 0.323 18792 14175 1 18 . 1 1 102 102 GLY N N 102 106.147 106.147 105.805 0.342 18792 14176 1 18 . 1 1 102 102 GLY C C 102 177.640 177.640 175.480 2.160 18792 14177 1 18 . 1 1 102 102 GLY CA C 102 46.914 46.914 45.401 1.513 18792 14178 1 18 . 1 1 102 102 GLY H H 102 8.504 8.504 8.014 0.490 18792 14179 1 18 . 1 1 103 103 ARG N N 103 121.347 121.347 121.646 -0.299 18792 14180 1 18 . 1 1 103 103 ARG C C 103 177.738 177.738 178.367 -0.629 18792 14181 1 18 . 1 1 103 103 ARG CA C 103 57.942 57.942 59.505 -1.563 18792 14182 1 18 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.544 -0.325 18792 14183 1 18 . 1 1 103 103 ARG H H 103 8.099 8.099 8.371 -0.272 18792 14184 1 18 . 1 1 104 104 ILE N N 104 120.930 120.930 120.078 0.852 18792 14185 1 18 . 1 1 104 104 ILE C C 104 178.197 178.197 177.857 0.340 18792 14186 1 18 . 1 1 104 104 ILE CA C 104 66.535 66.535 65.310 1.225 18792 14187 1 18 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.291 -2.246 18792 14188 1 18 . 1 1 104 104 ILE H H 104 7.690 7.690 7.897 -0.207 18792 14189 1 18 . 1 1 105 105 VAL N N 105 120.938 120.938 119.174 1.764 18792 14190 1 18 . 1 1 105 105 VAL C C 105 177.854 177.854 177.847 0.007 18792 14191 1 18 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.021 1.437 18792 14192 1 18 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.717 -0.343 18792 14193 1 18 . 1 1 105 105 VAL H H 105 8.245 8.245 7.513 0.732 18792 14194 1 18 . 1 1 106 106 ALA N N 106 121.165 121.165 121.210 -0.045 18792 14195 1 18 . 1 1 106 106 ALA C C 106 178.284 178.284 179.142 -0.858 18792 14196 1 18 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.215 0.383 18792 14197 1 18 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.762 -1.247 18792 14198 1 18 . 1 1 106 106 ALA H H 106 7.529 7.529 7.810 -0.281 18792 14199 1 18 . 1 1 107 107 PHE N N 107 119.242 119.242 121.608 -2.366 18792 14200 1 18 . 1 1 107 107 PHE C C 107 176.390 176.390 176.405 -0.015 18792 14201 1 18 . 1 1 107 107 PHE CA C 107 60.173 60.173 61.426 -1.253 18792 14202 1 18 . 1 1 107 107 PHE CB C 107 37.087 37.087 39.129 -2.042 18792 14203 1 18 . 1 1 107 107 PHE H H 107 7.974 7.974 7.798 0.176 18792 14204 1 18 . 1 1 108 108 PHE N N 108 120.009 120.009 119.439 0.570 18792 14205 1 18 . 1 1 108 108 PHE C C 108 177.640 177.640 176.597 1.043 18792 14206 1 18 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.104 2.320 18792 14207 1 18 . 1 1 108 108 PHE CB C 108 35.346 35.346 39.000 -3.654 18792 14208 1 18 . 1 1 108 108 PHE H H 108 7.946 7.946 8.416 -0.470 18792 14209 1 18 . 1 1 109 109 SER N N 109 114.631 114.631 116.511 -1.880 18792 14210 1 18 . 1 1 109 109 SER C C 109 177.770 177.770 176.204 1.566 18792 14211 1 18 . 1 1 109 109 SER CA C 109 63.349 63.349 61.501 1.848 18792 14212 1 18 . 1 1 109 109 SER H H 109 8.424 8.424 7.522 0.902 18792 14213 1 18 . 1 1 110 110 PHE N N 110 124.230 124.230 124.472 -0.242 18792 14214 1 18 . 1 1 110 110 PHE C C 110 176.708 176.708 177.081 -0.373 18792 14215 1 18 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.191 0.423 18792 14216 1 18 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.745 -1.301 18792 14217 1 18 . 1 1 110 110 PHE H H 110 9.052 9.052 8.185 0.867 18792 14218 1 18 . 1 1 111 111 GLY N N 111 105.893 105.893 106.152 -0.259 18792 14219 1 18 . 1 1 111 111 GLY C C 111 176.795 176.795 175.675 1.120 18792 14220 1 18 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.158 1.218 18792 14221 1 18 . 1 1 111 111 GLY H H 111 7.926 7.926 8.361 -0.434 18792 14222 1 18 . 1 1 112 112 GLY N N 112 107.410 107.410 109.198 -1.788 18792 14223 1 18 . 1 1 112 112 GLY C C 112 174.650 174.650 175.195 -0.545 18792 14224 1 18 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.173 1.132 18792 14225 1 18 . 1 1 112 112 GLY H H 112 8.799 8.799 7.896 0.903 18792 14226 1 18 . 1 1 113 113 ALA N N 113 124.313 124.313 124.713 -0.400 18792 14227 1 18 . 1 1 113 113 ALA C C 113 181.300 181.300 179.010 2.290 18792 14228 1 18 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.722 -0.195 18792 14229 1 18 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.669 -1.187 18792 14230 1 18 . 1 1 113 113 ALA H H 113 8.212 8.212 7.698 0.514 18792 14231 1 18 . 1 1 114 114 LEU N N 114 118.878 118.878 119.193 -0.315 18792 14232 1 18 . 1 1 114 114 LEU C C 114 180.286 180.286 178.270 2.016 18792 14233 1 18 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.841 -0.859 18792 14234 1 18 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.753 -0.736 18792 14235 1 18 . 1 1 114 114 LEU H H 114 8.161 8.161 7.860 0.301 18792 14236 1 18 . 1 1 115 115 CYS N N 115 119.002 119.002 117.303 1.699 18792 14237 1 18 . 1 1 115 115 CYS C C 115 176.087 176.087 177.062 -0.975 18792 14238 1 18 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.572 0.372 18792 14239 1 18 . 1 1 115 115 CYS CB C 115 25.635 25.635 27.741 -2.106 18792 14240 1 18 . 1 1 115 115 CYS H H 115 8.070 8.070 8.334 -0.264 18792 14241 1 18 . 1 1 116 116 VAL N N 116 118.737 118.737 117.077 1.660 18792 14242 1 18 . 1 1 116 116 VAL C C 116 177.494 177.494 177.416 0.078 18792 14243 1 18 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.010 0.752 18792 14244 1 18 . 1 1 116 116 VAL CB C 116 30.763 30.763 30.822 -0.059 18792 14245 1 18 . 1 1 116 116 VAL H H 116 7.995 7.995 7.798 0.197 18792 14246 1 18 . 1 1 117 117 GLU N N 117 118.886 118.886 120.827 -1.941 18792 14247 1 18 . 1 1 117 117 GLU C C 117 178.424 178.424 178.663 -0.239 18792 14248 1 18 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.102 -0.342 18792 14249 1 18 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.527 -1.473 18792 14250 1 18 . 1 1 117 117 GLU H H 117 8.059 8.059 7.848 0.211 18792 14251 1 18 . 1 1 118 118 SER N N 118 113.417 113.417 116.294 -2.877 18792 14252 1 18 . 1 1 118 118 SER C C 118 175.607 175.607 176.336 -0.729 18792 14253 1 18 . 1 1 118 118 SER CA C 118 62.638 62.638 61.687 0.951 18792 14254 1 18 . 1 1 118 118 SER CB C 118 61.061 61.061 63.101 -2.040 18792 14255 1 18 . 1 1 118 118 SER H H 118 7.626 7.626 7.757 -0.131 18792 14256 1 18 . 1 1 119 119 VAL N N 119 120.612 120.612 120.960 -0.348 18792 14257 1 18 . 1 1 119 119 VAL C C 119 179.713 179.713 177.369 2.344 18792 14258 1 18 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.346 0.880 18792 14259 1 18 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.853 -1.774 18792 14260 1 18 . 1 1 119 119 VAL H H 119 7.297 7.297 7.904 -0.607 18792 14261 1 18 . 1 1 120 120 ASP N N 120 122.546 122.546 119.999 2.547 18792 14262 1 18 . 1 1 120 120 ASP C C 120 178.057 178.057 177.555 0.502 18792 14263 1 18 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.647 0.342 18792 14264 1 18 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.856 -0.933 18792 14265 1 18 . 1 1 120 120 ASP H H 120 8.264 8.264 7.923 0.341 18792 14266 1 18 . 1 1 121 121 LYS N N 121 115.636 115.636 118.388 -2.752 18792 14267 1 18 . 1 1 121 121 LYS C C 121 175.159 175.159 176.419 -1.260 18792 14268 1 18 . 1 1 121 121 LYS CA C 121 55.260 55.260 57.294 -2.034 18792 14269 1 18 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.992 -2.217 18792 14270 1 18 . 1 1 121 121 LYS H H 121 7.558 7.558 7.432 0.126 18792 14271 1 18 . 1 1 122 122 GLU N N 122 113.915 113.915 115.058 -1.143 18792 14272 1 18 . 1 1 122 122 GLU C C 122 176.109 176.109 176.062 0.047 18792 14273 1 18 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.979 -0.672 18792 14274 1 18 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.197 -2.865 18792 14275 1 18 . 1 1 122 122 GLU H H 122 7.826 7.826 8.165 -0.339 18792 14276 1 18 . 1 1 124 124 GLN N N 124 119.233 119.233 121.881 -2.648 18792 14277 1 18 . 1 1 124 124 GLN C C 124 177.640 177.640 176.870 0.770 18792 14278 1 18 . 1 1 124 124 GLN CA C 124 59.472 59.472 57.781 1.691 18792 14279 1 18 . 1 1 124 124 GLN CB C 124 26.490 26.490 27.951 -1.461 18792 14280 1 18 . 1 1 124 124 GLN H H 124 8.626 8.626 8.513 0.113 18792 14281 1 18 . 1 1 125 125 VAL N N 125 117.011 117.011 117.968 -0.957 18792 14282 1 18 . 1 1 125 125 VAL C C 125 175.826 175.826 176.026 -0.200 18792 14283 1 18 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.108 0.028 18792 14284 1 18 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.959 -1.662 18792 14285 1 18 . 1 1 125 125 VAL H H 125 7.870 7.870 8.059 -0.189 18792 14286 1 18 . 1 1 126 126 LEU N N 126 117.058 117.058 115.893 1.165 18792 14287 1 18 . 1 1 126 126 LEU C C 126 178.096 178.096 177.751 0.345 18792 14288 1 18 . 1 1 126 126 LEU CA C 126 55.085 55.085 56.124 -1.039 18792 14289 1 18 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.393 -2.120 18792 14290 1 18 . 1 1 126 126 LEU H H 126 7.747 7.747 7.787 -0.040 18792 14291 1 18 . 1 1 127 127 VAL N N 127 119.457 119.457 120.909 -1.452 18792 14292 1 18 . 1 1 127 127 VAL C C 127 177.150 177.150 177.712 -0.562 18792 14293 1 18 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.650 0.506 18792 14294 1 18 . 1 1 127 127 VAL CB C 127 29.753 29.753 31.668 -1.915 18792 14295 1 18 . 1 1 127 127 VAL H H 127 7.306 7.306 8.083 -0.777 18792 14296 1 18 . 1 1 128 128 SER N N 128 110.647 110.647 113.616 -2.969 18792 14297 1 18 . 1 1 128 128 SER C C 128 177.222 177.222 176.801 0.421 18792 14298 1 18 . 1 1 128 128 SER CA C 128 60.752 60.752 61.212 -0.461 18792 14299 1 18 . 1 1 128 128 SER CB C 128 61.605 61.605 62.742 -1.137 18792 14300 1 18 . 1 1 128 128 SER H H 128 8.237 8.237 8.490 -0.253 18792 14301 1 18 . 1 1 129 129 ARG N N 129 123.100 123.100 122.506 0.594 18792 14302 1 18 . 1 1 129 129 ARG C C 129 175.802 175.802 178.839 -3.037 18792 14303 1 18 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.524 -0.297 18792 14304 1 18 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.199 -2.000 18792 14305 1 18 . 1 1 129 129 ARG H H 129 6.564 6.564 7.925 -1.361 18792 14306 1 18 . 1 1 130 130 ILE N N 130 118.182 118.182 117.737 0.445 18792 14307 1 18 . 1 1 130 130 ILE C C 130 178.156 178.156 178.090 0.066 18792 14308 1 18 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.228 -0.882 18792 14309 1 18 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.409 -0.727 18792 14310 1 18 . 1 1 130 130 ILE H H 130 7.955 7.955 8.686 -0.731 18792 14311 1 18 . 1 1 131 131 ALA N N 131 119.029 119.029 122.804 -3.775 18792 14312 1 18 . 1 1 131 131 ALA C C 131 179.593 179.593 179.182 0.411 18792 14313 1 18 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.156 -0.558 18792 14314 1 18 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.384 -0.996 18792 14315 1 18 . 1 1 131 131 ALA H H 131 7.582 7.582 8.724 -1.142 18792 14316 1 18 . 1 1 132 132 ALA N N 132 120.336 120.336 121.897 -1.561 18792 14317 1 18 . 1 1 132 132 ALA C C 132 181.095 181.095 179.086 2.009 18792 14318 1 18 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.977 -0.379 18792 14319 1 18 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.706 -2.005 18792 14320 1 18 . 1 1 132 132 ALA H H 132 7.224 7.224 7.843 -0.619 18792 14321 1 18 . 1 1 133 133 TRP N N 133 121.194 121.194 120.890 0.304 18792 14322 1 18 . 1 1 133 133 TRP C C 133 179.698 179.698 178.329 1.369 18792 14323 1 18 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.328 -3.026 18792 14324 1 18 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.897 -2.242 18792 14325 1 18 . 1 1 133 133 TRP H H 133 8.925 8.925 8.605 0.320 18792 14326 1 18 . 1 1 134 134 MET N N 134 116.987 116.987 117.998 -1.011 18792 14327 1 18 . 1 1 134 134 MET C C 134 178.277 178.277 178.383 -0.106 18792 14328 1 18 . 1 1 134 134 MET CA C 134 59.578 59.578 59.569 0.008 18792 14329 1 18 . 1 1 134 134 MET CB C 134 33.559 33.559 32.917 0.642 18792 14330 1 18 . 1 1 134 134 MET H H 134 8.863 8.863 8.771 0.092 18792 14331 1 18 . 1 1 135 135 ALA N N 135 120.523 120.523 121.000 -0.477 18792 14332 1 18 . 1 1 135 135 ALA C C 135 179.298 179.298 179.379 -0.081 18792 14333 1 18 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.115 0.318 18792 14334 1 18 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.177 -1.540 18792 14335 1 18 . 1 1 135 135 ALA H H 135 8.152 8.152 8.300 -0.148 18792 14336 1 18 . 1 1 136 136 THR N N 136 116.715 116.715 117.149 -0.434 18792 14337 1 18 . 1 1 136 136 THR C C 136 175.106 175.106 175.916 -0.810 18792 14338 1 18 . 1 1 136 136 THR CA C 136 66.729 66.729 67.672 -0.943 18792 14339 1 18 . 1 1 136 136 THR CB C 136 68.441 68.441 69.152 -0.711 18792 14340 1 18 . 1 1 136 136 THR H H 136 8.532 8.532 8.202 0.330 18792 14341 1 18 . 1 1 137 137 TYR N N 137 123.204 123.204 122.187 1.017 18792 14342 1 18 . 1 1 137 137 TYR C C 137 179.592 179.592 177.183 2.409 18792 14343 1 18 . 1 1 137 137 TYR CA C 137 63.065 63.065 60.036 3.029 18792 14344 1 18 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.526 0.462 18792 14345 1 18 . 1 1 137 137 TYR H H 137 8.809 8.809 7.973 0.836 18792 14346 1 18 . 1 1 138 138 LEU N N 138 119.247 119.247 120.249 -1.002 18792 14347 1 18 . 1 1 138 138 LEU C C 138 178.385 178.385 177.800 0.585 18792 14348 1 18 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.183 0.755 18792 14349 1 18 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.853 -0.145 18792 14350 1 18 . 1 1 138 138 LEU H H 138 8.742 8.742 8.009 0.733 18792 14351 1 18 . 1 1 139 139 ASN N N 139 117.122 117.122 115.070 2.052 18792 14352 1 18 . 1 1 139 139 ASN C C 139 176.417 176.417 177.305 -0.888 18792 14353 1 18 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.352 1.096 18792 14354 1 18 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.102 0.550 18792 14355 1 18 . 1 1 139 139 ASN H H 139 8.307 8.307 7.810 0.497 18792 14356 1 18 . 1 1 140 140 ASP N N 140 115.394 115.394 119.078 -3.684 18792 14357 1 18 . 1 1 140 140 ASP C C 140 177.919 177.919 177.081 0.838 18792 14358 1 18 . 1 1 140 140 ASP CA C 140 55.953 55.953 57.311 -1.358 18792 14359 1 18 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.044 -1.658 18792 14360 1 18 . 1 1 140 140 ASP H H 140 8.439 8.439 8.070 0.369 18792 14361 1 18 . 1 1 141 141 HIS N N 141 111.695 111.695 114.342 -2.647 18792 14362 1 18 . 1 1 141 141 HIS C C 141 175.949 175.949 175.840 0.109 18792 14363 1 18 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.913 -0.856 18792 14364 1 18 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.676 -2.768 18792 14365 1 18 . 1 1 141 141 HIS H H 141 8.043 8.043 7.315 0.728 18792 14366 1 18 . 1 1 142 142 LEU N N 142 117.054 117.054 121.721 -4.667 18792 14367 1 18 . 1 1 142 142 LEU C C 142 176.530 176.530 177.578 -1.048 18792 14368 1 18 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.990 -2.681 18792 14369 1 18 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.747 0.591 18792 14370 1 18 . 1 1 142 142 LEU H H 142 7.198 7.198 7.984 -0.786 18792 14371 1 18 . 1 1 143 143 GLU N N 143 121.335 121.335 120.077 1.258 18792 14372 1 18 . 1 1 143 143 GLU C C 143 173.964 173.964 175.615 -1.651 18792 14373 1 18 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.517 -0.263 18792 14374 1 18 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.164 -1.907 18792 14375 1 18 . 1 1 143 143 GLU H H 143 8.565 8.565 7.719 0.846 18792 14376 1 18 . 1 1 145 145 TRP N N 145 117.973 117.973 119.985 -2.012 18792 14377 1 18 . 1 1 145 145 TRP C C 145 179.526 179.526 177.831 1.695 18792 14378 1 18 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.519 1.087 18792 14379 1 18 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.439 -1.550 18792 14380 1 18 . 1 1 145 145 TRP H H 145 7.078 7.078 8.356 -1.278 18792 14381 1 18 . 1 1 146 146 ILE N N 146 122.101 122.101 111.740 10.361 18792 14382 1 18 . 1 1 146 146 ILE C C 146 179.110 179.110 176.939 2.171 18792 14383 1 18 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.761 3.573 18792 14384 1 18 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.127 -1.305 18792 14385 1 18 . 1 1 146 146 ILE H H 146 8.389 8.389 7.601 0.788 18792 14386 1 18 . 1 1 147 147 GLN N N 147 116.344 116.344 121.286 -4.942 18792 14387 1 18 . 1 1 147 147 GLN C C 147 179.526 179.526 177.815 1.711 18792 14388 1 18 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.956 -0.944 18792 14389 1 18 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.318 -1.595 18792 14390 1 18 . 1 1 147 147 GLN H H 147 8.376 8.376 8.089 0.287 18792 14391 1 18 . 1 1 148 148 GLU N N 148 118.913 118.913 120.214 -1.301 18792 14392 1 18 . 1 1 148 148 GLU C C 148 176.880 176.880 177.597 -0.717 18792 14393 1 18 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.378 -3.005 18792 14394 1 18 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.498 -1.066 18792 14395 1 18 . 1 1 148 148 GLU H H 148 7.504 7.504 7.961 -0.457 18792 14396 1 18 . 1 1 149 149 ASN N N 149 116.616 116.616 113.849 2.767 18792 14397 1 18 . 1 1 149 149 ASN C C 149 173.964 173.964 176.467 -2.503 18792 14398 1 18 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.443 -0.197 18792 14399 1 18 . 1 1 149 149 ASN CB C 149 37.133 37.133 40.322 -3.189 18792 14400 1 18 . 1 1 149 149 ASN H H 149 7.070 7.070 8.170 -1.100 18792 14401 1 18 . 1 1 150 150 GLY N N 150 104.750 104.750 106.062 -1.312 18792 14402 1 18 . 1 1 150 150 GLY C C 150 176.022 176.022 174.640 1.382 18792 14403 1 18 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.476 -0.234 18792 14404 1 18 . 1 1 150 150 GLY H H 150 7.313 7.313 8.092 -0.779 18792 14405 1 18 . 1 1 151 151 GLY N N 151 108.385 108.385 109.195 -0.810 18792 14406 1 18 . 1 1 151 151 GLY C C 151 173.449 173.449 174.851 -1.402 18792 14407 1 18 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.219 -1.187 18792 14408 1 18 . 1 1 151 151 GLY H H 151 8.452 8.452 7.468 0.984 18792 14409 1 18 . 1 1 152 152 TRP N N 152 118.092 118.092 122.635 -4.543 18792 14410 1 18 . 1 1 152 152 TRP C C 152 178.571 178.571 177.563 1.008 18792 14411 1 18 . 1 1 152 152 TRP CA C 152 60.077 60.077 61.983 -1.906 18792 14412 1 18 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.595 -1.006 18792 14413 1 18 . 1 1 152 152 TRP H H 152 8.644 8.644 8.904 -0.260 18792 14414 1 18 . 1 1 153 153 ASP N N 153 117.758 117.758 117.260 0.498 18792 14415 1 18 . 1 1 153 153 ASP C C 153 179.796 179.796 178.391 1.405 18792 14416 1 18 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.488 -0.186 18792 14417 1 18 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.848 -1.617 18792 14418 1 18 . 1 1 153 153 ASP H H 153 8.827 8.827 8.699 0.128 18792 14419 1 18 . 1 1 154 154 THR N N 154 116.817 116.817 116.998 -0.181 18792 14420 1 18 . 1 1 154 154 THR C C 154 175.352 175.352 176.639 -1.287 18792 14421 1 18 . 1 1 154 154 THR CA C 154 65.910 65.910 66.772 -0.861 18792 14422 1 18 . 1 1 154 154 THR CB C 154 67.712 67.712 69.133 -1.421 18792 14423 1 18 . 1 1 154 154 THR H H 154 7.494 7.494 7.644 -0.150 18792 14424 1 18 . 1 1 155 155 PHE N N 155 122.196 122.196 121.666 0.530 18792 14425 1 18 . 1 1 155 155 PHE C C 155 176.831 176.831 177.453 -0.622 18792 14426 1 18 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.564 0.722 18792 14427 1 18 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.160 -1.493 18792 14428 1 18 . 1 1 155 155 PHE H H 155 6.477 6.477 8.620 -2.143 18792 14429 1 18 . 1 1 156 156 VAL N N 156 117.387 117.387 119.433 -2.046 18792 14430 1 18 . 1 1 156 156 VAL C C 156 178.497 178.497 177.804 0.693 18792 14431 1 18 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.327 -0.096 18792 14432 1 18 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.097 -0.412 18792 14433 1 18 . 1 1 156 156 VAL H H 156 7.788 7.788 8.117 -0.329 18792 14434 1 18 . 1 1 157 157 GLU N N 157 119.876 119.876 119.853 0.023 18792 14435 1 18 . 1 1 157 157 GLU C C 157 178.399 178.399 179.084 -0.685 18792 14436 1 18 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.445 -0.685 18792 14437 1 18 . 1 1 157 157 GLU CB C 157 28.277 28.277 30.027 -1.750 18792 14438 1 18 . 1 1 157 157 GLU H H 157 7.409 7.409 8.547 -1.138 18792 14439 1 18 . 1 1 158 158 LEU N N 158 117.194 117.194 120.510 -3.316 18792 14440 1 18 . 1 1 158 158 LEU C C 158 178.595 178.595 177.250 1.345 18792 14441 1 18 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.264 -0.887 18792 14442 1 18 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.398 0.173 18792 14443 1 18 . 1 1 158 158 LEU H H 158 7.584 7.584 7.870 -0.286 18792 14444 1 18 . 1 1 159 159 TYR N N 159 115.549 115.549 113.559 1.990 18792 14445 1 18 . 1 1 159 159 TYR C C 159 177.032 177.032 176.314 0.718 18792 14446 1 18 . 1 1 159 159 TYR CA C 159 59.116 59.116 57.673 1.443 18792 14447 1 18 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.697 -1.098 18792 14448 1 18 . 1 1 159 159 TYR H H 159 8.099 8.099 7.886 0.213 18792 14449 1 18 . 1 1 160 160 GLY N N 160 108.334 108.334 106.579 1.755 18792 14450 1 18 . 1 1 160 160 GLY C C 160 173.973 173.973 174.213 -0.240 18792 14451 1 18 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.914 0.150 18792 14452 1 18 . 1 1 160 160 GLY H H 160 8.020 8.020 7.433 0.587 18792 14453 1 18 . 1 1 161 161 ASN N N 161 118.189 118.189 120.104 -1.915 18792 14454 1 18 . 1 1 161 161 ASN C C 161 175.513 175.513 174.128 1.385 18792 14455 1 18 . 1 1 161 161 ASN CA C 161 53.104 53.104 52.835 0.269 18792 14456 1 18 . 1 1 161 161 ASN CB C 161 38.203 38.203 40.450 -2.247 18792 14457 1 18 . 1 1 161 161 ASN H H 161 8.327 8.327 7.976 0.351 18792 14458 1 18 . 1 1 162 162 ASN N N 162 119.022 119.022 118.478 0.544 18792 14459 1 18 . 1 1 162 162 ASN C C 162 175.690 175.690 174.034 1.656 18792 14460 1 18 . 1 1 162 162 ASN CA C 162 53.424 53.424 52.624 0.800 18792 14461 1 18 . 1 1 162 162 ASN CB C 162 38.203 38.203 38.348 -0.145 18792 14462 1 18 . 1 1 162 162 ASN H H 162 8.363 8.363 8.731 -0.368 18792 14463 1 18 . 1 1 163 163 ALA N N 163 123.275 123.275 125.135 -1.860 18792 14464 1 18 . 1 1 163 163 ALA C C 163 178.598 178.598 178.067 0.531 18792 14465 1 18 . 1 1 163 163 ALA CA C 163 53.238 53.238 52.625 0.613 18792 14466 1 18 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.850 -2.239 18792 14467 1 18 . 1 1 163 163 ALA H H 163 8.103 8.103 8.491 -0.388 18792 14468 1 18 . 1 1 164 164 ALA N N 164 121.521 121.521 122.007 -0.486 18792 14469 1 18 . 1 1 164 164 ALA C C 164 178.642 178.642 179.143 -0.501 18792 14470 1 18 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.622 -2.038 18792 14471 1 18 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.266 -0.447 18792 14472 1 18 . 1 1 164 164 ALA H H 164 8.053 8.053 8.427 -0.374 18792 14473 1 18 . 1 1 165 165 ALA N N 165 122.101 122.101 119.122 2.979 18792 14474 1 18 . 1 1 165 165 ALA C C 165 179.124 179.124 178.738 0.386 18792 14475 1 18 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.193 -1.054 18792 14476 1 18 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.211 -0.233 18792 14477 1 18 . 1 1 165 165 ALA H H 165 7.949 7.949 7.966 -0.017 18792 14478 1 18 . 1 1 166 166 GLU N N 166 118.381 118.381 119.676 -1.295 18792 14479 1 18 . 1 1 166 166 GLU C C 166 177.664 177.664 178.221 -0.557 18792 14480 1 18 . 1 1 166 166 GLU CA C 166 57.088 57.088 57.329 -0.241 18792 14481 1 18 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.796 -1.442 18792 14482 1 18 . 1 1 166 166 GLU H H 166 8.202 8.202 7.734 0.468 18792 14483 1 18 . 1 1 167 167 SER N N 167 115.193 115.193 116.028 -0.835 18792 14484 1 18 . 1 1 167 167 SER C C 167 175.312 175.312 175.162 0.150 18792 14485 1 18 . 1 1 167 167 SER CA C 167 58.831 58.831 60.088 -1.257 18792 14486 1 18 . 1 1 167 167 SER CB C 167 62.537 62.537 63.491 -0.954 18792 14487 1 18 . 1 1 167 167 SER H H 167 8.029 8.029 7.616 0.413 18792 14488 1 18 . 1 1 168 168 ARG N N 168 121.696 121.696 120.866 0.830 18792 14489 1 18 . 1 1 168 168 ARG C C 168 176.880 176.880 175.220 1.660 18792 14490 1 18 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.298 -0.135 18792 14491 1 18 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.106 0.103 18792 14492 1 18 . 1 1 168 168 ARG H H 168 7.967 7.967 8.208 -0.241 18792 14493 1 18 . 1 1 169 169 LYS N N 169 120.917 120.917 120.852 0.065 18792 14494 1 18 . 1 1 169 169 LYS C C 169 177.640 177.640 176.300 1.340 18792 14495 1 18 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.785 -0.088 18792 14496 1 18 . 1 1 169 169 LYS CB C 169 31.462 31.462 33.079 -1.617 18792 14497 1 18 . 1 1 169 169 LYS H H 169 8.011 8.011 7.999 0.012 18792 14498 1 18 . 1 1 170 170 GLY N N 170 109.155 109.155 108.045 1.110 18792 14499 1 18 . 1 1 170 170 GLY C C 170 174.479 174.479 173.219 1.260 18792 14500 1 18 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.070 -0.006 18792 14501 1 18 . 1 1 170 170 GLY H H 170 8.329 8.329 8.800 -0.471 18792 14502 1 18 . 1 1 171 171 GLN N N 171 119.292 119.292 118.214 1.078 18792 14503 1 18 . 1 1 171 171 GLN C C 171 176.463 176.463 174.854 1.609 18792 14504 1 18 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.230 0.436 18792 14505 1 18 . 1 1 171 171 GLN CB C 171 28.199 28.199 31.385 -3.186 18792 14506 1 18 . 1 1 171 171 GLN H H 171 8.035 8.035 8.629 -0.594 18792 14507 1 18 . 1 1 172 172 GLU N N 172 121.703 121.703 120.744 0.959 18792 14508 1 18 . 1 1 172 172 GLU C C 172 176.414 176.414 175.512 0.902 18792 14509 1 18 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.799 0.542 18792 14510 1 18 . 1 1 172 172 GLU CB C 172 28.821 28.821 30.636 -1.815 18792 14511 1 18 . 1 1 172 172 GLU H H 172 8.405 8.405 8.677 -0.272 18792 14512 1 18 . 1 1 173 173 ARG N N 173 121.852 121.852 120.192 1.660 18792 14513 1 18 . 1 1 173 173 ARG C C 173 176.365 176.365 175.176 1.189 18792 14514 1 18 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.641 0.558 18792 14515 1 18 . 1 1 173 173 ARG CB C 173 29.131 29.131 30.967 -1.836 18792 14516 1 18 . 1 1 173 173 ARG H H 173 8.335 8.335 8.520 -0.185 18792 14517 1 18 . 1 1 174 174 LEU N N 174 122.640 122.640 118.914 3.726 18792 14518 1 18 . 1 1 174 174 LEU C C 174 176.523 176.523 175.333 1.190 18792 14519 1 18 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.241 0.527 18792 14520 1 18 . 1 1 174 174 LEU CB C 174 40.784 40.784 44.798 -4.014 18792 14521 1 18 . 1 1 174 174 LEU H H 174 8.082 8.082 8.951 -0.869 18792 14522 1 18 . 1 1 175 175 GLU N N 175 125.909 125.909 118.940 6.969 18792 14523 1 18 . 1 1 175 175 GLU C C 175 181.029 181.029 175.144 5.885 18792 14524 1 18 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.210 1.188 18792 14525 1 18 . 1 1 175 175 GLU CB C 175 30.050 30.050 32.455 -2.405 18792 14526 1 18 . 1 1 175 175 GLU H H 175 7.785 7.785 8.762 -0.977 18792 14527 1 19 . 1 1 4 4 ALA N N 4 124.786 124.786 124.819 -0.033 18792 14528 1 19 . 1 1 4 4 ALA C C 4 178.272 178.272 178.664 -0.392 18792 14529 1 19 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.068 -1.502 18792 14530 1 19 . 1 1 4 4 ALA CB C 4 18.234 18.234 19.138 -0.904 18792 14531 1 19 . 1 1 4 4 ALA H H 4 8.414 8.414 8.242 0.172 18792 14532 1 19 . 1 1 5 5 MET N N 5 119.681 119.681 117.211 2.470 18792 14533 1 19 . 1 1 5 5 MET C C 5 176.929 176.929 176.950 -0.021 18792 14534 1 19 . 1 1 5 5 MET CA C 5 55.594 55.594 55.087 0.507 18792 14535 1 19 . 1 1 5 5 MET CB C 5 31.540 31.540 32.674 -1.134 18792 14536 1 19 . 1 1 5 5 MET H H 5 8.336 8.336 8.281 0.055 18792 14537 1 19 . 1 1 6 6 SER N N 6 116.162 116.162 116.857 -0.695 18792 14538 1 19 . 1 1 6 6 SER C C 6 175.924 175.924 176.116 -0.192 18792 14539 1 19 . 1 1 6 6 SER CA C 6 59.009 59.009 61.023 -2.014 18792 14540 1 19 . 1 1 6 6 SER CB C 6 62.537 62.537 62.704 -0.167 18792 14541 1 19 . 1 1 6 6 SER H H 6 8.272 8.272 8.365 -0.093 18792 14542 1 19 . 1 1 7 7 GLN N N 7 122.263 122.263 122.457 -0.194 18792 14543 1 19 . 1 1 7 7 GLN C C 7 177.027 177.027 178.004 -0.977 18792 14544 1 19 . 1 1 7 7 GLN CA C 7 56.270 56.270 59.246 -2.976 18792 14545 1 19 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.293 -0.554 18792 14546 1 19 . 1 1 7 7 GLN H H 7 8.314 8.314 8.489 -0.175 18792 14547 1 19 . 1 1 8 8 SER N N 8 116.625 116.625 114.588 2.037 18792 14548 1 19 . 1 1 8 8 SER C C 8 176.457 176.457 175.999 0.458 18792 14549 1 19 . 1 1 8 8 SER CA C 8 59.650 59.650 61.829 -2.179 18792 14550 1 19 . 1 1 8 8 SER CB C 8 62.226 62.226 62.790 -0.564 18792 14551 1 19 . 1 1 8 8 SER H H 8 8.333 8.333 7.773 0.560 18792 14552 1 19 . 1 1 9 9 ASN N N 9 121.307 121.307 120.162 1.145 18792 14553 1 19 . 1 1 9 9 ASN C C 9 177.419 177.419 177.432 -0.013 18792 14554 1 19 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.351 -0.864 18792 14555 1 19 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.803 -1.670 18792 14556 1 19 . 1 1 9 9 ASN H H 9 8.611 8.611 8.032 0.579 18792 14557 1 19 . 1 1 10 10 ARG N N 10 119.830 119.830 120.722 -0.892 18792 14558 1 19 . 1 1 10 10 ARG C C 10 177.615 177.615 178.565 -0.950 18792 14559 1 19 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.405 -0.147 18792 14560 1 19 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.171 -1.972 18792 14561 1 19 . 1 1 10 10 ARG H H 10 7.996 7.996 8.726 -0.730 18792 14562 1 19 . 1 1 11 11 GLU N N 11 117.270 117.270 119.351 -2.081 18792 14563 1 19 . 1 1 11 11 GLU C C 11 179.649 179.649 178.987 0.662 18792 14564 1 19 . 1 1 11 11 GLU CA C 11 59.009 59.009 58.810 0.199 18792 14565 1 19 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.169 -1.048 18792 14566 1 19 . 1 1 11 11 GLU H H 11 7.885 7.885 8.410 -0.525 18792 14567 1 19 . 1 1 12 12 LEU N N 12 119.900 119.900 121.031 -1.131 18792 14568 1 19 . 1 1 12 12 LEU C C 12 178.473 178.473 179.001 -0.528 18792 14569 1 19 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.844 -1.151 18792 14570 1 19 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.898 -1.269 18792 14571 1 19 . 1 1 12 12 LEU H H 12 7.691 7.691 8.188 -0.497 18792 14572 1 19 . 1 1 13 13 VAL N N 13 117.320 117.320 118.892 -1.572 18792 14573 1 19 . 1 1 13 13 VAL C C 13 177.272 177.272 178.325 -1.053 18792 14574 1 19 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.531 0.625 18792 14575 1 19 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.574 -0.345 18792 14576 1 19 . 1 1 13 13 VAL H H 13 7.629 7.629 7.813 -0.184 18792 14577 1 19 . 1 1 14 14 VAL N N 14 116.659 116.659 120.924 -4.265 18792 14578 1 19 . 1 1 14 14 VAL C C 14 178.718 178.718 177.220 1.498 18792 14579 1 19 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.080 0.436 18792 14580 1 19 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.502 -1.128 18792 14581 1 19 . 1 1 14 14 VAL H H 14 8.210 8.210 8.285 -0.075 18792 14582 1 19 . 1 1 15 15 ASP N N 15 120.374 120.374 121.582 -1.208 18792 14583 1 19 . 1 1 15 15 ASP C C 15 177.557 177.557 178.204 -0.647 18792 14584 1 19 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.834 0.642 18792 14585 1 19 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.571 1.982 18792 14586 1 19 . 1 1 15 15 ASP H H 15 7.967 7.967 8.816 -0.849 18792 14587 1 19 . 1 1 16 16 PHE N N 16 119.864 119.864 121.153 -1.289 18792 14588 1 19 . 1 1 16 16 PHE C C 16 178.252 178.252 177.492 0.760 18792 14589 1 19 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.704 1.076 18792 14590 1 19 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.855 0.205 18792 14591 1 19 . 1 1 16 16 PHE H H 16 8.228 8.228 7.811 0.417 18792 14592 1 19 . 1 1 17 17 LEU N N 17 116.312 116.312 119.089 -2.777 18792 14593 1 19 . 1 1 17 17 LEU C C 17 179.649 179.649 178.923 0.726 18792 14594 1 19 . 1 1 17 17 LEU CA C 17 57.764 57.764 57.973 -0.209 18792 14595 1 19 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.395 -1.310 18792 14596 1 19 . 1 1 17 17 LEU H H 17 8.766 8.766 8.173 0.593 18792 14597 1 19 . 1 1 18 18 SER N N 18 113.715 113.715 114.984 -1.269 18792 14598 1 19 . 1 1 18 18 SER C C 18 177.362 177.362 176.222 1.140 18792 14599 1 19 . 1 1 18 18 SER CA C 18 61.948 61.948 62.317 -0.369 18792 14600 1 19 . 1 1 18 18 SER CB C 18 63.003 63.003 63.341 -0.338 18792 14601 1 19 . 1 1 18 18 SER H H 18 8.384 8.384 8.203 0.181 18792 14602 1 19 . 1 1 19 19 TYR N N 19 124.570 124.570 123.888 0.682 18792 14603 1 19 . 1 1 19 19 TYR C C 19 178.415 178.415 177.167 1.248 18792 14604 1 19 . 1 1 19 19 TYR CA C 19 59.764 59.764 60.317 -0.553 18792 14605 1 19 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.520 -1.504 18792 14606 1 19 . 1 1 19 19 TYR H H 19 8.155 8.155 8.863 -0.708 18792 14607 1 19 . 1 1 20 20 LYS N N 20 119.739 119.739 119.508 0.231 18792 14608 1 19 . 1 1 20 20 LYS C C 20 180.456 180.456 178.623 1.833 18792 14609 1 19 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.627 -3.139 18792 14610 1 19 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.207 -4.048 18792 14611 1 19 . 1 1 20 20 LYS H H 20 8.224 8.224 7.675 0.549 18792 14612 1 19 . 1 1 21 21 LEU N N 21 118.092 118.092 120.422 -2.330 18792 14613 1 19 . 1 1 21 21 LEU C C 21 179.989 179.989 178.700 1.289 18792 14614 1 19 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.236 -0.110 18792 14615 1 19 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.732 -2.124 18792 14616 1 19 . 1 1 21 21 LEU H H 21 8.586 8.586 7.818 0.768 18792 14617 1 19 . 1 1 22 22 SER N N 22 117.304 117.304 114.514 2.790 18792 14618 1 19 . 1 1 22 22 SER C C 22 180.152 180.152 177.068 3.084 18792 14619 1 19 . 1 1 22 22 SER CA C 22 61.287 61.287 61.299 -0.012 18792 14620 1 19 . 1 1 22 22 SER H H 22 8.266 8.266 7.839 0.427 18792 14621 1 19 . 1 1 23 23 GLN N N 23 122.497 122.497 121.154 1.343 18792 14622 1 19 . 1 1 23 23 GLN C C 23 177.297 177.297 177.492 -0.195 18792 14623 1 19 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.133 -0.191 18792 14624 1 19 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.312 -0.501 18792 14625 1 19 . 1 1 23 23 GLN H H 23 7.571 7.571 7.819 -0.248 18792 14626 1 19 . 1 1 24 24 LYS N N 24 116.038 116.038 118.124 -2.086 18792 14627 1 19 . 1 1 24 24 LYS C C 24 175.704 175.704 176.734 -1.030 18792 14628 1 19 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.308 -2.813 18792 14629 1 19 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.344 -2.115 18792 14630 1 19 . 1 1 24 24 LYS H H 24 7.134 7.134 7.556 -0.422 18792 14631 1 19 . 1 1 25 25 GLY N N 25 105.283 105.283 106.100 -0.817 18792 14632 1 19 . 1 1 25 25 GLY C C 25 174.013 174.013 173.028 0.985 18792 14633 1 19 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.426 0.353 18792 14634 1 19 . 1 1 25 25 GLY H H 25 7.483 7.483 7.705 -0.222 18792 14635 1 19 . 1 1 26 26 TYR N N 26 119.547 119.547 122.354 -2.807 18792 14636 1 19 . 1 1 26 26 TYR C C 26 175.122 175.122 173.591 1.531 18792 14637 1 19 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.524 -1.392 18792 14638 1 19 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.391 0.689 18792 14639 1 19 . 1 1 26 26 TYR H H 26 7.788 7.788 7.450 0.338 18792 14640 1 19 . 1 1 27 27 SER N N 27 115.088 115.088 120.821 -5.733 18792 14641 1 19 . 1 1 27 27 SER C C 27 174.452 174.452 174.652 -0.200 18792 14642 1 19 . 1 1 27 27 SER CA C 27 56.306 56.306 57.257 -0.951 18792 14643 1 19 . 1 1 27 27 SER CB C 27 63.921 63.921 64.538 -0.617 18792 14644 1 19 . 1 1 27 27 SER H H 27 8.473 8.473 7.962 0.511 18792 14645 1 19 . 1 1 28 28 TRP N N 28 127.014 127.014 126.331 0.683 18792 14646 1 19 . 1 1 28 28 TRP C C 28 177.002 177.002 177.437 -0.435 18792 14647 1 19 . 1 1 28 28 TRP CA C 28 59.472 59.472 60.249 -0.777 18792 14648 1 19 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.245 0.585 18792 14649 1 19 . 1 1 28 28 TRP H H 28 8.897 8.897 8.352 0.545 18792 14650 1 19 . 1 1 29 29 SER N N 29 112.044 112.044 109.125 2.919 18792 14651 1 19 . 1 1 29 29 SER C C 29 175.106 175.106 175.154 -0.048 18792 14652 1 19 . 1 1 29 29 SER CA C 29 59.472 59.472 58.785 0.687 18792 14653 1 19 . 1 1 29 29 SER CB C 29 62.226 62.226 63.122 -0.896 18792 14654 1 19 . 1 1 29 29 SER H H 29 8.129 8.129 8.237 -0.108 18792 14655 1 19 . 1 1 30 30 GLN N N 30 119.160 119.160 119.193 -0.033 18792 14656 1 19 . 1 1 30 30 GLN C C 30 176.218 176.218 174.772 1.446 18792 14657 1 19 . 1 1 30 30 GLN CA C 30 56.412 56.412 55.910 0.502 18792 14658 1 19 . 1 1 30 30 GLN CB C 30 27.578 27.578 30.125 -2.547 18792 14659 1 19 . 1 1 30 30 GLN H H 30 7.370 7.370 8.105 -0.735 18792 14660 1 19 . 1 1 31 31 PHE N N 31 116.277 116.277 119.283 -3.006 18792 14661 1 19 . 1 1 31 31 PHE C C 31 175.217 175.217 174.563 0.654 18792 14662 1 19 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.375 -2.141 18792 14663 1 19 . 1 1 31 31 PHE CB C 31 39.066 39.066 41.916 -2.850 18792 14664 1 19 . 1 1 31 31 PHE H H 31 7.248 7.248 7.799 -0.551 18792 14665 1 19 . 1 1 32 32 SER N N 32 113.683 113.683 116.120 -2.437 18792 14666 1 19 . 1 1 32 32 SER C C 32 173.793 173.793 173.663 0.130 18792 14667 1 19 . 1 1 32 32 SER CA C 32 57.124 57.124 57.472 -0.348 18792 14668 1 19 . 1 1 32 32 SER CB C 32 63.081 63.081 65.394 -2.313 18792 14669 1 19 . 1 1 32 32 SER H H 32 7.242 7.242 7.677 -0.435 18792 14670 1 19 . 1 1 33 33 ASP N N 33 122.195 122.195 122.527 -0.332 18792 14671 1 19 . 1 1 33 33 ASP C C 33 176.394 176.394 175.309 1.085 18792 14672 1 19 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.119 -1.371 18792 14673 1 19 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.928 -0.530 18792 14674 1 19 . 1 1 33 33 ASP H H 33 8.257 8.257 8.658 -0.401 18792 14675 1 19 . 1 1 34 34 VAL N N 34 118.913 118.913 117.924 0.989 18792 14676 1 19 . 1 1 34 34 VAL C C 34 176.328 176.328 174.427 1.901 18792 14677 1 19 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.326 -0.435 18792 14678 1 19 . 1 1 34 34 VAL CB C 34 32.015 32.015 32.888 -0.873 18792 14679 1 19 . 1 1 34 34 VAL H H 34 7.852 7.852 7.992 -0.140 18792 14680 1 19 . 1 1 35 35 GLU N N 35 124.205 124.205 120.244 3.961 18792 14681 1 19 . 1 1 35 35 GLU C C 35 176.586 176.586 174.911 1.675 18792 14682 1 19 . 1 1 35 35 GLU CA C 35 56.057 56.057 56.164 -0.107 18792 14683 1 19 . 1 1 35 35 GLU CB C 35 28.898 28.898 32.436 -3.538 18792 14684 1 19 . 1 1 35 35 GLU H H 35 8.401 8.401 8.012 0.389 18792 14685 1 19 . 1 1 36 36 GLU N N 36 121.670 121.670 120.954 0.716 18792 14686 1 19 . 1 1 36 36 GLU C C 36 176.218 176.218 174.998 1.220 18792 14687 1 19 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.522 -0.534 18792 14688 1 19 . 1 1 36 36 GLU CB C 36 29.442 29.442 31.996 -2.554 18792 14689 1 19 . 1 1 36 36 GLU H H 36 8.239 8.239 8.526 -0.287 18792 14690 1 19 . 1 1 37 37 ASN N N 37 119.252 119.252 116.664 2.588 18792 14691 1 19 . 1 1 37 37 ASN C C 37 175.003 175.003 173.977 1.026 18792 14692 1 19 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.876 -1.221 18792 14693 1 19 . 1 1 37 37 ASN CB C 37 38.212 38.212 38.334 -0.122 18792 14694 1 19 . 1 1 37 37 ASN H H 37 8.412 8.412 8.059 0.353 18792 14695 1 19 . 1 1 38 38 ARG N N 38 121.622 121.622 120.456 1.166 18792 14696 1 19 . 1 1 38 38 ARG C C 38 176.610 176.610 175.523 1.087 18792 14697 1 19 . 1 1 38 38 ARG CA C 38 55.364 55.364 57.176 -1.812 18792 14698 1 19 . 1 1 38 38 ARG CB C 38 29.419 29.419 30.707 -1.288 18792 14699 1 19 . 1 1 38 38 ARG H H 38 8.227 8.227 8.477 -0.250 18792 14700 1 19 . 1 1 39 39 THR N N 39 115.681 115.681 115.195 0.486 18792 14701 1 19 . 1 1 39 39 THR C C 39 174.500 174.500 174.678 -0.178 18792 14702 1 19 . 1 1 39 39 THR CA C 39 61.606 61.606 61.854 -0.248 18792 14703 1 19 . 1 1 39 39 THR CB C 39 69.163 69.163 68.966 0.197 18792 14704 1 19 . 1 1 39 39 THR H H 39 8.173 8.173 8.182 -0.009 18792 14705 1 19 . 1 1 40 40 GLU N N 40 122.708 122.708 123.378 -0.670 18792 14706 1 19 . 1 1 40 40 GLU C C 40 175.728 175.728 175.984 -0.256 18792 14707 1 19 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.806 -1.034 18792 14708 1 19 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.569 -0.514 18792 14709 1 19 . 1 1 40 40 GLU H H 40 8.298 8.298 8.481 -0.183 18792 14710 1 19 . 1 1 41 41 ALA N N 41 125.922 125.922 122.864 3.058 18792 14711 1 19 . 1 1 41 41 ALA C C 41 175.557 175.557 175.444 0.113 18792 14712 1 19 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.600 -1.627 18792 14713 1 19 . 1 1 41 41 ALA CB C 41 17.245 17.245 17.897 -0.652 18792 14714 1 19 . 1 1 41 41 ALA H H 41 8.212 8.212 8.214 -0.002 18792 14715 1 19 . 1 1 43 43 GLU N N 43 120.783 120.783 122.637 -1.854 18792 14716 1 19 . 1 1 43 43 GLU C C 43 177.174 177.174 176.293 0.881 18792 14717 1 19 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.142 0.198 18792 14718 1 19 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.030 0.257 18792 14719 1 19 . 1 1 43 43 GLU H H 43 8.519 8.519 8.361 0.158 18792 14720 1 19 . 1 1 44 44 GLY N N 44 110.022 110.022 111.641 -1.619 18792 14721 1 19 . 1 1 44 44 GLY C C 44 174.773 174.773 174.681 0.092 18792 14722 1 19 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.964 -0.936 18792 14723 1 19 . 1 1 44 44 GLY H H 44 8.429 8.429 8.351 0.078 18792 14724 1 19 . 1 1 45 45 THR N N 45 112.790 112.790 110.076 2.714 18792 14725 1 19 . 1 1 45 45 THR C C 45 175.726 175.726 174.161 1.565 18792 14726 1 19 . 1 1 45 45 THR CA C 45 61.987 61.987 61.678 0.309 18792 14727 1 19 . 1 1 45 45 THR CB C 45 69.304 69.304 70.082 -0.778 18792 14728 1 19 . 1 1 45 45 THR H H 45 8.125 8.125 7.795 0.330 18792 14729 1 19 . 1 1 46 46 GLU N N 46 122.752 122.752 121.381 1.371 18792 14730 1 19 . 1 1 46 46 GLU C C 46 177.419 177.419 175.795 1.624 18792 14731 1 19 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.124 1.107 18792 14732 1 19 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.663 -1.464 18792 14733 1 19 . 1 1 46 46 GLU H H 46 8.765 8.765 8.191 0.574 18792 14734 1 19 . 1 1 47 47 SER N N 47 114.895 114.895 113.079 1.816 18792 14735 1 19 . 1 1 47 47 SER C C 47 175.826 175.826 175.056 0.770 18792 14736 1 19 . 1 1 47 47 SER CA C 47 58.582 58.582 57.925 0.657 18792 14737 1 19 . 1 1 47 47 SER CB C 47 62.537 62.537 63.145 -0.608 18792 14738 1 19 . 1 1 47 47 SER H H 47 8.355 8.355 7.928 0.427 18792 14739 1 19 . 1 1 48 48 GLU N N 48 122.429 122.429 122.586 -0.157 18792 14740 1 19 . 1 1 48 48 GLU C C 48 178.099 178.099 177.533 0.566 18792 14741 1 19 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.140 -0.522 18792 14742 1 19 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.181 -0.706 18792 14743 1 19 . 1 1 48 48 GLU H H 48 8.139 8.139 8.860 -0.721 18792 14744 1 19 . 1 1 49 49 ALA N N 49 120.374 120.374 122.642 -2.268 18792 14745 1 19 . 1 1 49 49 ALA C C 49 180.843 180.843 179.494 1.349 18792 14746 1 19 . 1 1 49 49 ALA CA C 49 54.483 54.483 55.215 -0.732 18792 14747 1 19 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.191 -0.756 18792 14748 1 19 . 1 1 49 49 ALA H H 49 8.079 8.079 8.254 -0.175 18792 14749 1 19 . 1 1 50 50 VAL N N 50 118.599 118.599 118.488 0.111 18792 14750 1 19 . 1 1 50 50 VAL C C 50 176.921 176.921 177.948 -1.027 18792 14751 1 19 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.624 -0.064 18792 14752 1 19 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.155 -0.858 18792 14753 1 19 . 1 1 50 50 VAL H H 50 7.419 7.419 8.068 -0.649 18792 14754 1 19 . 1 1 51 51 LYS N N 51 117.469 117.469 120.141 -2.672 18792 14755 1 19 . 1 1 51 51 LYS C C 51 179.061 179.061 179.073 -0.012 18792 14756 1 19 . 1 1 51 51 LYS CA C 51 59.223 59.223 60.381 -1.158 18792 14757 1 19 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.134 -1.138 18792 14758 1 19 . 1 1 51 51 LYS H H 51 7.359 7.359 7.744 -0.385 18792 14759 1 19 . 1 1 52 52 GLN N N 52 115.930 115.930 118.198 -2.268 18792 14760 1 19 . 1 1 52 52 GLN C C 52 177.713 177.713 178.062 -0.349 18792 14761 1 19 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.543 -0.067 18792 14762 1 19 . 1 1 52 52 GLN CB C 52 26.568 26.568 27.476 -0.908 18792 14763 1 19 . 1 1 52 52 GLN H H 52 8.025 8.025 7.821 0.204 18792 14764 1 19 . 1 1 53 53 ALA N N 53 119.782 119.782 122.742 -2.960 18792 14765 1 19 . 1 1 53 53 ALA C C 53 180.008 180.008 179.184 0.824 18792 14766 1 19 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.931 -0.546 18792 14767 1 19 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.344 -0.829 18792 14768 1 19 . 1 1 53 53 ALA H H 53 7.655 7.655 7.801 -0.146 18792 14769 1 19 . 1 1 54 54 LEU N N 54 120.443 120.443 119.108 1.335 18792 14770 1 19 . 1 1 54 54 LEU C C 54 179.330 179.330 178.669 0.661 18792 14771 1 19 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.836 1.177 18792 14772 1 19 . 1 1 54 54 LEU CB C 54 40.862 40.862 42.195 -1.333 18792 14773 1 19 . 1 1 54 54 LEU H H 54 8.419 8.419 7.981 0.438 18792 14774 1 19 . 1 1 55 55 ARG N N 55 118.423 118.423 120.289 -1.866 18792 14775 1 19 . 1 1 55 55 ARG C C 55 178.767 178.767 178.596 0.171 18792 14776 1 19 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.475 0.922 18792 14777 1 19 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.791 -1.048 18792 14778 1 19 . 1 1 55 55 ARG H H 55 8.062 8.062 8.089 -0.027 18792 14779 1 19 . 1 1 56 56 GLU N N 56 115.988 115.988 118.313 -2.325 18792 14780 1 19 . 1 1 56 56 GLU C C 56 180.090 180.090 178.296 1.794 18792 14781 1 19 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.518 -0.758 18792 14782 1 19 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.771 -1.417 18792 14783 1 19 . 1 1 56 56 GLU H H 56 7.772 7.772 8.371 -0.599 18792 14784 1 19 . 1 1 57 57 ALA N N 57 122.837 122.837 121.158 1.679 18792 14785 1 19 . 1 1 57 57 ALA C C 57 181.861 181.861 179.685 2.176 18792 14786 1 19 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.764 -0.131 18792 14787 1 19 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.448 0.025 18792 14788 1 19 . 1 1 57 57 ALA H H 57 8.774 8.774 7.585 1.189 18792 14789 1 19 . 1 1 58 58 GLY N N 58 108.409 108.409 106.408 2.001 18792 14790 1 19 . 1 1 58 58 GLY C C 58 175.331 175.331 175.857 -0.526 18792 14791 1 19 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.939 -0.271 18792 14792 1 19 . 1 1 58 58 GLY H H 58 9.073 9.073 8.570 0.503 18792 14793 1 19 . 1 1 59 59 ASP N N 59 122.074 122.074 122.677 -0.603 18792 14794 1 19 . 1 1 59 59 ASP C C 59 179.023 179.023 177.880 1.143 18792 14795 1 19 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.208 0.094 18792 14796 1 19 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.829 -1.987 18792 14797 1 19 . 1 1 59 59 ASP H H 59 8.049 8.049 8.127 -0.078 18792 14798 1 19 . 1 1 60 60 GLU N N 60 120.131 120.131 119.827 0.304 18792 14799 1 19 . 1 1 60 60 GLU C C 60 178.522 178.522 179.151 -0.629 18792 14800 1 19 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.288 -0.279 18792 14801 1 19 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.785 -1.587 18792 14802 1 19 . 1 1 60 60 GLU H H 60 8.136 8.136 7.955 0.181 18792 14803 1 19 . 1 1 61 61 PHE N N 61 121.309 121.309 119.233 2.076 18792 14804 1 19 . 1 1 61 61 PHE C C 61 176.904 176.904 177.558 -0.654 18792 14805 1 19 . 1 1 61 61 PHE CA C 61 61.322 61.322 62.065 -0.743 18792 14806 1 19 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.419 -0.810 18792 14807 1 19 . 1 1 61 61 PHE H H 61 8.523 8.523 8.107 0.416 18792 14808 1 19 . 1 1 62 62 GLU N N 62 115.971 115.971 119.538 -3.567 18792 14809 1 19 . 1 1 62 62 GLU C C 62 177.713 177.713 177.763 -0.050 18792 14810 1 19 . 1 1 62 62 GLU CA C 62 58.191 58.191 58.880 -0.689 18792 14811 1 19 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.946 -1.669 18792 14812 1 19 . 1 1 62 62 GLU H H 62 7.969 7.969 8.124 -0.155 18792 14813 1 19 . 1 1 63 63 LEU N N 63 116.703 116.703 119.586 -2.883 18792 14814 1 19 . 1 1 63 63 LEU C C 63 178.963 178.963 179.049 -0.086 18792 14815 1 19 . 1 1 63 63 LEU CA C 63 56.412 56.412 57.719 -1.307 18792 14816 1 19 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.291 -0.885 18792 14817 1 19 . 1 1 63 63 LEU H H 63 7.347 7.347 8.213 -0.867 18792 14818 1 19 . 1 1 64 64 ARG N N 64 117.453 117.453 117.369 0.084 18792 14819 1 19 . 1 1 64 64 ARG C C 64 177.297 177.297 176.318 0.979 18792 14820 1 19 . 1 1 64 64 ARG CA C 64 57.337 57.337 57.321 0.017 18792 14821 1 19 . 1 1 64 64 ARG CB C 64 29.597 29.597 31.035 -1.438 18792 14822 1 19 . 1 1 64 64 ARG H H 64 7.995 7.995 7.565 0.430 18792 14823 1 19 . 1 1 65 65 TYR N N 65 118.956 118.956 117.002 1.954 18792 14824 1 19 . 1 1 65 65 TYR C C 65 175.278 175.278 175.387 -0.109 18792 14825 1 19 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.969 -3.268 18792 14826 1 19 . 1 1 65 65 TYR CB C 65 35.986 35.986 35.381 0.605 18792 14827 1 19 . 1 1 65 65 TYR H H 65 7.909 7.909 7.532 0.377 18792 14828 1 19 . 1 1 66 66 ARG N N 66 119.438 119.438 121.105 -1.667 18792 14829 1 19 . 1 1 66 66 ARG C C 66 178.424 178.424 177.641 0.783 18792 14830 1 19 . 1 1 66 66 ARG CA C 66 58.476 58.476 57.561 0.915 18792 14831 1 19 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.669 -1.848 18792 14832 1 19 . 1 1 66 66 ARG H H 66 7.244 7.244 8.105 -0.861 18792 14833 1 19 . 1 1 67 67 ARG N N 67 118.936 118.936 126.163 -7.227 18792 14834 1 19 . 1 1 67 67 ARG C C 67 177.542 177.542 178.004 -0.462 18792 14835 1 19 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.578 -2.134 18792 14836 1 19 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.704 -1.583 18792 14837 1 19 . 1 1 67 67 ARG H H 67 8.417 8.417 8.921 -0.504 18792 14838 1 19 . 1 1 68 68 ALA N N 68 121.797 121.797 121.460 0.337 18792 14839 1 19 . 1 1 68 68 ALA C C 68 180.337 180.337 179.802 0.535 18792 14840 1 19 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.608 -0.472 18792 14841 1 19 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.897 -0.430 18792 14842 1 19 . 1 1 68 68 ALA H H 68 7.827 7.827 8.203 -0.376 18792 14843 1 19 . 1 1 69 69 PHE N N 69 115.986 115.986 116.120 -0.134 18792 14844 1 19 . 1 1 69 69 PHE C C 69 177.468 177.468 177.876 -0.408 18792 14845 1 19 . 1 1 69 69 PHE CA C 69 58.049 58.049 58.293 -0.244 18792 14846 1 19 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.120 -0.521 18792 14847 1 19 . 1 1 69 69 PHE H H 69 8.517 8.517 7.496 1.021 18792 14848 1 19 . 1 1 70 70 SER N N 70 116.526 116.526 117.150 -0.624 18792 14849 1 19 . 1 1 70 70 SER C C 70 177.640 177.640 176.854 0.786 18792 14850 1 19 . 1 1 70 70 SER CA C 70 61.073 61.073 62.084 -1.011 18792 14851 1 19 . 1 1 70 70 SER CB C 70 61.993 61.993 62.963 -0.970 18792 14852 1 19 . 1 1 70 70 SER H H 70 8.152 8.152 7.880 0.272 18792 14853 1 19 . 1 1 71 71 ASP N N 71 121.181 121.181 121.530 -0.349 18792 14854 1 19 . 1 1 71 71 ASP C C 71 178.546 178.546 178.638 -0.092 18792 14855 1 19 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.452 -1.004 18792 14856 1 19 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.894 -1.663 18792 14857 1 19 . 1 1 71 71 ASP H H 71 8.356 8.356 8.072 0.284 18792 14858 1 19 . 1 1 72 72 LEU N N 72 120.747 120.747 120.847 -0.100 18792 14859 1 19 . 1 1 72 72 LEU C C 72 178.963 178.963 178.262 0.701 18792 14860 1 19 . 1 1 72 72 LEU CA C 72 57.444 57.444 57.995 -0.551 18792 14861 1 19 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.284 -1.267 18792 14862 1 19 . 1 1 72 72 LEU H H 72 7.738 7.738 7.409 0.330 18792 14863 1 19 . 1 1 73 73 THR N N 73 109.432 109.432 113.316 -3.884 18792 14864 1 19 . 1 1 73 73 THR C C 73 177.481 177.481 176.331 1.150 18792 14865 1 19 . 1 1 73 73 THR CA C 73 65.128 65.128 65.735 -0.607 18792 14866 1 19 . 1 1 73 73 THR CB C 73 67.720 67.720 68.925 -1.205 18792 14867 1 19 . 1 1 73 73 THR H H 73 8.296 8.296 8.469 -0.173 18792 14868 1 19 . 1 1 74 74 SER N N 74 115.862 115.862 114.973 0.889 18792 14869 1 19 . 1 1 74 74 SER C C 74 175.361 175.361 176.641 -1.280 18792 14870 1 19 . 1 1 74 74 SER CA C 74 60.112 60.112 60.798 -0.686 18792 14871 1 19 . 1 1 74 74 SER CB C 74 62.537 62.537 63.088 -0.551 18792 14872 1 19 . 1 1 74 74 SER H H 74 7.629 7.629 8.295 -0.666 18792 14873 1 19 . 1 1 75 75 GLN N N 75 118.551 118.551 119.916 -1.365 18792 14874 1 19 . 1 1 75 75 GLN C C 75 176.316 176.316 176.183 0.133 18792 14875 1 19 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.491 -0.687 18792 14876 1 19 . 1 1 75 75 GLN CB C 75 28.277 28.277 30.550 -2.273 18792 14877 1 19 . 1 1 75 75 GLN H H 75 7.640 7.640 7.653 -0.013 18792 14878 1 19 . 1 1 76 76 LEU N N 76 118.313 118.313 118.631 -0.318 18792 14879 1 19 . 1 1 76 76 LEU C C 76 174.160 174.160 175.821 -1.661 18792 14880 1 19 . 1 1 76 76 LEU CA C 76 54.740 54.740 52.871 1.869 18792 14881 1 19 . 1 1 76 76 LEU CB C 76 42.727 42.727 40.945 1.782 18792 14882 1 19 . 1 1 76 76 LEU H H 76 7.411 7.411 7.581 -0.170 18792 14883 1 19 . 1 1 77 77 HIS N N 77 120.104 120.104 117.896 2.208 18792 14884 1 19 . 1 1 77 77 HIS C C 77 174.528 174.528 175.843 -1.315 18792 14885 1 19 . 1 1 77 77 HIS CA C 77 54.207 54.207 55.107 -0.900 18792 14886 1 19 . 1 1 77 77 HIS CB C 77 27.966 27.966 27.306 0.660 18792 14887 1 19 . 1 1 77 77 HIS H H 77 8.117 8.117 8.083 0.034 18792 14888 1 19 . 1 1 78 78 ILE N N 78 122.298 122.298 119.608 2.690 18792 14889 1 19 . 1 1 78 78 ILE C C 78 174.240 174.240 174.067 0.173 18792 14890 1 19 . 1 1 78 78 ILE CA C 78 61.402 61.402 61.766 -0.364 18792 14891 1 19 . 1 1 78 78 ILE CB C 78 37.591 37.591 37.214 0.377 18792 14892 1 19 . 1 1 78 78 ILE H H 78 8.655 8.655 8.133 0.522 18792 14893 1 19 . 1 1 79 79 THR N N 79 116.442 116.442 111.917 4.525 18792 14894 1 19 . 1 1 79 79 THR C C 79 174.291 174.291 172.933 1.358 18792 14895 1 19 . 1 1 79 79 THR CA C 79 61.632 61.632 60.917 0.715 18792 14896 1 19 . 1 1 79 79 THR CB C 79 68.704 68.704 68.599 0.105 18792 14897 1 19 . 1 1 79 79 THR H H 79 8.245 8.245 7.620 0.625 18792 14898 1 19 . 1 1 84 84 TYR N N 84 120.888 120.888 120.376 0.512 18792 14899 1 19 . 1 1 84 84 TYR C C 84 176.708 176.708 177.607 -0.899 18792 14900 1 19 . 1 1 84 84 TYR CA C 84 60.432 60.432 62.253 -1.821 18792 14901 1 19 . 1 1 84 84 TYR CB C 84 36.745 36.745 38.704 -1.959 18792 14902 1 19 . 1 1 84 84 TYR H H 84 8.733 8.733 8.816 -0.083 18792 14903 1 19 . 1 1 85 85 GLN N N 85 114.530 114.530 118.584 -4.054 18792 14904 1 19 . 1 1 85 85 GLN C C 85 178.473 178.473 178.937 -0.464 18792 14905 1 19 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.572 -0.278 18792 14906 1 19 . 1 1 85 85 GLN CB C 85 26.801 26.801 27.880 -1.079 18792 14907 1 19 . 1 1 85 85 GLN H H 85 8.413 8.413 8.540 -0.127 18792 14908 1 19 . 1 1 86 86 SER N N 86 114.032 114.032 115.831 -1.799 18792 14909 1 19 . 1 1 86 86 SER C C 86 178.473 178.473 177.012 1.461 18792 14910 1 19 . 1 1 86 86 SER CA C 86 62.175 62.175 61.455 0.720 18792 14911 1 19 . 1 1 86 86 SER CB C 86 63.252 63.252 62.741 0.511 18792 14912 1 19 . 1 1 86 86 SER H H 86 7.258 7.258 8.209 -0.951 18792 14913 1 19 . 1 1 88 88 GLU N N 88 119.386 119.386 120.429 -1.043 18792 14914 1 19 . 1 1 88 88 GLU C C 88 177.199 177.199 178.881 -1.682 18792 14915 1 19 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.817 -1.235 18792 14916 1 19 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.260 -0.284 18792 14917 1 19 . 1 1 88 88 GLU H H 88 8.534 8.534 8.432 0.102 18792 14918 1 19 . 1 1 89 89 GLN N N 89 114.678 114.678 118.802 -4.124 18792 14919 1 19 . 1 1 89 89 GLN C C 89 178.669 178.669 178.706 -0.037 18792 14920 1 19 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.806 -0.224 18792 14921 1 19 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.801 -1.379 18792 14922 1 19 . 1 1 89 89 GLN H H 89 7.500 7.500 7.706 -0.206 18792 14923 1 19 . 1 1 90 90 VAL N N 90 118.174 118.174 119.342 -1.168 18792 14924 1 19 . 1 1 90 90 VAL C C 90 178.081 178.081 178.565 -0.484 18792 14925 1 19 . 1 1 90 90 VAL CA C 90 65.555 65.555 66.361 -0.806 18792 14926 1 19 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.091 -0.484 18792 14927 1 19 . 1 1 90 90 VAL H H 90 7.017 7.017 7.828 -0.811 18792 14928 1 19 . 1 1 91 91 VAL N N 91 119.489 119.489 118.530 0.959 18792 14929 1 19 . 1 1 91 91 VAL C C 91 177.914 177.914 177.880 0.034 18792 14930 1 19 . 1 1 91 91 VAL CA C 91 65.769 65.769 67.076 -1.307 18792 14931 1 19 . 1 1 91 91 VAL CB C 91 30.291 30.291 31.267 -0.976 18792 14932 1 19 . 1 1 91 91 VAL H H 91 7.833 7.833 8.767 -0.934 18792 14933 1 19 . 1 1 92 92 ASN N N 92 117.180 117.180 118.124 -0.944 18792 14934 1 19 . 1 1 92 92 ASN C C 92 179.110 179.110 176.971 2.139 18792 14935 1 19 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.280 -1.362 18792 14936 1 19 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.683 -2.715 18792 14937 1 19 . 1 1 92 92 ASN H H 92 8.368 8.368 8.223 0.145 18792 14938 1 19 . 1 1 93 93 GLU N N 93 118.476 118.476 118.863 -0.387 18792 14939 1 19 . 1 1 93 93 GLU C C 93 179.355 179.355 179.143 0.212 18792 14940 1 19 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.813 -0.408 18792 14941 1 19 . 1 1 93 93 GLU CB C 93 27.733 27.733 30.237 -2.504 18792 14942 1 19 . 1 1 93 93 GLU H H 93 7.213 7.213 8.211 -0.998 18792 14943 1 19 . 1 1 94 94 LEU N N 94 120.889 120.889 120.180 0.709 18792 14944 1 19 . 1 1 94 94 LEU C C 94 178.473 178.473 178.680 -0.207 18792 14945 1 19 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.191 -0.174 18792 14946 1 19 . 1 1 94 94 LEU CB C 94 39.930 39.930 42.064 -2.134 18792 14947 1 19 . 1 1 94 94 LEU H H 94 7.446 7.446 8.147 -0.701 18792 14948 1 19 . 1 1 95 95 PHE N N 95 112.902 112.902 118.550 -5.648 18792 14949 1 19 . 1 1 95 95 PHE C C 95 176.586 176.586 176.926 -0.340 18792 14950 1 19 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.117 -1.958 18792 14951 1 19 . 1 1 95 95 PHE CB C 95 38.221 38.221 39.219 -0.998 18792 14952 1 19 . 1 1 95 95 PHE H H 95 6.916 6.916 7.915 -0.999 18792 14953 1 19 . 1 1 96 96 ARG N N 96 123.729 123.729 119.390 4.339 18792 14954 1 19 . 1 1 96 96 ARG C C 96 177.272 177.272 176.468 0.804 18792 14955 1 19 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.111 1.112 18792 14956 1 19 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.745 -2.313 18792 14957 1 19 . 1 1 96 96 ARG H H 96 7.126 7.126 7.705 -0.579 18792 14958 1 19 . 1 1 97 97 ASP N N 97 116.576 116.576 115.721 0.855 18792 14959 1 19 . 1 1 97 97 ASP C C 97 175.687 175.687 174.823 0.864 18792 14960 1 19 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.245 -0.572 18792 14961 1 19 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.583 -2.538 18792 14962 1 19 . 1 1 97 97 ASP H H 97 8.644 8.644 7.751 0.893 18792 14963 1 19 . 1 1 98 98 GLY N N 98 108.551 108.551 107.253 1.298 18792 14964 1 19 . 1 1 98 98 GLY C C 98 172.690 172.690 171.838 0.852 18792 14965 1 19 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.354 -2.104 18792 14966 1 19 . 1 1 98 98 GLY H H 98 7.463 7.463 7.766 -0.303 18792 14967 1 19 . 1 1 99 99 VAL N N 99 120.630 120.630 122.646 -2.016 18792 14968 1 19 . 1 1 99 99 VAL C C 99 174.503 174.503 175.109 -0.606 18792 14969 1 19 . 1 1 99 99 VAL CA C 99 62.318 62.318 60.197 2.121 18792 14970 1 19 . 1 1 99 99 VAL CB C 99 30.763 30.763 34.129 -3.366 18792 14971 1 19 . 1 1 99 99 VAL H H 99 8.184 8.184 7.608 0.576 18792 14972 1 19 . 1 1 100 100 ASN N N 100 115.485 115.485 124.423 -8.938 18792 14973 1 19 . 1 1 100 100 ASN C C 100 175.239 175.239 175.962 -0.723 18792 14974 1 19 . 1 1 100 100 ASN CA C 100 51.361 51.361 56.473 -5.112 18792 14975 1 19 . 1 1 100 100 ASN CB C 100 38.920 38.920 37.381 1.539 18792 14976 1 19 . 1 1 100 100 ASN H H 100 6.241 6.241 8.811 -2.570 18792 14977 1 19 . 1 1 101 101 TRP N N 101 118.266 118.266 120.635 -2.369 18792 14978 1 19 . 1 1 101 101 TRP C C 101 178.301 178.301 175.891 2.410 18792 14979 1 19 . 1 1 101 101 TRP CA C 101 60.539 60.539 57.290 3.249 18792 14980 1 19 . 1 1 101 101 TRP CB C 101 29.830 29.830 29.172 0.658 18792 14981 1 19 . 1 1 101 101 TRP H H 101 8.409 8.409 7.602 0.807 18792 14982 1 19 . 1 1 102 102 GLY N N 102 106.147 106.147 107.015 -0.868 18792 14983 1 19 . 1 1 102 102 GLY C C 102 177.640 177.640 175.913 1.727 18792 14984 1 19 . 1 1 102 102 GLY CA C 102 46.914 46.914 45.328 1.586 18792 14985 1 19 . 1 1 102 102 GLY H H 102 8.504 8.504 7.300 1.204 18792 14986 1 19 . 1 1 103 103 ARG N N 103 121.347 121.347 121.504 -0.157 18792 14987 1 19 . 1 1 103 103 ARG C C 103 177.738 177.738 178.223 -0.485 18792 14988 1 19 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.581 -0.639 18792 14989 1 19 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.206 0.013 18792 14990 1 19 . 1 1 103 103 ARG H H 103 8.099 8.099 8.050 0.049 18792 14991 1 19 . 1 1 104 104 ILE N N 104 120.930 120.930 120.113 0.817 18792 14992 1 19 . 1 1 104 104 ILE C C 104 178.197 178.197 177.691 0.506 18792 14993 1 19 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.433 2.102 18792 14994 1 19 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.858 -1.813 18792 14995 1 19 . 1 1 104 104 ILE H H 104 7.690 7.690 8.013 -0.323 18792 14996 1 19 . 1 1 105 105 VAL N N 105 120.938 120.938 119.759 1.179 18792 14997 1 19 . 1 1 105 105 VAL C C 105 177.854 177.854 177.627 0.227 18792 14998 1 19 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.374 1.084 18792 14999 1 19 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.392 -0.018 18792 15000 1 19 . 1 1 105 105 VAL H H 105 8.245 8.245 7.435 0.810 18792 15001 1 19 . 1 1 106 106 ALA N N 106 121.165 121.165 122.371 -1.206 18792 15002 1 19 . 1 1 106 106 ALA C C 106 178.284 178.284 179.685 -1.401 18792 15003 1 19 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.177 0.421 18792 15004 1 19 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.268 -0.753 18792 15005 1 19 . 1 1 106 106 ALA H H 106 7.529 7.529 7.579 -0.050 18792 15006 1 19 . 1 1 107 107 PHE N N 107 119.242 119.242 119.306 -0.064 18792 15007 1 19 . 1 1 107 107 PHE C C 107 176.390 176.390 177.492 -1.102 18792 15008 1 19 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.884 -0.711 18792 15009 1 19 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.501 -1.414 18792 15010 1 19 . 1 1 107 107 PHE H H 107 7.974 7.974 7.707 0.267 18792 15011 1 19 . 1 1 108 108 PHE N N 108 120.009 120.009 117.792 2.217 18792 15012 1 19 . 1 1 108 108 PHE C C 108 177.640 177.640 177.312 0.328 18792 15013 1 19 . 1 1 108 108 PHE CA C 108 62.424 62.424 60.700 1.724 18792 15014 1 19 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.500 -3.154 18792 15015 1 19 . 1 1 108 108 PHE H H 108 7.946 7.946 8.258 -0.312 18792 15016 1 19 . 1 1 109 109 SER N N 109 114.631 114.631 115.630 -0.999 18792 15017 1 19 . 1 1 109 109 SER C C 109 177.770 177.770 176.849 0.921 18792 15018 1 19 . 1 1 109 109 SER CA C 109 63.349 63.349 61.550 1.799 18792 15019 1 19 . 1 1 109 109 SER H H 109 8.424 8.424 7.822 0.602 18792 15020 1 19 . 1 1 110 110 PHE N N 110 124.230 124.230 124.019 0.211 18792 15021 1 19 . 1 1 110 110 PHE C C 110 176.708 176.708 177.278 -0.570 18792 15022 1 19 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.578 0.036 18792 15023 1 19 . 1 1 110 110 PHE CB C 110 37.444 37.444 39.056 -1.613 18792 15024 1 19 . 1 1 110 110 PHE H H 110 9.052 9.052 8.606 0.446 18792 15025 1 19 . 1 1 111 111 GLY N N 111 105.893 105.893 106.032 -0.139 18792 15026 1 19 . 1 1 111 111 GLY C C 111 176.795 176.795 175.967 0.828 18792 15027 1 19 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.353 1.022 18792 15028 1 19 . 1 1 111 111 GLY H H 111 7.926 7.926 8.508 -0.582 18792 15029 1 19 . 1 1 112 112 GLY N N 112 107.410 107.410 109.568 -2.158 18792 15030 1 19 . 1 1 112 112 GLY C C 112 174.650 174.650 175.440 -0.790 18792 15031 1 19 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.436 0.869 18792 15032 1 19 . 1 1 112 112 GLY H H 112 8.799 8.799 7.958 0.841 18792 15033 1 19 . 1 1 113 113 ALA N N 113 124.313 124.313 125.000 -0.687 18792 15034 1 19 . 1 1 113 113 ALA C C 113 181.300 181.300 179.236 2.064 18792 15035 1 19 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.757 -0.230 18792 15036 1 19 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.326 -0.843 18792 15037 1 19 . 1 1 113 113 ALA H H 113 8.212 8.212 7.726 0.486 18792 15038 1 19 . 1 1 114 114 LEU N N 114 118.878 118.878 118.861 0.017 18792 15039 1 19 . 1 1 114 114 LEU C C 114 180.286 180.286 178.438 1.848 18792 15040 1 19 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.831 -0.849 18792 15041 1 19 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.543 -0.526 18792 15042 1 19 . 1 1 114 114 LEU H H 114 8.161 8.161 7.904 0.257 18792 15043 1 19 . 1 1 115 115 CYS N N 115 119.002 119.002 117.914 1.088 18792 15044 1 19 . 1 1 115 115 CYS C C 115 176.087 176.087 177.008 -0.921 18792 15045 1 19 . 1 1 115 115 CYS CA C 115 63.944 63.944 61.843 2.101 18792 15046 1 19 . 1 1 115 115 CYS CB C 115 25.635 25.635 26.932 -1.297 18792 15047 1 19 . 1 1 115 115 CYS H H 115 8.070 8.070 7.931 0.139 18792 15048 1 19 . 1 1 116 116 VAL N N 116 118.737 118.737 120.922 -2.185 18792 15049 1 19 . 1 1 116 116 VAL C C 116 177.494 177.494 178.181 -0.687 18792 15050 1 19 . 1 1 116 116 VAL CA C 116 66.762 66.762 67.010 -0.248 18792 15051 1 19 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.265 -0.502 18792 15052 1 19 . 1 1 116 116 VAL H H 116 7.995 7.995 7.830 0.165 18792 15053 1 19 . 1 1 117 117 GLU N N 117 118.886 118.886 119.699 -0.813 18792 15054 1 19 . 1 1 117 117 GLU C C 117 178.424 178.424 178.939 -0.515 18792 15055 1 19 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.708 -0.948 18792 15056 1 19 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.537 -1.483 18792 15057 1 19 . 1 1 117 117 GLU H H 117 8.059 8.059 7.901 0.158 18792 15058 1 19 . 1 1 118 118 SER N N 118 113.417 113.417 115.159 -1.742 18792 15059 1 19 . 1 1 118 118 SER C C 118 175.607 175.607 176.574 -0.967 18792 15060 1 19 . 1 1 118 118 SER CA C 118 62.638 62.638 61.482 1.156 18792 15061 1 19 . 1 1 118 118 SER CB C 118 61.061 61.061 63.357 -2.296 18792 15062 1 19 . 1 1 118 118 SER H H 118 7.626 7.626 7.752 -0.126 18792 15063 1 19 . 1 1 119 119 VAL N N 119 120.612 120.612 121.211 -0.599 18792 15064 1 19 . 1 1 119 119 VAL C C 119 179.713 179.713 177.703 2.010 18792 15065 1 19 . 1 1 119 119 VAL CA C 119 66.225 66.225 64.665 1.560 18792 15066 1 19 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.660 -1.581 18792 15067 1 19 . 1 1 119 119 VAL H H 119 7.297 7.297 8.179 -0.882 18792 15068 1 19 . 1 1 120 120 ASP N N 120 122.546 122.546 121.606 0.940 18792 15069 1 19 . 1 1 120 120 ASP C C 120 178.057 178.057 177.606 0.451 18792 15070 1 19 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.838 0.151 18792 15071 1 19 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.881 -0.958 18792 15072 1 19 . 1 1 120 120 ASP H H 120 8.264 8.264 8.293 -0.029 18792 15073 1 19 . 1 1 121 121 LYS N N 121 115.636 115.636 117.577 -1.941 18792 15074 1 19 . 1 1 121 121 LYS C C 121 175.159 175.159 176.380 -1.221 18792 15075 1 19 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.499 -1.239 18792 15076 1 19 . 1 1 121 121 LYS CB C 121 30.775 30.775 33.251 -2.476 18792 15077 1 19 . 1 1 121 121 LYS H H 121 7.558 7.558 7.506 0.052 18792 15078 1 19 . 1 1 122 122 GLU N N 122 113.915 113.915 116.820 -2.905 18792 15079 1 19 . 1 1 122 122 GLU C C 122 176.109 176.109 175.855 0.254 18792 15080 1 19 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.905 -0.598 18792 15081 1 19 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.698 -3.366 18792 15082 1 19 . 1 1 122 122 GLU H H 122 7.826 7.826 8.064 -0.238 18792 15083 1 19 . 1 1 124 124 GLN N N 124 119.233 119.233 119.392 -0.159 18792 15084 1 19 . 1 1 124 124 GLN C C 124 177.640 177.640 177.077 0.563 18792 15085 1 19 . 1 1 124 124 GLN CA C 124 59.472 59.472 56.595 2.877 18792 15086 1 19 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.976 -2.486 18792 15087 1 19 . 1 1 124 124 GLN H H 124 8.626 8.626 8.207 0.419 18792 15088 1 19 . 1 1 125 125 VAL N N 125 117.011 117.011 114.437 2.574 18792 15089 1 19 . 1 1 125 125 VAL C C 125 175.826 175.826 175.397 0.429 18792 15090 1 19 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.391 -0.254 18792 15091 1 19 . 1 1 125 125 VAL CB C 125 30.297 30.297 30.991 -0.694 18792 15092 1 19 . 1 1 125 125 VAL H H 125 7.870 7.870 8.445 -0.575 18792 15093 1 19 . 1 1 126 126 LEU N N 126 117.058 117.058 115.044 2.014 18792 15094 1 19 . 1 1 126 126 LEU C C 126 178.096 178.096 178.080 0.016 18792 15095 1 19 . 1 1 126 126 LEU CA C 126 55.085 55.085 56.818 -1.733 18792 15096 1 19 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.653 -2.380 18792 15097 1 19 . 1 1 126 126 LEU H H 126 7.747 7.747 7.880 -0.133 18792 15098 1 19 . 1 1 127 127 VAL N N 127 119.457 119.457 120.579 -1.122 18792 15099 1 19 . 1 1 127 127 VAL C C 127 177.150 177.150 178.250 -1.100 18792 15100 1 19 . 1 1 127 127 VAL CA C 127 67.156 67.156 65.672 1.484 18792 15101 1 19 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.874 -1.121 18792 15102 1 19 . 1 1 127 127 VAL H H 127 7.306 7.306 8.245 -0.939 18792 15103 1 19 . 1 1 128 128 SER N N 128 110.647 110.647 113.966 -3.319 18792 15104 1 19 . 1 1 128 128 SER C C 128 177.222 177.222 176.354 0.868 18792 15105 1 19 . 1 1 128 128 SER CA C 128 60.752 60.752 61.194 -0.443 18792 15106 1 19 . 1 1 128 128 SER CB C 128 61.605 61.605 62.885 -1.280 18792 15107 1 19 . 1 1 128 128 SER H H 128 8.237 8.237 8.420 -0.183 18792 15108 1 19 . 1 1 129 129 ARG N N 129 123.100 123.100 123.080 0.020 18792 15109 1 19 . 1 1 129 129 ARG C C 129 175.802 175.802 178.618 -2.816 18792 15110 1 19 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.286 -1.060 18792 15111 1 19 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.357 -2.158 18792 15112 1 19 . 1 1 129 129 ARG H H 129 6.564 6.564 7.742 -1.178 18792 15113 1 19 . 1 1 130 130 ILE N N 130 118.182 118.182 117.356 0.826 18792 15114 1 19 . 1 1 130 130 ILE C C 130 178.156 178.156 177.761 0.395 18792 15115 1 19 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.323 -0.977 18792 15116 1 19 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.514 -0.832 18792 15117 1 19 . 1 1 130 130 ILE H H 130 7.955 7.955 8.559 -0.604 18792 15118 1 19 . 1 1 131 131 ALA N N 131 119.029 119.029 122.335 -3.306 18792 15119 1 19 . 1 1 131 131 ALA C C 131 179.593 179.593 179.087 0.506 18792 15120 1 19 . 1 1 131 131 ALA CA C 131 54.598 54.598 54.950 -0.352 18792 15121 1 19 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.160 -0.772 18792 15122 1 19 . 1 1 131 131 ALA H H 131 7.582 7.582 8.096 -0.514 18792 15123 1 19 . 1 1 132 132 ALA N N 132 120.336 120.336 122.055 -1.719 18792 15124 1 19 . 1 1 132 132 ALA C C 132 181.095 181.095 179.297 1.798 18792 15125 1 19 . 1 1 132 132 ALA CA C 132 54.598 54.598 55.008 -0.410 18792 15126 1 19 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.646 -1.945 18792 15127 1 19 . 1 1 132 132 ALA H H 132 7.224 7.224 7.772 -0.548 18792 15128 1 19 . 1 1 133 133 TRP N N 133 121.194 121.194 119.986 1.208 18792 15129 1 19 . 1 1 133 133 TRP C C 133 179.698 179.698 178.440 1.258 18792 15130 1 19 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.399 -3.097 18792 15131 1 19 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.856 -2.201 18792 15132 1 19 . 1 1 133 133 TRP H H 133 8.925 8.925 8.740 0.185 18792 15133 1 19 . 1 1 134 134 MET N N 134 116.987 116.987 117.539 -0.552 18792 15134 1 19 . 1 1 134 134 MET C C 134 178.277 178.277 178.381 -0.104 18792 15135 1 19 . 1 1 134 134 MET CA C 134 59.578 59.578 59.426 0.152 18792 15136 1 19 . 1 1 134 134 MET CB C 134 33.559 33.559 32.566 0.993 18792 15137 1 19 . 1 1 134 134 MET H H 134 8.863 8.863 8.375 0.488 18792 15138 1 19 . 1 1 135 135 ALA N N 135 120.523 120.523 121.243 -0.720 18792 15139 1 19 . 1 1 135 135 ALA C C 135 179.298 179.298 179.232 0.066 18792 15140 1 19 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.124 0.309 18792 15141 1 19 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.279 -1.642 18792 15142 1 19 . 1 1 135 135 ALA H H 135 8.152 8.152 8.136 0.016 18792 15143 1 19 . 1 1 136 136 THR N N 136 116.715 116.715 117.834 -1.119 18792 15144 1 19 . 1 1 136 136 THR C C 136 175.106 175.106 176.182 -1.076 18792 15145 1 19 . 1 1 136 136 THR CA C 136 66.729 66.729 66.781 -0.052 18792 15146 1 19 . 1 1 136 136 THR CB C 136 68.441 68.441 69.007 -0.566 18792 15147 1 19 . 1 1 136 136 THR H H 136 8.532 8.532 8.212 0.320 18792 15148 1 19 . 1 1 137 137 TYR N N 137 123.204 123.204 122.303 0.901 18792 15149 1 19 . 1 1 137 137 TYR C C 137 179.592 179.592 176.886 2.706 18792 15150 1 19 . 1 1 137 137 TYR CA C 137 63.065 63.065 59.986 3.079 18792 15151 1 19 . 1 1 137 137 TYR CB C 137 37.988 37.988 37.658 0.330 18792 15152 1 19 . 1 1 137 137 TYR H H 137 8.809 8.809 7.877 0.932 18792 15153 1 19 . 1 1 138 138 LEU N N 138 119.247 119.247 120.176 -0.929 18792 15154 1 19 . 1 1 138 138 LEU C C 138 178.385 178.385 177.913 0.472 18792 15155 1 19 . 1 1 138 138 LEU CA C 138 58.938 58.938 57.784 1.154 18792 15156 1 19 . 1 1 138 138 LEU CB C 138 41.708 41.708 41.873 -0.165 18792 15157 1 19 . 1 1 138 138 LEU H H 138 8.742 8.742 7.656 1.086 18792 15158 1 19 . 1 1 139 139 ASN N N 139 117.122 117.122 116.093 1.029 18792 15159 1 19 . 1 1 139 139 ASN C C 139 176.417 176.417 177.148 -0.731 18792 15160 1 19 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.387 1.061 18792 15161 1 19 . 1 1 139 139 ASN CB C 139 38.652 38.652 37.836 0.816 18792 15162 1 19 . 1 1 139 139 ASN H H 139 8.307 8.307 7.872 0.435 18792 15163 1 19 . 1 1 140 140 ASP N N 140 115.394 115.394 120.266 -4.872 18792 15164 1 19 . 1 1 140 140 ASP C C 140 177.919 177.919 176.969 0.950 18792 15165 1 19 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.945 -0.992 18792 15166 1 19 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.827 -1.441 18792 15167 1 19 . 1 1 140 140 ASP H H 140 8.439 8.439 8.190 0.249 18792 15168 1 19 . 1 1 141 141 HIS N N 141 111.695 111.695 113.296 -1.601 18792 15169 1 19 . 1 1 141 141 HIS C C 141 175.949 175.949 175.587 0.362 18792 15170 1 19 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.159 -0.102 18792 15171 1 19 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.236 -2.328 18792 15172 1 19 . 1 1 141 141 HIS H H 141 8.043 8.043 7.222 0.821 18792 15173 1 19 . 1 1 142 142 LEU N N 142 117.054 117.054 121.820 -4.766 18792 15174 1 19 . 1 1 142 142 LEU C C 142 176.530 176.530 177.381 -0.851 18792 15175 1 19 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.147 -1.837 18792 15176 1 19 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.554 0.784 18792 15177 1 19 . 1 1 142 142 LEU H H 142 7.198 7.198 7.883 -0.685 18792 15178 1 19 . 1 1 143 143 GLU N N 143 121.335 121.335 119.607 1.728 18792 15179 1 19 . 1 1 143 143 GLU C C 143 173.964 173.964 175.519 -1.555 18792 15180 1 19 . 1 1 143 143 GLU CA C 143 60.254 60.254 61.011 -0.757 18792 15181 1 19 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.210 -1.953 18792 15182 1 19 . 1 1 143 143 GLU H H 143 8.565 8.565 7.592 0.973 18792 15183 1 19 . 1 1 145 145 TRP N N 145 117.973 117.973 119.809 -1.836 18792 15184 1 19 . 1 1 145 145 TRP C C 145 179.526 179.526 177.762 1.764 18792 15185 1 19 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.390 1.216 18792 15186 1 19 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.278 -1.390 18792 15187 1 19 . 1 1 145 145 TRP H H 145 7.078 7.078 8.382 -1.304 18792 15188 1 19 . 1 1 146 146 ILE N N 146 122.101 122.101 111.714 10.387 18792 15189 1 19 . 1 1 146 146 ILE C C 146 179.110 179.110 176.973 2.137 18792 15190 1 19 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.679 3.655 18792 15191 1 19 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.110 -1.288 18792 15192 1 19 . 1 1 146 146 ILE H H 146 8.389 8.389 7.534 0.855 18792 15193 1 19 . 1 1 147 147 GLN N N 147 116.344 116.344 121.372 -5.028 18792 15194 1 19 . 1 1 147 147 GLN C C 147 179.526 179.526 177.592 1.934 18792 15195 1 19 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.904 -0.891 18792 15196 1 19 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.315 -1.592 18792 15197 1 19 . 1 1 147 147 GLN H H 147 8.376 8.376 8.077 0.299 18792 15198 1 19 . 1 1 148 148 GLU N N 148 118.913 118.913 119.878 -0.965 18792 15199 1 19 . 1 1 148 148 GLU C C 148 176.880 176.880 177.390 -0.510 18792 15200 1 19 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.139 -2.765 18792 15201 1 19 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.373 -0.941 18792 15202 1 19 . 1 1 148 148 GLU H H 148 7.504 7.504 8.010 -0.506 18792 15203 1 19 . 1 1 149 149 ASN N N 149 116.616 116.616 113.433 3.183 18792 15204 1 19 . 1 1 149 149 ASN C C 149 173.964 173.964 176.708 -2.744 18792 15205 1 19 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.748 -0.502 18792 15206 1 19 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.334 -2.201 18792 15207 1 19 . 1 1 149 149 ASN H H 149 7.070 7.070 8.067 -0.997 18792 15208 1 19 . 1 1 150 150 GLY N N 150 104.750 104.750 107.503 -2.753 18792 15209 1 19 . 1 1 150 150 GLY C C 150 176.022 176.022 174.791 1.231 18792 15210 1 19 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.341 -0.099 18792 15211 1 19 . 1 1 150 150 GLY H H 150 7.313 7.313 8.139 -0.826 18792 15212 1 19 . 1 1 151 151 GLY N N 151 108.385 108.385 109.693 -1.308 18792 15213 1 19 . 1 1 151 151 GLY C C 151 173.449 173.449 175.203 -1.754 18792 15214 1 19 . 1 1 151 151 GLY CA C 151 44.032 44.032 45.387 -1.355 18792 15215 1 19 . 1 1 151 151 GLY H H 151 8.452 8.452 7.500 0.952 18792 15216 1 19 . 1 1 152 152 TRP N N 152 118.092 118.092 121.969 -3.877 18792 15217 1 19 . 1 1 152 152 TRP C C 152 178.571 178.571 178.029 0.542 18792 15218 1 19 . 1 1 152 152 TRP CA C 152 60.077 60.077 60.245 -0.168 18792 15219 1 19 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.178 -0.590 18792 15220 1 19 . 1 1 152 152 TRP H H 152 8.644 8.644 8.940 -0.296 18792 15221 1 19 . 1 1 153 153 ASP N N 153 117.758 117.758 118.650 -0.892 18792 15222 1 19 . 1 1 153 153 ASP C C 153 179.796 179.796 178.621 1.175 18792 15223 1 19 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.872 -0.570 18792 15224 1 19 . 1 1 153 153 ASP CB C 153 39.231 39.231 41.177 -1.946 18792 15225 1 19 . 1 1 153 153 ASP H H 153 8.827 8.827 8.084 0.743 18792 15226 1 19 . 1 1 154 154 THR N N 154 116.817 116.817 117.034 -0.217 18792 15227 1 19 . 1 1 154 154 THR C C 154 175.352 175.352 176.450 -1.098 18792 15228 1 19 . 1 1 154 154 THR CA C 154 65.910 65.910 66.512 -0.602 18792 15229 1 19 . 1 1 154 154 THR CB C 154 67.712 67.712 69.236 -1.524 18792 15230 1 19 . 1 1 154 154 THR H H 154 7.494 7.494 7.738 -0.244 18792 15231 1 19 . 1 1 155 155 PHE N N 155 122.196 122.196 121.940 0.256 18792 15232 1 19 . 1 1 155 155 PHE C C 155 176.831 176.831 177.516 -0.685 18792 15233 1 19 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.808 0.478 18792 15234 1 19 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.317 -1.650 18792 15235 1 19 . 1 1 155 155 PHE H H 155 6.477 6.477 8.791 -2.314 18792 15236 1 19 . 1 1 156 156 VAL N N 156 117.387 117.387 119.328 -1.941 18792 15237 1 19 . 1 1 156 156 VAL C C 156 178.497 178.497 178.218 0.279 18792 15238 1 19 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.862 -0.631 18792 15239 1 19 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.231 -0.546 18792 15240 1 19 . 1 1 156 156 VAL H H 156 7.788 7.788 8.356 -0.568 18792 15241 1 19 . 1 1 157 157 GLU N N 157 119.876 119.876 120.253 -0.377 18792 15242 1 19 . 1 1 157 157 GLU C C 157 178.399 178.399 179.170 -0.771 18792 15243 1 19 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.506 -0.746 18792 15244 1 19 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.812 -1.535 18792 15245 1 19 . 1 1 157 157 GLU H H 157 7.409 7.409 8.199 -0.790 18792 15246 1 19 . 1 1 158 158 LEU N N 158 117.194 117.194 120.432 -3.238 18792 15247 1 19 . 1 1 158 158 LEU C C 158 178.595 178.595 179.089 -0.494 18792 15248 1 19 . 1 1 158 158 LEU CA C 158 56.377 56.377 57.702 -1.325 18792 15249 1 19 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.031 0.540 18792 15250 1 19 . 1 1 158 158 LEU H H 158 7.584 7.584 7.936 -0.352 18792 15251 1 19 . 1 1 159 159 TYR N N 159 115.549 115.549 120.561 -5.012 18792 15252 1 19 . 1 1 159 159 TYR C C 159 177.032 177.032 177.412 -0.380 18792 15253 1 19 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.405 -0.289 18792 15254 1 19 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.388 -0.789 18792 15255 1 19 . 1 1 159 159 TYR H H 159 8.099 8.099 8.383 -0.284 18792 15256 1 19 . 1 1 160 160 GLY N N 160 108.334 108.334 105.756 2.578 18792 15257 1 19 . 1 1 160 160 GLY C C 160 173.973 173.973 174.022 -0.049 18792 15258 1 19 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.957 0.107 18792 15259 1 19 . 1 1 160 160 GLY H H 160 8.020 8.020 8.041 -0.021 18792 15260 1 19 . 1 1 161 161 ASN N N 161 118.189 118.189 118.192 -0.003 18792 15261 1 19 . 1 1 161 161 ASN C C 161 175.513 175.513 174.490 1.023 18792 15262 1 19 . 1 1 161 161 ASN CA C 161 53.104 53.104 53.553 -0.449 18792 15263 1 19 . 1 1 161 161 ASN CB C 161 38.203 38.203 37.714 0.489 18792 15264 1 19 . 1 1 161 161 ASN H H 161 8.327 8.327 7.582 0.745 18792 15265 1 19 . 1 1 162 162 ASN N N 162 119.022 119.022 119.851 -0.829 18792 15266 1 19 . 1 1 162 162 ASN C C 162 175.690 175.690 174.255 1.435 18792 15267 1 19 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.112 0.312 18792 15268 1 19 . 1 1 162 162 ASN CB C 162 38.203 38.203 38.759 -0.556 18792 15269 1 19 . 1 1 162 162 ASN H H 162 8.363 8.363 8.798 -0.435 18792 15270 1 19 . 1 1 163 163 ALA N N 163 123.275 123.275 122.540 0.735 18792 15271 1 19 . 1 1 163 163 ALA C C 163 178.598 178.598 178.043 0.555 18792 15272 1 19 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.160 0.078 18792 15273 1 19 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.321 -1.710 18792 15274 1 19 . 1 1 163 163 ALA H H 163 8.103 8.103 8.097 0.006 18792 15275 1 19 . 1 1 164 164 ALA N N 164 121.521 121.521 121.292 0.229 18792 15276 1 19 . 1 1 164 164 ALA C C 164 178.642 178.642 178.579 0.063 18792 15277 1 19 . 1 1 164 164 ALA CA C 164 52.584 52.584 54.294 -1.710 18792 15278 1 19 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.415 -0.596 18792 15279 1 19 . 1 1 164 164 ALA H H 164 8.053 8.053 8.466 -0.413 18792 15280 1 19 . 1 1 165 165 ALA N N 165 122.101 122.101 118.272 3.829 18792 15281 1 19 . 1 1 165 165 ALA C C 165 179.124 179.124 177.983 1.141 18792 15282 1 19 . 1 1 165 165 ALA CA C 165 53.139 53.139 53.463 -0.324 18792 15283 1 19 . 1 1 165 165 ALA CB C 165 17.978 17.978 19.052 -1.074 18792 15284 1 19 . 1 1 165 165 ALA H H 165 7.949 7.949 7.861 0.088 18792 15285 1 19 . 1 1 166 166 GLU N N 166 118.381 118.381 118.154 0.227 18792 15286 1 19 . 1 1 166 166 GLU C C 166 177.664 177.664 177.628 0.036 18792 15287 1 19 . 1 1 166 166 GLU CA C 166 57.088 57.088 57.174 -0.086 18792 15288 1 19 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.851 -1.496 18792 15289 1 19 . 1 1 166 166 GLU H H 166 8.202 8.202 7.887 0.315 18792 15290 1 19 . 1 1 167 167 SER N N 167 115.193 115.193 115.183 0.010 18792 15291 1 19 . 1 1 167 167 SER C C 167 175.312 175.312 175.906 -0.594 18792 15292 1 19 . 1 1 167 167 SER CA C 167 58.831 58.831 59.590 -0.759 18792 15293 1 19 . 1 1 167 167 SER CB C 167 62.537 62.537 64.316 -1.779 18792 15294 1 19 . 1 1 167 167 SER H H 167 8.029 8.029 8.029 0.000 18792 15295 1 19 . 1 1 168 168 ARG N N 168 121.696 121.696 120.712 0.984 18792 15296 1 19 . 1 1 168 168 ARG C C 168 176.880 176.880 175.553 1.327 18792 15297 1 19 . 1 1 168 168 ARG CA C 168 56.163 56.163 57.965 -1.802 18792 15298 1 19 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.116 0.093 18792 15299 1 19 . 1 1 168 168 ARG H H 168 7.967 7.967 8.441 -0.474 18792 15300 1 19 . 1 1 169 169 LYS N N 169 120.917 120.917 118.025 2.892 18792 15301 1 19 . 1 1 169 169 LYS C C 169 177.640 177.640 175.744 1.896 18792 15302 1 19 . 1 1 169 169 LYS CA C 169 56.697 56.697 57.641 -0.944 18792 15303 1 19 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.376 -0.914 18792 15304 1 19 . 1 1 169 169 LYS H H 169 8.011 8.011 8.208 -0.197 18792 15305 1 19 . 1 1 170 170 GLY N N 170 109.155 109.155 108.820 0.335 18792 15306 1 19 . 1 1 170 170 GLY C C 170 174.479 174.479 173.568 0.911 18792 15307 1 19 . 1 1 170 170 GLY CA C 170 45.064 45.064 44.876 0.188 18792 15308 1 19 . 1 1 170 170 GLY H H 170 8.329 8.329 8.453 -0.124 18792 15309 1 19 . 1 1 171 171 GLN N N 171 119.292 119.292 119.215 0.077 18792 15310 1 19 . 1 1 171 171 GLN C C 171 176.463 176.463 176.079 0.384 18792 15311 1 19 . 1 1 171 171 GLN CA C 171 55.666 55.666 56.296 -0.630 18792 15312 1 19 . 1 1 171 171 GLN CB C 171 28.199 28.199 29.626 -1.427 18792 15313 1 19 . 1 1 171 171 GLN H H 171 8.035 8.035 8.606 -0.571 18792 15314 1 19 . 1 1 172 172 GLU N N 172 121.703 121.703 119.605 2.098 18792 15315 1 19 . 1 1 172 172 GLU C C 172 176.414 176.414 174.814 1.600 18792 15316 1 19 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.486 0.855 18792 15317 1 19 . 1 1 172 172 GLU CB C 172 28.821 28.821 32.222 -3.401 18792 15318 1 19 . 1 1 172 172 GLU H H 172 8.405 8.405 8.695 -0.290 18792 15319 1 19 . 1 1 173 173 ARG N N 173 121.852 121.852 120.379 1.473 18792 15320 1 19 . 1 1 173 173 ARG C C 173 176.365 176.365 173.914 2.451 18792 15321 1 19 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.697 0.502 18792 15322 1 19 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.844 -2.713 18792 15323 1 19 . 1 1 173 173 ARG H H 173 8.335 8.335 8.746 -0.411 18792 15324 1 19 . 1 1 174 174 LEU N N 174 122.640 122.640 123.060 -0.420 18792 15325 1 19 . 1 1 174 174 LEU C C 174 176.523 176.523 174.719 1.804 18792 15326 1 19 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.605 0.163 18792 15327 1 19 . 1 1 174 174 LEU CB C 174 40.784 40.784 44.709 -3.925 18792 15328 1 19 . 1 1 174 174 LEU H H 174 8.082 8.082 8.846 -0.764 18792 15329 1 19 . 1 1 175 175 GLU N N 175 125.909 125.909 120.783 5.126 18792 15330 1 19 . 1 1 175 175 GLU C C 175 181.029 181.029 174.577 6.452 18792 15331 1 19 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.990 1.408 18792 15332 1 19 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.168 -1.118 18792 15333 1 19 . 1 1 175 175 GLU H H 175 7.785 7.785 8.905 -1.120 18792 15334 1 20 . 1 1 4 4 ALA N N 4 124.786 124.786 122.485 2.301 18792 15335 1 20 . 1 1 4 4 ALA C C 4 178.272 178.272 179.614 -1.342 18792 15336 1 20 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.425 -1.859 18792 15337 1 20 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.998 -0.764 18792 15338 1 20 . 1 1 4 4 ALA H H 4 8.414 8.414 8.551 -0.137 18792 15339 1 20 . 1 1 5 5 MET N N 5 119.681 119.681 118.203 1.478 18792 15340 1 20 . 1 1 5 5 MET C C 5 176.929 176.929 178.057 -1.128 18792 15341 1 20 . 1 1 5 5 MET CA C 5 55.594 55.594 58.057 -2.463 18792 15342 1 20 . 1 1 5 5 MET CB C 5 31.540 31.540 32.115 -0.575 18792 15343 1 20 . 1 1 5 5 MET H H 5 8.336 8.336 8.476 -0.140 18792 15344 1 20 . 1 1 6 6 SER N N 6 116.162 116.162 116.097 0.065 18792 15345 1 20 . 1 1 6 6 SER C C 6 175.924 175.924 176.595 -0.671 18792 15346 1 20 . 1 1 6 6 SER CA C 6 59.009 59.009 61.251 -2.242 18792 15347 1 20 . 1 1 6 6 SER CB C 6 62.537 62.537 62.836 -0.299 18792 15348 1 20 . 1 1 6 6 SER H H 6 8.272 8.272 7.864 0.408 18792 15349 1 20 . 1 1 7 7 GLN N N 7 122.263 122.263 121.583 0.680 18792 15350 1 20 . 1 1 7 7 GLN C C 7 177.027 177.027 178.229 -1.202 18792 15351 1 20 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.894 -2.624 18792 15352 1 20 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.598 -0.859 18792 15353 1 20 . 1 1 7 7 GLN H H 7 8.314 8.314 7.955 0.359 18792 15354 1 20 . 1 1 8 8 SER N N 8 116.625 116.625 114.918 1.707 18792 15355 1 20 . 1 1 8 8 SER C C 8 176.457 176.457 176.433 0.024 18792 15356 1 20 . 1 1 8 8 SER CA C 8 59.650 59.650 61.713 -2.063 18792 15357 1 20 . 1 1 8 8 SER CB C 8 62.226 62.226 62.956 -0.730 18792 15358 1 20 . 1 1 8 8 SER H H 8 8.333 8.333 8.356 -0.023 18792 15359 1 20 . 1 1 9 9 ASN N N 9 121.307 121.307 119.836 1.471 18792 15360 1 20 . 1 1 9 9 ASN C C 9 177.419 177.419 177.208 0.211 18792 15361 1 20 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.291 -0.804 18792 15362 1 20 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.315 -1.182 18792 15363 1 20 . 1 1 9 9 ASN H H 9 8.611 8.611 7.745 0.866 18792 15364 1 20 . 1 1 10 10 ARG N N 10 119.830 119.830 121.294 -1.464 18792 15365 1 20 . 1 1 10 10 ARG C C 10 177.615 177.615 178.216 -0.601 18792 15366 1 20 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.615 -0.357 18792 15367 1 20 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.391 -2.192 18792 15368 1 20 . 1 1 10 10 ARG H H 10 7.996 7.996 8.416 -0.420 18792 15369 1 20 . 1 1 11 11 GLU N N 11 117.270 117.270 119.381 -2.111 18792 15370 1 20 . 1 1 11 11 GLU C C 11 179.649 179.649 178.469 1.180 18792 15371 1 20 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.128 -0.119 18792 15372 1 20 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.267 -1.146 18792 15373 1 20 . 1 1 11 11 GLU H H 11 7.885 7.885 8.256 -0.371 18792 15374 1 20 . 1 1 12 12 LEU N N 12 119.900 119.900 120.991 -1.091 18792 15375 1 20 . 1 1 12 12 LEU C C 12 178.473 178.473 178.316 0.157 18792 15376 1 20 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.253 -0.560 18792 15377 1 20 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.655 -1.026 18792 15378 1 20 . 1 1 12 12 LEU H H 12 7.691 7.691 7.754 -0.063 18792 15379 1 20 . 1 1 13 13 VAL N N 13 117.320 117.320 118.838 -1.518 18792 15380 1 20 . 1 1 13 13 VAL C C 13 177.272 177.272 178.480 -1.208 18792 15381 1 20 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.899 0.257 18792 15382 1 20 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.294 -0.065 18792 15383 1 20 . 1 1 13 13 VAL H H 13 7.629 7.629 7.695 -0.066 18792 15384 1 20 . 1 1 14 14 VAL N N 14 116.659 116.659 121.043 -4.384 18792 15385 1 20 . 1 1 14 14 VAL C C 14 178.718 178.718 176.995 1.723 18792 15386 1 20 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.388 0.128 18792 15387 1 20 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.693 -1.319 18792 15388 1 20 . 1 1 14 14 VAL H H 14 8.210 8.210 8.156 0.054 18792 15389 1 20 . 1 1 15 15 ASP N N 15 120.374 120.374 121.360 -0.986 18792 15390 1 20 . 1 1 15 15 ASP C C 15 177.557 177.557 177.829 -0.272 18792 15391 1 20 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.675 0.801 18792 15392 1 20 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.749 1.804 18792 15393 1 20 . 1 1 15 15 ASP H H 15 7.967 7.967 8.715 -0.748 18792 15394 1 20 . 1 1 16 16 PHE N N 16 119.864 119.864 119.887 -0.023 18792 15395 1 20 . 1 1 16 16 PHE C C 16 178.252 178.252 178.019 0.233 18792 15396 1 20 . 1 1 16 16 PHE CA C 16 62.780 62.780 62.359 0.420 18792 15397 1 20 . 1 1 16 16 PHE CB C 16 39.060 39.060 39.157 -0.097 18792 15398 1 20 . 1 1 16 16 PHE H H 16 8.228 8.228 7.879 0.349 18792 15399 1 20 . 1 1 17 17 LEU N N 17 116.312 116.312 119.258 -2.946 18792 15400 1 20 . 1 1 17 17 LEU C C 17 179.649 179.649 179.302 0.347 18792 15401 1 20 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.359 -0.595 18792 15402 1 20 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.669 -1.584 18792 15403 1 20 . 1 1 17 17 LEU H H 17 8.766 8.766 8.548 0.218 18792 15404 1 20 . 1 1 18 18 SER N N 18 113.715 113.715 114.735 -1.020 18792 15405 1 20 . 1 1 18 18 SER C C 18 177.362 177.362 176.697 0.665 18792 15406 1 20 . 1 1 18 18 SER CA C 18 61.948 61.948 62.302 -0.354 18792 15407 1 20 . 1 1 18 18 SER CB C 18 63.003 63.003 63.419 -0.416 18792 15408 1 20 . 1 1 18 18 SER H H 18 8.384 8.384 8.278 0.106 18792 15409 1 20 . 1 1 19 19 TYR N N 19 124.570 124.570 123.209 1.361 18792 15410 1 20 . 1 1 19 19 TYR C C 19 178.415 178.415 177.878 0.537 18792 15411 1 20 . 1 1 19 19 TYR CA C 19 59.764 59.764 59.963 -0.199 18792 15412 1 20 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.199 -1.183 18792 15413 1 20 . 1 1 19 19 TYR H H 19 8.155 8.155 8.981 -0.826 18792 15414 1 20 . 1 1 20 20 LYS N N 20 119.739 119.739 120.351 -0.612 18792 15415 1 20 . 1 1 20 20 LYS C C 20 180.456 180.456 179.053 1.403 18792 15416 1 20 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.422 -2.933 18792 15417 1 20 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.530 -4.371 18792 15418 1 20 . 1 1 20 20 LYS H H 20 8.224 8.224 8.179 0.045 18792 15419 1 20 . 1 1 21 21 LEU N N 21 118.092 118.092 120.335 -2.243 18792 15420 1 20 . 1 1 21 21 LEU C C 21 179.989 179.989 178.923 1.066 18792 15421 1 20 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.267 -0.141 18792 15422 1 20 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.948 -2.340 18792 15423 1 20 . 1 1 21 21 LEU H H 21 8.586 8.586 7.908 0.678 18792 15424 1 20 . 1 1 22 22 SER N N 22 117.304 117.304 114.012 3.292 18792 15425 1 20 . 1 1 22 22 SER C C 22 180.152 180.152 176.914 3.238 18792 15426 1 20 . 1 1 22 22 SER CA C 22 61.287 61.287 60.977 0.310 18792 15427 1 20 . 1 1 22 22 SER H H 22 8.266 8.266 7.706 0.560 18792 15428 1 20 . 1 1 23 23 GLN N N 23 122.497 122.497 121.474 1.023 18792 15429 1 20 . 1 1 23 23 GLN C C 23 177.297 177.297 177.455 -0.158 18792 15430 1 20 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.302 -0.360 18792 15431 1 20 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.392 -0.581 18792 15432 1 20 . 1 1 23 23 GLN H H 23 7.571 7.571 8.393 -0.823 18792 15433 1 20 . 1 1 24 24 LYS N N 24 116.038 116.038 117.329 -1.291 18792 15434 1 20 . 1 1 24 24 LYS C C 24 175.704 175.704 176.589 -0.885 18792 15435 1 20 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.642 -3.147 18792 15436 1 20 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.469 -2.240 18792 15437 1 20 . 1 1 24 24 LYS H H 24 7.134 7.134 7.502 -0.368 18792 15438 1 20 . 1 1 25 25 GLY N N 25 105.283 105.283 105.869 -0.586 18792 15439 1 20 . 1 1 25 25 GLY C C 25 174.013 174.013 173.497 0.516 18792 15440 1 20 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.438 0.341 18792 15441 1 20 . 1 1 25 25 GLY H H 25 7.483 7.483 7.637 -0.154 18792 15442 1 20 . 1 1 26 26 TYR N N 26 119.547 119.547 120.911 -1.364 18792 15443 1 20 . 1 1 26 26 TYR C C 26 175.122 175.122 174.081 1.041 18792 15444 1 20 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.717 -1.585 18792 15445 1 20 . 1 1 26 26 TYR CB C 26 40.080 40.080 38.686 1.394 18792 15446 1 20 . 1 1 26 26 TYR H H 26 7.788 7.788 7.542 0.246 18792 15447 1 20 . 1 1 27 27 SER N N 27 115.088 115.088 120.007 -4.919 18792 15448 1 20 . 1 1 27 27 SER C C 27 174.452 174.452 175.103 -0.651 18792 15449 1 20 . 1 1 27 27 SER CA C 27 56.306 56.306 56.014 0.292 18792 15450 1 20 . 1 1 27 27 SER CB C 27 63.921 63.921 63.970 -0.049 18792 15451 1 20 . 1 1 27 27 SER H H 27 8.473 8.473 8.687 -0.214 18792 15452 1 20 . 1 1 28 28 TRP N N 28 127.014 127.014 128.354 -1.340 18792 15453 1 20 . 1 1 28 28 TRP C C 28 177.002 177.002 178.337 -1.335 18792 15454 1 20 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.457 0.015 18792 15455 1 20 . 1 1 28 28 TRP CB C 28 29.830 29.830 28.783 1.047 18792 15456 1 20 . 1 1 28 28 TRP H H 28 8.897 8.897 8.592 0.305 18792 15457 1 20 . 1 1 29 29 SER N N 29 112.044 112.044 114.167 -2.123 18792 15458 1 20 . 1 1 29 29 SER C C 29 175.106 175.106 175.602 -0.496 18792 15459 1 20 . 1 1 29 29 SER CA C 29 59.472 59.472 60.020 -0.548 18792 15460 1 20 . 1 1 29 29 SER CB C 29 62.226 62.226 62.961 -0.735 18792 15461 1 20 . 1 1 29 29 SER H H 29 8.129 8.129 8.188 -0.059 18792 15462 1 20 . 1 1 30 30 GLN N N 30 119.160 119.160 119.924 -0.764 18792 15463 1 20 . 1 1 30 30 GLN C C 30 176.218 176.218 175.497 0.721 18792 15464 1 20 . 1 1 30 30 GLN CA C 30 56.412 56.412 55.672 0.740 18792 15465 1 20 . 1 1 30 30 GLN CB C 30 27.578 27.578 28.750 -1.172 18792 15466 1 20 . 1 1 30 30 GLN H H 30 7.370 7.370 7.603 -0.233 18792 15467 1 20 . 1 1 31 31 PHE N N 31 116.277 116.277 117.434 -1.157 18792 15468 1 20 . 1 1 31 31 PHE C C 31 175.217 175.217 175.863 -0.646 18792 15469 1 20 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.403 -2.169 18792 15470 1 20 . 1 1 31 31 PHE CB C 31 39.066 39.066 36.453 2.614 18792 15471 1 20 . 1 1 31 31 PHE H H 31 7.248 7.248 7.517 -0.269 18792 15472 1 20 . 1 1 32 32 SER N N 32 113.683 113.683 116.778 -3.095 18792 15473 1 20 . 1 1 32 32 SER C C 32 173.793 173.793 175.177 -1.384 18792 15474 1 20 . 1 1 32 32 SER CA C 32 57.124 57.124 59.380 -2.256 18792 15475 1 20 . 1 1 32 32 SER CB C 32 63.081 63.081 62.764 0.317 18792 15476 1 20 . 1 1 32 32 SER H H 32 7.242 7.242 8.347 -1.105 18792 15477 1 20 . 1 1 33 33 ASP N N 33 122.195 122.195 123.984 -1.789 18792 15478 1 20 . 1 1 33 33 ASP C C 33 176.394 176.394 175.625 0.769 18792 15479 1 20 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.736 -1.988 18792 15480 1 20 . 1 1 33 33 ASP CB C 33 40.398 40.398 39.692 0.706 18792 15481 1 20 . 1 1 33 33 ASP H H 33 8.257 8.257 8.653 -0.396 18792 15482 1 20 . 1 1 34 34 VAL N N 34 118.913 118.913 112.376 6.537 18792 15483 1 20 . 1 1 34 34 VAL C C 34 176.328 176.328 175.549 0.779 18792 15484 1 20 . 1 1 34 34 VAL CA C 34 61.891 61.891 64.340 -2.449 18792 15485 1 20 . 1 1 34 34 VAL CB C 34 32.015 32.015 30.196 1.819 18792 15486 1 20 . 1 1 34 34 VAL H H 34 7.852 7.852 7.898 -0.046 18792 15487 1 20 . 1 1 35 35 GLU N N 35 124.205 124.205 118.850 5.355 18792 15488 1 20 . 1 1 35 35 GLU C C 35 176.586 176.586 174.528 2.058 18792 15489 1 20 . 1 1 35 35 GLU CA C 35 56.057 56.057 55.557 0.500 18792 15490 1 20 . 1 1 35 35 GLU CB C 35 28.898 28.898 33.402 -4.504 18792 15491 1 20 . 1 1 35 35 GLU H H 35 8.401 8.401 7.980 0.421 18792 15492 1 20 . 1 1 36 36 GLU N N 36 121.670 121.670 117.947 3.723 18792 15493 1 20 . 1 1 36 36 GLU C C 36 176.218 176.218 173.787 2.431 18792 15494 1 20 . 1 1 36 36 GLU CA C 36 55.988 55.988 57.047 -1.059 18792 15495 1 20 . 1 1 36 36 GLU CB C 36 29.442 29.442 29.882 -0.440 18792 15496 1 20 . 1 1 36 36 GLU H H 36 8.239 8.239 8.726 -0.487 18792 15497 1 20 . 1 1 37 37 ASN N N 37 119.252 119.252 118.830 0.422 18792 15498 1 20 . 1 1 37 37 ASN C C 37 175.003 175.003 173.336 1.667 18792 15499 1 20 . 1 1 37 37 ASN CA C 37 52.655 52.655 52.660 -0.005 18792 15500 1 20 . 1 1 37 37 ASN CB C 37 38.212 38.212 40.289 -2.077 18792 15501 1 20 . 1 1 37 37 ASN H H 37 8.412 8.412 8.278 0.134 18792 15502 1 20 . 1 1 38 38 ARG N N 38 121.622 121.622 122.661 -1.039 18792 15503 1 20 . 1 1 38 38 ARG C C 38 176.610 176.610 173.316 3.294 18792 15504 1 20 . 1 1 38 38 ARG CA C 38 55.364 55.364 55.396 -0.032 18792 15505 1 20 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.853 -2.434 18792 15506 1 20 . 1 1 38 38 ARG H H 38 8.227 8.227 7.743 0.484 18792 15507 1 20 . 1 1 39 39 THR N N 39 115.681 115.681 112.999 2.682 18792 15508 1 20 . 1 1 39 39 THR C C 39 174.500 174.500 173.683 0.817 18792 15509 1 20 . 1 1 39 39 THR CA C 39 61.606 61.606 62.031 -0.425 18792 15510 1 20 . 1 1 39 39 THR CB C 39 69.163 69.163 69.288 -0.125 18792 15511 1 20 . 1 1 39 39 THR H H 39 8.173 8.173 7.966 0.207 18792 15512 1 20 . 1 1 40 40 GLU N N 40 122.708 122.708 120.642 2.066 18792 15513 1 20 . 1 1 40 40 GLU C C 40 175.728 175.728 175.321 0.407 18792 15514 1 20 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.157 -0.385 18792 15515 1 20 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.496 -0.442 18792 15516 1 20 . 1 1 40 40 GLU H H 40 8.298 8.298 8.129 0.169 18792 15517 1 20 . 1 1 41 41 ALA N N 41 125.922 125.922 122.913 3.009 18792 15518 1 20 . 1 1 41 41 ALA C C 41 175.557 175.557 176.243 -0.686 18792 15519 1 20 . 1 1 41 41 ALA CA C 41 49.973 49.973 53.052 -3.079 18792 15520 1 20 . 1 1 41 41 ALA CB C 41 17.245 17.245 18.454 -1.210 18792 15521 1 20 . 1 1 41 41 ALA H H 41 8.212 8.212 8.220 -0.008 18792 15522 1 20 . 1 1 43 43 GLU N N 43 120.783 120.783 120.345 0.438 18792 15523 1 20 . 1 1 43 43 GLU C C 43 177.174 177.174 176.587 0.587 18792 15524 1 20 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.902 -0.561 18792 15525 1 20 . 1 1 43 43 GLU CB C 43 29.287 29.287 30.766 -1.479 18792 15526 1 20 . 1 1 43 43 GLU H H 43 8.519 8.519 8.588 -0.069 18792 15527 1 20 . 1 1 44 44 GLY N N 44 110.022 110.022 108.180 1.842 18792 15528 1 20 . 1 1 44 44 GLY C C 44 174.773 174.773 174.018 0.755 18792 15529 1 20 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.938 -0.910 18792 15530 1 20 . 1 1 44 44 GLY H H 44 8.429 8.429 8.384 0.045 18792 15531 1 20 . 1 1 45 45 THR N N 45 112.790 112.790 114.794 -2.004 18792 15532 1 20 . 1 1 45 45 THR C C 45 175.726 175.726 174.886 0.840 18792 15533 1 20 . 1 1 45 45 THR CA C 45 61.987 61.987 62.280 -0.293 18792 15534 1 20 . 1 1 45 45 THR CB C 45 69.304 69.304 69.064 0.240 18792 15535 1 20 . 1 1 45 45 THR H H 45 8.125 8.125 8.096 0.029 18792 15536 1 20 . 1 1 46 46 GLU N N 46 122.752 122.752 121.268 1.484 18792 15537 1 20 . 1 1 46 46 GLU C C 46 177.419 177.419 175.705 1.714 18792 15538 1 20 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.329 0.902 18792 15539 1 20 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.808 -1.609 18792 15540 1 20 . 1 1 46 46 GLU H H 46 8.765 8.765 8.459 0.306 18792 15541 1 20 . 1 1 47 47 SER N N 47 114.895 114.895 111.618 3.277 18792 15542 1 20 . 1 1 47 47 SER C C 47 175.826 175.826 175.272 0.554 18792 15543 1 20 . 1 1 47 47 SER CA C 47 58.582 58.582 57.934 0.648 18792 15544 1 20 . 1 1 47 47 SER CB C 47 62.537 62.537 64.035 -1.498 18792 15545 1 20 . 1 1 47 47 SER H H 47 8.355 8.355 7.867 0.488 18792 15546 1 20 . 1 1 48 48 GLU N N 48 122.429 122.429 122.222 0.207 18792 15547 1 20 . 1 1 48 48 GLU C C 48 178.099 178.099 177.197 0.902 18792 15548 1 20 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.212 -0.594 18792 15549 1 20 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.309 -0.834 18792 15550 1 20 . 1 1 48 48 GLU H H 48 8.139 8.139 8.278 -0.139 18792 15551 1 20 . 1 1 49 49 ALA N N 49 120.374 120.374 122.970 -2.596 18792 15552 1 20 . 1 1 49 49 ALA C C 49 180.843 180.843 179.159 1.684 18792 15553 1 20 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.816 -0.333 18792 15554 1 20 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.277 -0.842 18792 15555 1 20 . 1 1 49 49 ALA H H 49 8.079 8.079 8.299 -0.220 18792 15556 1 20 . 1 1 50 50 VAL N N 50 118.599 118.599 118.796 -0.197 18792 15557 1 20 . 1 1 50 50 VAL C C 50 176.921 176.921 177.508 -0.587 18792 15558 1 20 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.271 0.289 18792 15559 1 20 . 1 1 50 50 VAL CB C 50 30.297 30.297 30.849 -0.552 18792 15560 1 20 . 1 1 50 50 VAL H H 50 7.419 7.419 7.995 -0.576 18792 15561 1 20 . 1 1 51 51 LYS N N 51 117.469 117.469 120.759 -3.290 18792 15562 1 20 . 1 1 51 51 LYS C C 51 179.061 179.061 178.857 0.204 18792 15563 1 20 . 1 1 51 51 LYS CA C 51 59.223 59.223 60.109 -0.886 18792 15564 1 20 . 1 1 51 51 LYS CB C 51 30.996 30.996 32.233 -1.236 18792 15565 1 20 . 1 1 51 51 LYS H H 51 7.359 7.359 7.598 -0.239 18792 15566 1 20 . 1 1 52 52 GLN N N 52 115.930 115.930 117.806 -1.876 18792 15567 1 20 . 1 1 52 52 GLN C C 52 177.713 177.713 178.050 -0.337 18792 15568 1 20 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.561 -0.085 18792 15569 1 20 . 1 1 52 52 GLN CB C 52 26.568 26.568 27.813 -1.245 18792 15570 1 20 . 1 1 52 52 GLN H H 52 8.025 8.025 7.902 0.123 18792 15571 1 20 . 1 1 53 53 ALA N N 53 119.782 119.782 122.145 -2.363 18792 15572 1 20 . 1 1 53 53 ALA C C 53 180.008 180.008 178.755 1.253 18792 15573 1 20 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.584 -0.199 18792 15574 1 20 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.299 -0.784 18792 15575 1 20 . 1 1 53 53 ALA H H 53 7.655 7.655 7.630 0.025 18792 15576 1 20 . 1 1 54 54 LEU N N 54 120.443 120.443 120.122 0.321 18792 15577 1 20 . 1 1 54 54 LEU C C 54 179.330 179.330 177.990 1.340 18792 15578 1 20 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.636 1.377 18792 15579 1 20 . 1 1 54 54 LEU CB C 54 40.862 40.862 40.873 -0.011 18792 15580 1 20 . 1 1 54 54 LEU H H 54 8.419 8.419 7.728 0.691 18792 15581 1 20 . 1 1 55 55 ARG N N 55 118.423 118.423 120.029 -1.606 18792 15582 1 20 . 1 1 55 55 ARG C C 55 178.767 178.767 178.235 0.532 18792 15583 1 20 . 1 1 55 55 ARG CA C 55 60.397 60.397 60.113 0.284 18792 15584 1 20 . 1 1 55 55 ARG CB C 55 28.743 28.743 30.240 -1.497 18792 15585 1 20 . 1 1 55 55 ARG H H 55 8.062 8.062 7.859 0.203 18792 15586 1 20 . 1 1 56 56 GLU N N 56 115.988 115.988 119.337 -3.349 18792 15587 1 20 . 1 1 56 56 GLU C C 56 180.090 180.090 178.471 1.619 18792 15588 1 20 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.977 -1.217 18792 15589 1 20 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.581 -1.227 18792 15590 1 20 . 1 1 56 56 GLU H H 56 7.772 7.772 8.014 -0.242 18792 15591 1 20 . 1 1 57 57 ALA N N 57 122.837 122.837 121.390 1.447 18792 15592 1 20 . 1 1 57 57 ALA C C 57 181.861 181.861 179.724 2.137 18792 15593 1 20 . 1 1 57 57 ALA CA C 57 54.634 54.634 55.083 -0.449 18792 15594 1 20 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.575 -0.102 18792 15595 1 20 . 1 1 57 57 ALA H H 57 8.774 8.774 7.985 0.789 18792 15596 1 20 . 1 1 58 58 GLY N N 58 108.409 108.409 106.558 1.851 18792 15597 1 20 . 1 1 58 58 GLY C C 58 175.331 175.331 175.950 -0.619 18792 15598 1 20 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.896 -0.228 18792 15599 1 20 . 1 1 58 58 GLY H H 58 9.073 9.073 8.311 0.762 18792 15600 1 20 . 1 1 59 59 ASP N N 59 122.074 122.074 122.632 -0.558 18792 15601 1 20 . 1 1 59 59 ASP C C 59 179.023 179.023 178.794 0.229 18792 15602 1 20 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.426 -0.124 18792 15603 1 20 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.715 -1.873 18792 15604 1 20 . 1 1 59 59 ASP H H 59 8.049 8.049 8.522 -0.473 18792 15605 1 20 . 1 1 60 60 GLU N N 60 120.131 120.131 120.950 -0.819 18792 15606 1 20 . 1 1 60 60 GLU C C 60 178.522 178.522 179.164 -0.642 18792 15607 1 20 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.878 -0.869 18792 15608 1 20 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.755 -1.556 18792 15609 1 20 . 1 1 60 60 GLU H H 60 8.136 8.136 8.391 -0.255 18792 15610 1 20 . 1 1 61 61 PHE N N 61 121.309 121.309 119.274 2.035 18792 15611 1 20 . 1 1 61 61 PHE C C 61 176.904 176.904 178.274 -1.370 18792 15612 1 20 . 1 1 61 61 PHE CA C 61 61.322 61.322 62.039 -0.717 18792 15613 1 20 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.499 -0.890 18792 15614 1 20 . 1 1 61 61 PHE H H 61 8.523 8.523 8.153 0.370 18792 15615 1 20 . 1 1 62 62 GLU N N 62 115.971 115.971 119.954 -3.983 18792 15616 1 20 . 1 1 62 62 GLU C C 62 177.713 177.713 178.754 -1.041 18792 15617 1 20 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.441 -1.250 18792 15618 1 20 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.682 -1.405 18792 15619 1 20 . 1 1 62 62 GLU H H 62 7.969 7.969 8.404 -0.435 18792 15620 1 20 . 1 1 63 63 LEU N N 63 116.703 116.703 119.518 -2.815 18792 15621 1 20 . 1 1 63 63 LEU C C 63 178.963 178.963 177.848 1.115 18792 15622 1 20 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.753 -0.341 18792 15623 1 20 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.242 -0.836 18792 15624 1 20 . 1 1 63 63 LEU H H 63 7.347 7.347 7.852 -0.505 18792 15625 1 20 . 1 1 64 64 ARG N N 64 117.453 117.453 116.598 0.855 18792 15626 1 20 . 1 1 64 64 ARG C C 64 177.297 177.297 177.204 0.093 18792 15627 1 20 . 1 1 64 64 ARG CA C 64 57.337 57.337 58.672 -1.335 18792 15628 1 20 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.282 -0.685 18792 15629 1 20 . 1 1 64 64 ARG H H 64 7.995 7.995 8.082 -0.087 18792 15630 1 20 . 1 1 65 65 TYR N N 65 118.956 118.956 114.893 4.063 18792 15631 1 20 . 1 1 65 65 TYR C C 65 175.278 175.278 177.143 -1.865 18792 15632 1 20 . 1 1 65 65 TYR CA C 65 55.701 55.701 58.520 -2.820 18792 15633 1 20 . 1 1 65 65 TYR CB C 65 35.986 35.986 39.680 -3.694 18792 15634 1 20 . 1 1 65 65 TYR H H 65 7.909 7.909 7.876 0.033 18792 15635 1 20 . 1 1 66 66 ARG N N 66 119.438 119.438 117.831 1.607 18792 15636 1 20 . 1 1 66 66 ARG C C 66 178.424 178.424 177.949 0.475 18792 15637 1 20 . 1 1 66 66 ARG CA C 66 58.476 58.476 59.306 -0.830 18792 15638 1 20 . 1 1 66 66 ARG CB C 66 28.821 28.821 28.584 0.237 18792 15639 1 20 . 1 1 66 66 ARG H H 66 7.244 7.244 8.538 -1.294 18792 15640 1 20 . 1 1 67 67 ARG N N 67 118.936 118.936 120.061 -1.125 18792 15641 1 20 . 1 1 67 67 ARG C C 67 177.542 177.542 177.810 -0.268 18792 15642 1 20 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.400 -1.956 18792 15643 1 20 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.905 -1.784 18792 15644 1 20 . 1 1 67 67 ARG H H 67 8.417 8.417 8.397 0.020 18792 15645 1 20 . 1 1 68 68 ALA N N 68 121.797 121.797 121.411 0.386 18792 15646 1 20 . 1 1 68 68 ALA C C 68 180.337 180.337 179.624 0.713 18792 15647 1 20 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.375 -0.239 18792 15648 1 20 . 1 1 68 68 ALA CB C 68 17.467 17.467 17.771 -0.304 18792 15649 1 20 . 1 1 68 68 ALA H H 68 7.827 7.827 8.314 -0.487 18792 15650 1 20 . 1 1 69 69 PHE N N 69 115.986 115.986 116.485 -0.499 18792 15651 1 20 . 1 1 69 69 PHE C C 69 177.468 177.468 177.745 -0.277 18792 15652 1 20 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.445 -1.396 18792 15653 1 20 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.516 -0.917 18792 15654 1 20 . 1 1 69 69 PHE H H 69 8.517 8.517 7.315 1.202 18792 15655 1 20 . 1 1 70 70 SER N N 70 116.526 116.526 118.336 -1.810 18792 15656 1 20 . 1 1 70 70 SER C C 70 177.640 177.640 176.582 1.058 18792 15657 1 20 . 1 1 70 70 SER CA C 70 61.073 61.073 61.832 -0.759 18792 15658 1 20 . 1 1 70 70 SER CB C 70 61.993 61.993 63.167 -1.174 18792 15659 1 20 . 1 1 70 70 SER H H 70 8.152 8.152 8.761 -0.609 18792 15660 1 20 . 1 1 71 71 ASP N N 71 121.181 121.181 121.436 -0.255 18792 15661 1 20 . 1 1 71 71 ASP C C 71 178.546 178.546 178.068 0.478 18792 15662 1 20 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.114 -0.666 18792 15663 1 20 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.935 -1.704 18792 15664 1 20 . 1 1 71 71 ASP H H 71 8.356 8.356 8.347 0.009 18792 15665 1 20 . 1 1 72 72 LEU N N 72 120.747 120.747 119.679 1.068 18792 15666 1 20 . 1 1 72 72 LEU C C 72 178.963 178.963 178.357 0.606 18792 15667 1 20 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.123 -0.679 18792 15668 1 20 . 1 1 72 72 LEU CB C 72 41.017 41.017 42.173 -1.156 18792 15669 1 20 . 1 1 72 72 LEU H H 72 7.738 7.738 7.280 0.458 18792 15670 1 20 . 1 1 73 73 THR N N 73 109.432 109.432 111.492 -2.060 18792 15671 1 20 . 1 1 73 73 THR C C 73 177.481 177.481 176.695 0.786 18792 15672 1 20 . 1 1 73 73 THR CA C 73 65.128 65.128 65.893 -0.765 18792 15673 1 20 . 1 1 73 73 THR CB C 73 67.720 67.720 68.318 -0.598 18792 15674 1 20 . 1 1 73 73 THR H H 73 8.296 8.296 8.443 -0.147 18792 15675 1 20 . 1 1 74 74 SER N N 74 115.862 115.862 116.473 -0.611 18792 15676 1 20 . 1 1 74 74 SER C C 74 175.361 175.361 176.163 -0.802 18792 15677 1 20 . 1 1 74 74 SER CA C 74 60.112 60.112 60.080 0.032 18792 15678 1 20 . 1 1 74 74 SER CB C 74 62.537 62.537 62.740 -0.203 18792 15679 1 20 . 1 1 74 74 SER H H 74 7.629 7.629 8.324 -0.695 18792 15680 1 20 . 1 1 75 75 GLN N N 75 118.551 118.551 118.105 0.446 18792 15681 1 20 . 1 1 75 75 GLN C C 75 176.316 176.316 176.547 -0.231 18792 15682 1 20 . 1 1 75 75 GLN CA C 75 56.804 56.804 57.346 -0.542 18792 15683 1 20 . 1 1 75 75 GLN CB C 75 28.277 28.277 30.085 -1.808 18792 15684 1 20 . 1 1 75 75 GLN H H 75 7.640 7.640 7.871 -0.231 18792 15685 1 20 . 1 1 76 76 LEU N N 76 118.313 118.313 119.935 -1.622 18792 15686 1 20 . 1 1 76 76 LEU C C 76 174.160 174.160 177.597 -3.437 18792 15687 1 20 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.901 -1.161 18792 15688 1 20 . 1 1 76 76 LEU CB C 76 42.727 42.727 43.824 -1.097 18792 15689 1 20 . 1 1 76 76 LEU H H 76 7.411 7.411 7.564 -0.153 18792 15690 1 20 . 1 1 77 77 HIS N N 77 120.104 120.104 116.177 3.927 18792 15691 1 20 . 1 1 77 77 HIS C C 77 174.528 174.528 175.513 -0.985 18792 15692 1 20 . 1 1 77 77 HIS CA C 77 54.207 54.207 60.002 -5.795 18792 15693 1 20 . 1 1 77 77 HIS CB C 77 27.966 27.966 29.580 -1.614 18792 15694 1 20 . 1 1 77 77 HIS H H 77 8.117 8.117 8.397 -0.280 18792 15695 1 20 . 1 1 78 78 ILE N N 78 122.298 122.298 115.765 6.533 18792 15696 1 20 . 1 1 78 78 ILE C C 78 174.240 174.240 174.661 -0.421 18792 15697 1 20 . 1 1 78 78 ILE CA C 78 61.402 61.402 61.367 0.035 18792 15698 1 20 . 1 1 78 78 ILE CB C 78 37.591 37.591 38.426 -0.835 18792 15699 1 20 . 1 1 78 78 ILE H H 78 8.655 8.655 8.231 0.424 18792 15700 1 20 . 1 1 79 79 THR N N 79 116.442 116.442 116.699 -0.257 18792 15701 1 20 . 1 1 79 79 THR C C 79 174.291 174.291 173.909 0.382 18792 15702 1 20 . 1 1 79 79 THR CA C 79 61.632 61.632 64.933 -3.301 18792 15703 1 20 . 1 1 79 79 THR CB C 79 68.704 68.704 66.958 1.746 18792 15704 1 20 . 1 1 79 79 THR H H 79 8.245 8.245 8.040 0.205 18792 15705 1 20 . 1 1 84 84 TYR N N 84 120.888 120.888 120.135 0.753 18792 15706 1 20 . 1 1 84 84 TYR C C 84 176.708 176.708 177.440 -0.732 18792 15707 1 20 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.041 -0.609 18792 15708 1 20 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.733 -0.988 18792 15709 1 20 . 1 1 84 84 TYR H H 84 8.733 8.733 8.036 0.697 18792 15710 1 20 . 1 1 85 85 GLN N N 85 114.530 114.530 118.322 -3.792 18792 15711 1 20 . 1 1 85 85 GLN C C 85 178.473 178.473 178.248 0.225 18792 15712 1 20 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.679 -0.385 18792 15713 1 20 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.111 -1.310 18792 15714 1 20 . 1 1 85 85 GLN H H 85 8.413 8.413 8.637 -0.224 18792 15715 1 20 . 1 1 86 86 SER N N 86 114.032 114.032 115.801 -1.769 18792 15716 1 20 . 1 1 86 86 SER C C 86 178.473 178.473 176.736 1.737 18792 15717 1 20 . 1 1 86 86 SER CA C 86 62.175 62.175 61.294 0.881 18792 15718 1 20 . 1 1 86 86 SER CB C 86 63.252 63.252 62.705 0.547 18792 15719 1 20 . 1 1 86 86 SER H H 86 7.258 7.258 7.657 -0.399 18792 15720 1 20 . 1 1 88 88 GLU N N 88 119.386 119.386 117.852 1.534 18792 15721 1 20 . 1 1 88 88 GLU C C 88 177.199 177.199 179.013 -1.814 18792 15722 1 20 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.586 -1.004 18792 15723 1 20 . 1 1 88 88 GLU CB C 88 28.976 28.976 28.736 0.240 18792 15724 1 20 . 1 1 88 88 GLU H H 88 8.534 8.534 7.892 0.642 18792 15725 1 20 . 1 1 89 89 GLN N N 89 114.678 114.678 119.922 -5.244 18792 15726 1 20 . 1 1 89 89 GLN C C 89 178.669 178.669 178.316 0.353 18792 15727 1 20 . 1 1 89 89 GLN CA C 89 58.582 58.582 58.487 0.095 18792 15728 1 20 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.369 -0.947 18792 15729 1 20 . 1 1 89 89 GLN H H 89 7.500 7.500 7.596 -0.096 18792 15730 1 20 . 1 1 90 90 VAL N N 90 118.174 118.174 119.415 -1.241 18792 15731 1 20 . 1 1 90 90 VAL C C 90 178.081 178.081 177.430 0.651 18792 15732 1 20 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.447 0.108 18792 15733 1 20 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.022 -0.415 18792 15734 1 20 . 1 1 90 90 VAL H H 90 7.017 7.017 7.855 -0.838 18792 15735 1 20 . 1 1 91 91 VAL N N 91 119.489 119.489 119.883 -0.394 18792 15736 1 20 . 1 1 91 91 VAL C C 91 177.914 177.914 177.805 0.109 18792 15737 1 20 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.413 -0.644 18792 15738 1 20 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.792 -0.501 18792 15739 1 20 . 1 1 91 91 VAL H H 91 7.833 7.833 8.146 -0.313 18792 15740 1 20 . 1 1 92 92 ASN N N 92 117.180 117.180 118.633 -1.453 18792 15741 1 20 . 1 1 92 92 ASN C C 92 179.110 179.110 177.216 1.894 18792 15742 1 20 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.086 -1.168 18792 15743 1 20 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.567 -2.599 18792 15744 1 20 . 1 1 92 92 ASN H H 92 8.368 8.368 8.196 0.172 18792 15745 1 20 . 1 1 93 93 GLU N N 93 118.476 118.476 119.572 -1.096 18792 15746 1 20 . 1 1 93 93 GLU C C 93 179.355 179.355 178.738 0.617 18792 15747 1 20 . 1 1 93 93 GLU CA C 93 58.405 58.405 59.093 -0.688 18792 15748 1 20 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.859 -2.126 18792 15749 1 20 . 1 1 93 93 GLU H H 93 7.213 7.213 7.776 -0.563 18792 15750 1 20 . 1 1 94 94 LEU N N 94 120.889 120.889 121.202 -0.313 18792 15751 1 20 . 1 1 94 94 LEU C C 94 178.473 178.473 178.503 -0.030 18792 15752 1 20 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.200 -0.183 18792 15753 1 20 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.471 -1.541 18792 15754 1 20 . 1 1 94 94 LEU H H 94 7.446 7.446 7.985 -0.539 18792 15755 1 20 . 1 1 95 95 PHE N N 95 112.902 112.902 117.614 -4.712 18792 15756 1 20 . 1 1 95 95 PHE C C 95 176.586 176.586 177.648 -1.062 18792 15757 1 20 . 1 1 95 95 PHE CA C 95 57.159 57.159 59.472 -2.313 18792 15758 1 20 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.514 -0.293 18792 15759 1 20 . 1 1 95 95 PHE H H 95 6.916 6.916 8.233 -1.317 18792 15760 1 20 . 1 1 96 96 ARG N N 96 123.729 123.729 118.622 5.107 18792 15761 1 20 . 1 1 96 96 ARG C C 96 177.272 177.272 176.872 0.400 18792 15762 1 20 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.563 0.660 18792 15763 1 20 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.584 -2.152 18792 15764 1 20 . 1 1 96 96 ARG H H 96 7.126 7.126 7.617 -0.491 18792 15765 1 20 . 1 1 97 97 ASP N N 97 116.576 116.576 115.514 1.062 18792 15766 1 20 . 1 1 97 97 ASP C C 97 175.687 175.687 174.380 1.307 18792 15767 1 20 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.554 -0.881 18792 15768 1 20 . 1 1 97 97 ASP CB C 97 40.045 40.045 43.323 -3.278 18792 15769 1 20 . 1 1 97 97 ASP H H 97 8.644 8.644 7.843 0.801 18792 15770 1 20 . 1 1 98 98 GLY N N 98 108.551 108.551 107.645 0.906 18792 15771 1 20 . 1 1 98 98 GLY C C 98 172.690 172.690 172.575 0.115 18792 15772 1 20 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.398 -2.148 18792 15773 1 20 . 1 1 98 98 GLY H H 98 7.463 7.463 8.110 -0.647 18792 15774 1 20 . 1 1 99 99 VAL N N 99 120.630 120.630 122.866 -2.236 18792 15775 1 20 . 1 1 99 99 VAL C C 99 174.503 174.503 174.429 0.074 18792 15776 1 20 . 1 1 99 99 VAL CA C 99 62.318 62.318 62.876 -0.558 18792 15777 1 20 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.653 -1.890 18792 15778 1 20 . 1 1 99 99 VAL H H 99 8.184 8.184 8.657 -0.473 18792 15779 1 20 . 1 1 100 100 ASN N N 100 115.485 115.485 116.532 -1.047 18792 15780 1 20 . 1 1 100 100 ASN C C 100 175.239 175.239 176.921 -1.682 18792 15781 1 20 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.140 -2.779 18792 15782 1 20 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.572 0.348 18792 15783 1 20 . 1 1 100 100 ASN H H 100 6.241 6.241 8.017 -1.776 18792 15784 1 20 . 1 1 101 101 TRP N N 101 118.266 118.266 119.694 -1.428 18792 15785 1 20 . 1 1 101 101 TRP C C 101 178.301 178.301 175.883 2.418 18792 15786 1 20 . 1 1 101 101 TRP CA C 101 60.539 60.539 58.588 1.951 18792 15787 1 20 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.426 1.404 18792 15788 1 20 . 1 1 101 101 TRP H H 101 8.409 8.409 8.727 -0.318 18792 15789 1 20 . 1 1 102 102 GLY N N 102 106.147 106.147 107.156 -1.009 18792 15790 1 20 . 1 1 102 102 GLY C C 102 177.640 177.640 175.248 2.392 18792 15791 1 20 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.909 2.005 18792 15792 1 20 . 1 1 102 102 GLY H H 102 8.504 8.504 7.824 0.680 18792 15793 1 20 . 1 1 103 103 ARG N N 103 121.347 121.347 121.532 -0.185 18792 15794 1 20 . 1 1 103 103 ARG C C 103 177.738 177.738 178.008 -0.270 18792 15795 1 20 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.847 -0.905 18792 15796 1 20 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.117 0.102 18792 15797 1 20 . 1 1 103 103 ARG H H 103 8.099 8.099 8.334 -0.235 18792 15798 1 20 . 1 1 104 104 ILE N N 104 120.930 120.930 119.775 1.155 18792 15799 1 20 . 1 1 104 104 ILE C C 104 178.197 178.197 177.742 0.455 18792 15800 1 20 . 1 1 104 104 ILE CA C 104 66.535 66.535 65.099 1.436 18792 15801 1 20 . 1 1 104 104 ILE CB C 104 36.045 36.045 38.130 -2.085 18792 15802 1 20 . 1 1 104 104 ILE H H 104 7.690 7.690 7.778 -0.088 18792 15803 1 20 . 1 1 105 105 VAL N N 105 120.938 120.938 119.276 1.662 18792 15804 1 20 . 1 1 105 105 VAL C C 105 177.854 177.854 177.910 -0.056 18792 15805 1 20 . 1 1 105 105 VAL CA C 105 67.458 67.458 65.668 1.790 18792 15806 1 20 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.521 -0.147 18792 15807 1 20 . 1 1 105 105 VAL H H 105 8.245 8.245 7.472 0.773 18792 15808 1 20 . 1 1 106 106 ALA N N 106 121.165 121.165 121.835 -0.670 18792 15809 1 20 . 1 1 106 106 ALA C C 106 178.284 178.284 179.668 -1.384 18792 15810 1 20 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.996 -0.398 18792 15811 1 20 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.677 -1.162 18792 15812 1 20 . 1 1 106 106 ALA H H 106 7.529 7.529 7.814 -0.285 18792 15813 1 20 . 1 1 107 107 PHE N N 107 119.242 119.242 119.440 -0.198 18792 15814 1 20 . 1 1 107 107 PHE C C 107 176.390 176.390 177.324 -0.934 18792 15815 1 20 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.008 0.165 18792 15816 1 20 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.495 -1.408 18792 15817 1 20 . 1 1 107 107 PHE H H 107 7.974 7.974 7.472 0.502 18792 15818 1 20 . 1 1 108 108 PHE N N 108 120.009 120.009 116.259 3.750 18792 15819 1 20 . 1 1 108 108 PHE C C 108 177.640 177.640 178.123 -0.483 18792 15820 1 20 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.742 0.682 18792 15821 1 20 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.041 -2.695 18792 15822 1 20 . 1 1 108 108 PHE H H 108 7.946 7.946 7.936 0.010 18792 15823 1 20 . 1 1 109 109 SER N N 109 114.631 114.631 115.315 -0.684 18792 15824 1 20 . 1 1 109 109 SER C C 109 177.770 177.770 176.102 1.668 18792 15825 1 20 . 1 1 109 109 SER CA C 109 63.349 63.349 61.925 1.423 18792 15826 1 20 . 1 1 109 109 SER H H 109 8.424 8.424 7.846 0.578 18792 15827 1 20 . 1 1 110 110 PHE N N 110 124.230 124.230 123.280 0.950 18792 15828 1 20 . 1 1 110 110 PHE C C 110 176.708 176.708 177.137 -0.429 18792 15829 1 20 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.709 -0.095 18792 15830 1 20 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.773 -1.329 18792 15831 1 20 . 1 1 110 110 PHE H H 110 9.052 9.052 8.097 0.955 18792 15832 1 20 . 1 1 111 111 GLY N N 111 105.893 105.893 106.070 -0.177 18792 15833 1 20 . 1 1 111 111 GLY C C 111 176.795 176.795 176.027 0.768 18792 15834 1 20 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.793 0.583 18792 15835 1 20 . 1 1 111 111 GLY H H 111 7.926 7.926 8.636 -0.710 18792 15836 1 20 . 1 1 112 112 GLY N N 112 107.410 107.410 109.416 -2.006 18792 15837 1 20 . 1 1 112 112 GLY C C 112 174.650 174.650 175.497 -0.847 18792 15838 1 20 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.352 0.953 18792 15839 1 20 . 1 1 112 112 GLY H H 112 8.799 8.799 7.897 0.902 18792 15840 1 20 . 1 1 113 113 ALA N N 113 124.313 124.313 125.055 -0.742 18792 15841 1 20 . 1 1 113 113 ALA C C 113 181.300 181.300 179.591 1.709 18792 15842 1 20 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.778 -0.251 18792 15843 1 20 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.321 -0.838 18792 15844 1 20 . 1 1 113 113 ALA H H 113 8.212 8.212 7.799 0.413 18792 15845 1 20 . 1 1 114 114 LEU N N 114 118.878 118.878 118.737 0.141 18792 15846 1 20 . 1 1 114 114 LEU C C 114 180.286 180.286 179.309 0.977 18792 15847 1 20 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.283 -0.301 18792 15848 1 20 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.436 -0.419 18792 15849 1 20 . 1 1 114 114 LEU H H 114 8.161 8.161 7.935 0.226 18792 15850 1 20 . 1 1 115 115 CYS N N 115 119.002 119.002 118.854 0.148 18792 15851 1 20 . 1 1 115 115 CYS C C 115 176.087 176.087 176.857 -0.770 18792 15852 1 20 . 1 1 115 115 CYS CA C 115 63.944 63.944 62.395 1.549 18792 15853 1 20 . 1 1 115 115 CYS CB C 115 25.635 25.635 25.872 -0.237 18792 15854 1 20 . 1 1 115 115 CYS H H 115 8.070 8.070 7.826 0.244 18792 15855 1 20 . 1 1 116 116 VAL N N 116 118.737 118.737 119.119 -0.382 18792 15856 1 20 . 1 1 116 116 VAL C C 116 177.494 177.494 178.875 -1.381 18792 15857 1 20 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.387 0.375 18792 15858 1 20 . 1 1 116 116 VAL CB C 116 30.763 30.763 30.848 -0.085 18792 15859 1 20 . 1 1 116 116 VAL H H 116 7.995 7.995 7.618 0.377 18792 15860 1 20 . 1 1 117 117 GLU N N 117 118.886 118.886 119.029 -0.143 18792 15861 1 20 . 1 1 117 117 GLU C C 117 178.424 178.424 178.737 -0.313 18792 15862 1 20 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.186 -0.426 18792 15863 1 20 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.470 -1.416 18792 15864 1 20 . 1 1 117 117 GLU H H 117 8.059 8.059 7.817 0.242 18792 15865 1 20 . 1 1 118 118 SER N N 118 113.417 113.417 115.728 -2.311 18792 15866 1 20 . 1 1 118 118 SER C C 118 175.607 175.607 176.744 -1.137 18792 15867 1 20 . 1 1 118 118 SER CA C 118 62.638 62.638 61.546 1.092 18792 15868 1 20 . 1 1 118 118 SER CB C 118 61.061 61.061 62.656 -1.595 18792 15869 1 20 . 1 1 118 118 SER H H 118 7.626 7.626 7.468 0.158 18792 15870 1 20 . 1 1 119 119 VAL N N 119 120.612 120.612 121.804 -1.192 18792 15871 1 20 . 1 1 119 119 VAL C C 119 179.713 179.713 178.104 1.609 18792 15872 1 20 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.366 0.859 18792 15873 1 20 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.057 -0.978 18792 15874 1 20 . 1 1 119 119 VAL H H 119 7.297 7.297 7.770 -0.473 18792 15875 1 20 . 1 1 120 120 ASP N N 120 122.546 122.546 117.983 4.563 18792 15876 1 20 . 1 1 120 120 ASP C C 120 178.057 178.057 177.623 0.434 18792 15877 1 20 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.428 0.561 18792 15878 1 20 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.967 -1.044 18792 15879 1 20 . 1 1 120 120 ASP H H 120 8.264 8.264 7.970 0.294 18792 15880 1 20 . 1 1 121 121 LYS N N 121 115.636 115.636 116.720 -1.084 18792 15881 1 20 . 1 1 121 121 LYS C C 121 175.159 175.159 175.914 -0.755 18792 15882 1 20 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.034 -0.774 18792 15883 1 20 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.371 -1.597 18792 15884 1 20 . 1 1 121 121 LYS H H 121 7.558 7.558 7.392 0.166 18792 15885 1 20 . 1 1 122 122 GLU N N 122 113.915 113.915 117.649 -3.734 18792 15886 1 20 . 1 1 122 122 GLU C C 122 176.109 176.109 175.390 0.719 18792 15887 1 20 . 1 1 122 122 GLU CA C 122 57.307 57.307 56.886 0.421 18792 15888 1 20 . 1 1 122 122 GLU CB C 122 25.332 25.332 28.366 -3.034 18792 15889 1 20 . 1 1 122 122 GLU H H 122 7.826 7.826 7.800 0.026 18792 15890 1 20 . 1 1 124 124 GLN N N 124 119.233 119.233 122.346 -3.113 18792 15891 1 20 . 1 1 124 124 GLN C C 124 177.640 177.640 176.817 0.823 18792 15892 1 20 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.010 1.462 18792 15893 1 20 . 1 1 124 124 GLN CB C 124 26.490 26.490 29.106 -2.616 18792 15894 1 20 . 1 1 124 124 GLN H H 124 8.626 8.626 8.207 0.419 18792 15895 1 20 . 1 1 125 125 VAL N N 125 117.011 117.011 115.115 1.896 18792 15896 1 20 . 1 1 125 125 VAL C C 125 175.826 175.826 176.764 -0.938 18792 15897 1 20 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.243 -0.107 18792 15898 1 20 . 1 1 125 125 VAL CB C 125 30.297 30.297 31.373 -1.076 18792 15899 1 20 . 1 1 125 125 VAL H H 125 7.870 7.870 7.788 0.082 18792 15900 1 20 . 1 1 126 126 LEU N N 126 117.058 117.058 120.236 -3.178 18792 15901 1 20 . 1 1 126 126 LEU C C 126 178.096 178.096 177.591 0.505 18792 15902 1 20 . 1 1 126 126 LEU CA C 126 55.085 55.085 58.134 -3.049 18792 15903 1 20 . 1 1 126 126 LEU CB C 126 40.273 40.273 41.437 -1.164 18792 15904 1 20 . 1 1 126 126 LEU H H 126 7.747 7.747 8.233 -0.486 18792 15905 1 20 . 1 1 127 127 VAL N N 127 119.457 119.457 117.194 2.263 18792 15906 1 20 . 1 1 127 127 VAL C C 127 177.150 177.150 178.157 -1.007 18792 15907 1 20 . 1 1 127 127 VAL CA C 127 67.156 67.156 65.861 1.295 18792 15908 1 20 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.623 -0.870 18792 15909 1 20 . 1 1 127 127 VAL H H 127 7.306 7.306 8.203 -0.897 18792 15910 1 20 . 1 1 128 128 SER N N 128 110.647 110.647 114.904 -4.257 18792 15911 1 20 . 1 1 128 128 SER C C 128 177.222 177.222 176.911 0.311 18792 15912 1 20 . 1 1 128 128 SER CA C 128 60.752 60.752 61.820 -1.068 18792 15913 1 20 . 1 1 128 128 SER CB C 128 61.605 61.605 63.027 -1.422 18792 15914 1 20 . 1 1 128 128 SER H H 128 8.237 8.237 7.853 0.384 18792 15915 1 20 . 1 1 129 129 ARG N N 129 123.100 123.100 122.532 0.568 18792 15916 1 20 . 1 1 129 129 ARG C C 129 175.802 175.802 178.910 -3.108 18792 15917 1 20 . 1 1 129 129 ARG CA C 129 58.227 58.227 59.277 -1.050 18792 15918 1 20 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.642 -2.443 18792 15919 1 20 . 1 1 129 129 ARG H H 129 6.564 6.564 7.868 -1.304 18792 15920 1 20 . 1 1 130 130 ILE N N 130 118.182 118.182 117.743 0.439 18792 15921 1 20 . 1 1 130 130 ILE C C 130 178.156 178.156 177.811 0.345 18792 15922 1 20 . 1 1 130 130 ILE CA C 130 64.346 64.346 64.873 -0.527 18792 15923 1 20 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.605 -0.923 18792 15924 1 20 . 1 1 130 130 ILE H H 130 7.955 7.955 8.416 -0.461 18792 15925 1 20 . 1 1 131 131 ALA N N 131 119.029 119.029 122.245 -3.216 18792 15926 1 20 . 1 1 131 131 ALA C C 131 179.593 179.593 179.311 0.282 18792 15927 1 20 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.224 -0.626 18792 15928 1 20 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.025 -0.637 18792 15929 1 20 . 1 1 131 131 ALA H H 131 7.582 7.582 8.732 -1.150 18792 15930 1 20 . 1 1 132 132 ALA N N 132 120.336 120.336 121.821 -1.485 18792 15931 1 20 . 1 1 132 132 ALA C C 132 181.095 181.095 179.478 1.617 18792 15932 1 20 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.677 -0.079 18792 15933 1 20 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.372 -1.671 18792 15934 1 20 . 1 1 132 132 ALA H H 132 7.224 7.224 7.768 -0.544 18792 15935 1 20 . 1 1 133 133 TRP N N 133 121.194 121.194 119.743 1.451 18792 15936 1 20 . 1 1 133 133 TRP C C 133 179.698 179.698 178.727 0.971 18792 15937 1 20 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.304 -3.002 18792 15938 1 20 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.533 -1.878 18792 15939 1 20 . 1 1 133 133 TRP H H 133 8.925 8.925 8.466 0.459 18792 15940 1 20 . 1 1 134 134 MET N N 134 116.987 116.987 118.640 -1.653 18792 15941 1 20 . 1 1 134 134 MET C C 134 178.277 178.277 178.815 -0.538 18792 15942 1 20 . 1 1 134 134 MET CA C 134 59.578 59.578 57.984 1.594 18792 15943 1 20 . 1 1 134 134 MET CB C 134 33.559 33.559 32.088 1.471 18792 15944 1 20 . 1 1 134 134 MET H H 134 8.863 8.863 8.751 0.112 18792 15945 1 20 . 1 1 135 135 ALA N N 135 120.523 120.523 121.258 -0.735 18792 15946 1 20 . 1 1 135 135 ALA C C 135 179.298 179.298 179.636 -0.338 18792 15947 1 20 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.350 0.083 18792 15948 1 20 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.198 -1.561 18792 15949 1 20 . 1 1 135 135 ALA H H 135 8.152 8.152 8.367 -0.215 18792 15950 1 20 . 1 1 136 136 THR N N 136 116.715 116.715 118.011 -1.296 18792 15951 1 20 . 1 1 136 136 THR C C 136 175.106 175.106 176.545 -1.439 18792 15952 1 20 . 1 1 136 136 THR CA C 136 66.729 66.729 66.944 -0.215 18792 15953 1 20 . 1 1 136 136 THR CB C 136 68.441 68.441 69.142 -0.701 18792 15954 1 20 . 1 1 136 136 THR H H 136 8.532 8.532 8.243 0.289 18792 15955 1 20 . 1 1 137 137 TYR N N 137 123.204 123.204 122.295 0.909 18792 15956 1 20 . 1 1 137 137 TYR C C 137 179.592 179.592 177.820 1.772 18792 15957 1 20 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.693 1.372 18792 15958 1 20 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.244 -0.256 18792 15959 1 20 . 1 1 137 137 TYR H H 137 8.809 8.809 8.423 0.386 18792 15960 1 20 . 1 1 138 138 LEU N N 138 119.247 119.247 120.619 -1.372 18792 15961 1 20 . 1 1 138 138 LEU C C 138 178.385 178.385 178.378 0.007 18792 15962 1 20 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.393 0.545 18792 15963 1 20 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.242 -0.534 18792 15964 1 20 . 1 1 138 138 LEU H H 138 8.742 8.742 8.351 0.391 18792 15965 1 20 . 1 1 139 139 ASN N N 139 117.122 117.122 117.013 0.109 18792 15966 1 20 . 1 1 139 139 ASN C C 139 176.417 176.417 177.101 -0.684 18792 15967 1 20 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.635 0.813 18792 15968 1 20 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.009 0.643 18792 15969 1 20 . 1 1 139 139 ASN H H 139 8.307 8.307 8.174 0.133 18792 15970 1 20 . 1 1 140 140 ASP N N 140 115.394 115.394 120.496 -5.102 18792 15971 1 20 . 1 1 140 140 ASP C C 140 177.919 177.919 177.301 0.618 18792 15972 1 20 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.972 -1.019 18792 15973 1 20 . 1 1 140 140 ASP CB C 140 39.386 39.386 41.096 -1.710 18792 15974 1 20 . 1 1 140 140 ASP H H 140 8.439 8.439 8.515 -0.076 18792 15975 1 20 . 1 1 141 141 HIS N N 141 111.695 111.695 113.479 -1.784 18792 15976 1 20 . 1 1 141 141 HIS C C 141 175.949 175.949 175.790 0.159 18792 15977 1 20 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.343 -0.286 18792 15978 1 20 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.133 -2.225 18792 15979 1 20 . 1 1 141 141 HIS H H 141 8.043 8.043 7.598 0.445 18792 15980 1 20 . 1 1 142 142 LEU N N 142 117.054 117.054 122.462 -5.408 18792 15981 1 20 . 1 1 142 142 LEU C C 142 176.530 176.530 177.748 -1.218 18792 15982 1 20 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.711 -2.402 18792 15983 1 20 . 1 1 142 142 LEU CB C 142 42.338 42.338 42.090 0.248 18792 15984 1 20 . 1 1 142 142 LEU H H 142 7.198 7.198 8.166 -0.968 18792 15985 1 20 . 1 1 143 143 GLU N N 143 121.335 121.335 120.120 1.215 18792 15986 1 20 . 1 1 143 143 GLU C C 143 173.964 173.964 175.683 -1.719 18792 15987 1 20 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.383 -0.129 18792 15988 1 20 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.561 -2.304 18792 15989 1 20 . 1 1 143 143 GLU H H 143 8.565 8.565 8.054 0.511 18792 15990 1 20 . 1 1 145 145 TRP N N 145 117.973 117.973 120.218 -2.245 18792 15991 1 20 . 1 1 145 145 TRP C C 145 179.526 179.526 177.741 1.785 18792 15992 1 20 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.255 1.351 18792 15993 1 20 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.572 -1.683 18792 15994 1 20 . 1 1 145 145 TRP H H 145 7.078 7.078 8.471 -1.393 18792 15995 1 20 . 1 1 146 146 ILE N N 146 122.101 122.101 111.469 10.632 18792 15996 1 20 . 1 1 146 146 ILE C C 146 179.110 179.110 176.931 2.179 18792 15997 1 20 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.610 3.724 18792 15998 1 20 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.332 -1.510 18792 15999 1 20 . 1 1 146 146 ILE H H 146 8.389 8.389 7.579 0.810 18792 16000 1 20 . 1 1 147 147 GLN N N 147 116.344 116.344 121.379 -5.035 18792 16001 1 20 . 1 1 147 147 GLN C C 147 179.526 179.526 177.345 2.181 18792 16002 1 20 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.564 -0.551 18792 16003 1 20 . 1 1 147 147 GLN CB C 147 26.723 26.723 27.878 -1.155 18792 16004 1 20 . 1 1 147 147 GLN H H 147 8.376 8.376 8.045 0.331 18792 16005 1 20 . 1 1 148 148 GLU N N 148 118.913 118.913 120.060 -1.147 18792 16006 1 20 . 1 1 148 148 GLU C C 148 176.880 176.880 177.460 -0.580 18792 16007 1 20 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.535 -3.162 18792 16008 1 20 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.542 -1.110 18792 16009 1 20 . 1 1 148 148 GLU H H 148 7.504 7.504 7.915 -0.411 18792 16010 1 20 . 1 1 149 149 ASN N N 149 116.616 116.616 114.970 1.646 18792 16011 1 20 . 1 1 149 149 ASN C C 149 173.964 173.964 177.021 -3.057 18792 16012 1 20 . 1 1 149 149 ASN CA C 149 53.246 53.246 54.107 -0.861 18792 16013 1 20 . 1 1 149 149 ASN CB C 149 37.133 37.133 38.194 -1.061 18792 16014 1 20 . 1 1 149 149 ASN H H 149 7.070 7.070 8.400 -1.330 18792 16015 1 20 . 1 1 150 150 GLY N N 150 104.750 104.750 107.786 -3.036 18792 16016 1 20 . 1 1 150 150 GLY C C 150 176.022 176.022 173.997 2.025 18792 16017 1 20 . 1 1 150 150 GLY CA C 150 45.242 45.242 44.867 0.376 18792 16018 1 20 . 1 1 150 150 GLY H H 150 7.313 7.313 7.822 -0.509 18792 16019 1 20 . 1 1 151 151 GLY N N 151 108.385 108.385 108.016 0.369 18792 16020 1 20 . 1 1 151 151 GLY C C 151 173.449 173.449 175.218 -1.769 18792 16021 1 20 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.504 -0.472 18792 16022 1 20 . 1 1 151 151 GLY H H 151 8.452 8.452 7.046 1.406 18792 16023 1 20 . 1 1 152 152 TRP N N 152 118.092 118.092 121.644 -3.552 18792 16024 1 20 . 1 1 152 152 TRP C C 152 178.571 178.571 178.572 -0.001 18792 16025 1 20 . 1 1 152 152 TRP CA C 152 60.077 60.077 59.391 0.686 18792 16026 1 20 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.892 -1.304 18792 16027 1 20 . 1 1 152 152 TRP H H 152 8.644 8.644 7.508 1.136 18792 16028 1 20 . 1 1 153 153 ASP N N 153 117.758 117.758 118.879 -1.121 18792 16029 1 20 . 1 1 153 153 ASP C C 153 179.796 179.796 178.718 1.078 18792 16030 1 20 . 1 1 153 153 ASP CA C 153 57.302 57.302 58.415 -1.113 18792 16031 1 20 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.820 -1.589 18792 16032 1 20 . 1 1 153 153 ASP H H 153 8.827 8.827 8.135 0.692 18792 16033 1 20 . 1 1 154 154 THR N N 154 116.817 116.817 117.002 -0.185 18792 16034 1 20 . 1 1 154 154 THR C C 154 175.352 175.352 176.673 -1.321 18792 16035 1 20 . 1 1 154 154 THR CA C 154 65.910 65.910 66.400 -0.490 18792 16036 1 20 . 1 1 154 154 THR CB C 154 67.712 67.712 68.855 -1.143 18792 16037 1 20 . 1 1 154 154 THR H H 154 7.494 7.494 7.492 0.002 18792 16038 1 20 . 1 1 155 155 PHE N N 155 122.196 122.196 122.179 0.017 18792 16039 1 20 . 1 1 155 155 PHE C C 155 176.831 176.831 177.658 -0.827 18792 16040 1 20 . 1 1 155 155 PHE CA C 155 61.286 61.286 61.594 -0.309 18792 16041 1 20 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.535 -1.869 18792 16042 1 20 . 1 1 155 155 PHE H H 155 6.477 6.477 8.709 -2.232 18792 16043 1 20 . 1 1 156 156 VAL N N 156 117.387 117.387 119.014 -1.627 18792 16044 1 20 . 1 1 156 156 VAL C C 156 178.497 178.497 178.210 0.287 18792 16045 1 20 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.906 -0.675 18792 16046 1 20 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.147 -0.462 18792 16047 1 20 . 1 1 156 156 VAL H H 156 7.788 7.788 9.054 -1.266 18792 16048 1 20 . 1 1 157 157 GLU N N 157 119.876 119.876 120.034 -0.158 18792 16049 1 20 . 1 1 157 157 GLU C C 157 178.399 178.399 177.620 0.779 18792 16050 1 20 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.624 -0.865 18792 16051 1 20 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.773 -1.496 18792 16052 1 20 . 1 1 157 157 GLU H H 157 7.409 7.409 7.953 -0.544 18792 16053 1 20 . 1 1 158 158 LEU N N 158 117.194 117.194 118.239 -1.045 18792 16054 1 20 . 1 1 158 158 LEU C C 158 178.595 178.595 179.218 -0.623 18792 16055 1 20 . 1 1 158 158 LEU CA C 158 56.377 56.377 56.515 -0.138 18792 16056 1 20 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.298 0.273 18792 16057 1 20 . 1 1 158 158 LEU H H 158 7.584 7.584 7.889 -0.305 18792 16058 1 20 . 1 1 159 159 TYR N N 159 115.549 115.549 121.344 -5.795 18792 16059 1 20 . 1 1 159 159 TYR C C 159 177.032 177.032 177.141 -0.109 18792 16060 1 20 . 1 1 159 159 TYR CA C 159 59.116 59.116 60.264 -1.148 18792 16061 1 20 . 1 1 159 159 TYR CB C 159 37.599 37.599 38.590 -0.991 18792 16062 1 20 . 1 1 159 159 TYR H H 159 8.099 8.099 8.714 -0.615 18792 16063 1 20 . 1 1 160 160 GLY N N 160 108.334 108.334 105.057 3.277 18792 16064 1 20 . 1 1 160 160 GLY C C 160 173.973 173.973 173.703 0.270 18792 16065 1 20 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.526 0.537 18792 16066 1 20 . 1 1 160 160 GLY H H 160 8.020 8.020 8.103 -0.083 18792 16067 1 20 . 1 1 161 161 ASN N N 161 118.189 118.189 117.665 0.524 18792 16068 1 20 . 1 1 161 161 ASN C C 161 175.513 175.513 173.669 1.844 18792 16069 1 20 . 1 1 161 161 ASN CA C 161 53.104 53.104 54.554 -1.450 18792 16070 1 20 . 1 1 161 161 ASN CB C 161 38.203 38.203 38.705 -0.502 18792 16071 1 20 . 1 1 161 161 ASN H H 161 8.327 8.327 7.909 0.418 18792 16072 1 20 . 1 1 162 162 ASN N N 162 119.022 119.022 118.476 0.546 18792 16073 1 20 . 1 1 162 162 ASN C C 162 175.690 175.690 174.566 1.124 18792 16074 1 20 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.054 0.370 18792 16075 1 20 . 1 1 162 162 ASN CB C 162 38.203 38.203 39.661 -1.458 18792 16076 1 20 . 1 1 162 162 ASN H H 162 8.363 8.363 8.550 -0.187 18792 16077 1 20 . 1 1 163 163 ALA N N 163 123.275 123.275 126.733 -3.458 18792 16078 1 20 . 1 1 163 163 ALA C C 163 178.598 178.598 177.772 0.826 18792 16079 1 20 . 1 1 163 163 ALA CA C 163 53.238 53.238 54.010 -0.772 18792 16080 1 20 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.259 -1.648 18792 16081 1 20 . 1 1 163 163 ALA H H 163 8.103 8.103 8.680 -0.577 18792 16082 1 20 . 1 1 164 164 ALA N N 164 121.521 121.521 120.467 1.054 18792 16083 1 20 . 1 1 164 164 ALA C C 164 178.642 178.642 179.336 -0.694 18792 16084 1 20 . 1 1 164 164 ALA CA C 164 52.584 52.584 52.360 0.224 18792 16085 1 20 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.873 -1.054 18792 16086 1 20 . 1 1 164 164 ALA H H 164 8.053 8.053 8.231 -0.178 18792 16087 1 20 . 1 1 165 165 ALA N N 165 122.101 122.101 122.423 -0.322 18792 16088 1 20 . 1 1 165 165 ALA C C 165 179.124 179.124 179.127 -0.003 18792 16089 1 20 . 1 1 165 165 ALA CA C 165 53.139 53.139 54.042 -0.903 18792 16090 1 20 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.582 -0.604 18792 16091 1 20 . 1 1 165 165 ALA H H 165 7.949 7.949 8.215 -0.266 18792 16092 1 20 . 1 1 166 166 GLU N N 166 118.381 118.381 117.476 0.905 18792 16093 1 20 . 1 1 166 166 GLU C C 166 177.664 177.664 177.546 0.118 18792 16094 1 20 . 1 1 166 166 GLU CA C 166 57.088 57.088 58.526 -1.438 18792 16095 1 20 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.253 -0.899 18792 16096 1 20 . 1 1 166 166 GLU H H 166 8.202 8.202 8.645 -0.443 18792 16097 1 20 . 1 1 167 167 SER N N 167 115.193 115.193 114.348 0.845 18792 16098 1 20 . 1 1 167 167 SER C C 167 175.312 175.312 175.236 0.076 18792 16099 1 20 . 1 1 167 167 SER CA C 167 58.831 58.831 59.718 -0.887 18792 16100 1 20 . 1 1 167 167 SER CB C 167 62.537 62.537 63.472 -0.935 18792 16101 1 20 . 1 1 167 167 SER H H 167 8.029 8.029 7.771 0.258 18792 16102 1 20 . 1 1 168 168 ARG N N 168 121.696 121.696 120.280 1.416 18792 16103 1 20 . 1 1 168 168 ARG C C 168 176.880 176.880 175.121 1.759 18792 16104 1 20 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.548 -0.385 18792 16105 1 20 . 1 1 168 168 ARG CB C 168 29.209 29.209 28.858 0.351 18792 16106 1 20 . 1 1 168 168 ARG H H 168 7.967 7.967 7.578 0.389 18792 16107 1 20 . 1 1 169 169 LYS N N 169 120.917 120.917 120.813 0.104 18792 16108 1 20 . 1 1 169 169 LYS C C 169 177.640 177.640 176.553 1.087 18792 16109 1 20 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.631 0.066 18792 16110 1 20 . 1 1 169 169 LYS CB C 169 31.462 31.462 30.293 1.169 18792 16111 1 20 . 1 1 169 169 LYS H H 169 8.011 8.011 8.226 -0.215 18792 16112 1 20 . 1 1 170 170 GLY N N 170 109.155 109.155 113.631 -4.476 18792 16113 1 20 . 1 1 170 170 GLY C C 170 174.479 174.479 173.446 1.033 18792 16114 1 20 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.707 -0.643 18792 16115 1 20 . 1 1 170 170 GLY H H 170 8.329 8.329 8.438 -0.109 18792 16116 1 20 . 1 1 171 171 GLN N N 171 119.292 119.292 118.535 0.757 18792 16117 1 20 . 1 1 171 171 GLN C C 171 176.463 176.463 173.770 2.693 18792 16118 1 20 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.340 0.327 18792 16119 1 20 . 1 1 171 171 GLN CB C 171 28.199 28.199 30.308 -2.108 18792 16120 1 20 . 1 1 171 171 GLN H H 171 8.035 8.035 8.241 -0.206 18792 16121 1 20 . 1 1 172 172 GLU N N 172 121.703 121.703 119.771 1.932 18792 16122 1 20 . 1 1 172 172 GLU C C 172 176.414 176.414 174.954 1.460 18792 16123 1 20 . 1 1 172 172 GLU CA C 172 56.341 56.341 55.319 1.022 18792 16124 1 20 . 1 1 172 172 GLU CB C 172 28.821 28.821 32.544 -3.723 18792 16125 1 20 . 1 1 172 172 GLU H H 172 8.405 8.405 8.883 -0.478 18792 16126 1 20 . 1 1 173 173 ARG N N 173 121.852 121.852 121.033 0.819 18792 16127 1 20 . 1 1 173 173 ARG C C 173 176.365 176.365 175.118 1.247 18792 16128 1 20 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.668 0.531 18792 16129 1 20 . 1 1 173 173 ARG CB C 173 29.131 29.131 30.898 -1.768 18792 16130 1 20 . 1 1 173 173 ARG H H 173 8.335 8.335 8.500 -0.165 18792 16131 1 20 . 1 1 174 174 LEU N N 174 122.640 122.640 120.753 1.887 18792 16132 1 20 . 1 1 174 174 LEU C C 174 176.523 176.523 176.259 0.264 18792 16133 1 20 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.228 0.540 18792 16134 1 20 . 1 1 174 174 LEU CB C 174 40.784 40.784 44.079 -3.295 18792 16135 1 20 . 1 1 174 174 LEU H H 174 8.082 8.082 8.999 -0.917 18792 16136 1 20 . 1 1 175 175 GLU N N 175 125.909 125.909 118.989 6.920 18792 16137 1 20 . 1 1 175 175 GLU C C 175 181.029 181.029 174.679 6.350 18792 16138 1 20 . 1 1 175 175 GLU CA C 175 57.398 57.398 55.828 1.570 18792 16139 1 20 . 1 1 175 175 GLU CB C 175 30.050 30.050 32.687 -2.637 18792 16140 1 20 . 1 1 175 175 GLU H H 175 7.785 7.785 8.902 -1.117 18792 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 164 2.665 0.190 2.666 18792 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18792 3 1 1 "Average Difference" C 164 1.140 -0.295 1.105 18792 4 1 1 "Average Difference" CA 164 1.350 0.369 1.303 18792 5 1 1 "Average Difference" CB 151 1.523 0.990 1.162 18792 6 1 1 "Average Difference" HN 164 0.575 0.054 0.574 18792 7 1 2 "Average Difference" N 164 2.529 0.248 2.524 18792 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18792 9 1 2 "Average Difference" C 164 1.205 -0.293 1.172 18792 10 1 2 "Average Difference" CA 164 1.339 0.409 1.279 18792 11 1 2 "Average Difference" CB 151 1.581 1.015 1.216 18792 12 1 2 "Average Difference" HN 164 0.562 0.080 0.558 18792 13 1 3 "Average Difference" N 164 2.507 0.094 2.513 18792 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18792 15 1 3 "Average Difference" C 164 1.259 -0.366 1.209 18792 16 1 3 "Average Difference" CA 164 1.204 0.359 1.153 18792 17 1 3 "Average Difference" CB 151 1.513 1.022 1.119 18792 18 1 3 "Average Difference" HN 164 0.588 0.013 0.590 18792 19 1 4 "Average Difference" N 164 2.537 0.251 2.532 18792 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18792 21 1 4 "Average Difference" C 164 1.235 -0.329 1.194 18792 22 1 4 "Average Difference" CA 164 1.309 0.380 1.257 18792 23 1 4 "Average Difference" CB 151 1.490 1.075 1.036 18792 24 1 4 "Average Difference" HN 164 0.587 0.037 0.587 18792 25 1 5 "Average Difference" N 164 2.548 0.426 2.520 18792 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18792 27 1 5 "Average Difference" C 164 1.152 -0.273 1.123 18792 28 1 5 "Average Difference" CA 164 1.208 0.394 1.146 18792 29 1 5 "Average Difference" CB 151 1.409 0.979 1.017 18792 30 1 5 "Average Difference" HN 164 0.576 0.052 0.575 18792 31 1 6 "Average Difference" N 164 2.452 0.086 2.458 18792 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18792 33 1 6 "Average Difference" C 164 1.200 -0.344 1.153 18792 34 1 6 "Average Difference" CA 164 1.216 0.313 1.178 18792 35 1 6 "Average Difference" CB 151 1.442 1.015 1.028 18792 36 1 6 "Average Difference" HN 164 0.555 0.052 0.554 18792 37 1 7 "Average Difference" N 164 2.399 0.157 2.401 18792 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18792 39 1 7 "Average Difference" C 164 1.258 -0.331 1.218 18792 40 1 7 "Average Difference" CA 164 1.267 0.340 1.224 18792 41 1 7 "Average Difference" CB 151 1.502 0.982 1.141 18792 42 1 7 "Average Difference" HN 164 0.556 0.022 0.557 18792 43 1 8 "Average Difference" N 164 2.360 0.251 2.354 18792 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18792 45 1 8 "Average Difference" C 164 1.283 -0.382 1.229 18792 46 1 8 "Average Difference" CA 164 1.231 0.326 1.191 18792 47 1 8 "Average Difference" CB 151 1.464 1.009 1.065 18792 48 1 8 "Average Difference" HN 164 0.589 0.037 0.590 18792 49 1 9 "Average Difference" N 164 2.492 0.274 2.484 18792 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18792 51 1 9 "Average Difference" C 164 1.148 -0.223 1.130 18792 52 1 9 "Average Difference" CA 164 1.363 0.440 1.294 18792 53 1 9 "Average Difference" CB 151 1.437 1.003 1.032 18792 54 1 9 "Average Difference" HN 164 0.563 0.048 0.563 18792 55 1 10 "Average Difference" N 164 2.494 0.260 2.488 18792 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18792 57 1 10 "Average Difference" C 164 1.275 -0.337 1.234 18792 58 1 10 "Average Difference" CA 164 1.260 0.337 1.218 18792 59 1 10 "Average Difference" CB 151 1.469 1.014 1.067 18792 60 1 10 "Average Difference" HN 164 0.583 0.060 0.582 18792 61 1 11 "Average Difference" N 164 2.262 0.317 2.247 18792 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 18792 63 1 11 "Average Difference" C 164 1.273 -0.291 1.243 18792 64 1 11 "Average Difference" CA 164 1.229 0.285 1.199 18792 65 1 11 "Average Difference" CB 151 1.412 1.070 0.925 18792 66 1 11 "Average Difference" HN 164 0.580 0.059 0.579 18792 67 1 12 "Average Difference" N 164 2.396 0.281 2.387 18792 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 18792 69 1 12 "Average Difference" C 164 1.277 -0.338 1.235 18792 70 1 12 "Average Difference" CA 164 1.221 0.349 1.174 18792 71 1 12 "Average Difference" CB 151 1.524 1.131 1.025 18792 72 1 12 "Average Difference" HN 164 0.584 0.070 0.582 18792 73 1 13 "Average Difference" N 164 2.466 0.303 2.455 18792 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 18792 75 1 13 "Average Difference" C 164 1.303 -0.314 1.269 18792 76 1 13 "Average Difference" CA 164 1.429 0.399 1.376 18792 77 1 13 "Average Difference" CB 151 1.524 1.115 1.043 18792 78 1 13 "Average Difference" HN 164 0.551 0.034 0.552 18792 79 1 14 "Average Difference" N 164 2.331 0.395 2.304 18792 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 18792 81 1 14 "Average Difference" C 164 1.286 -0.344 1.243 18792 82 1 14 "Average Difference" CA 164 1.286 0.306 1.253 18792 83 1 14 "Average Difference" CB 151 1.586 1.048 1.195 18792 84 1 14 "Average Difference" HN 164 0.562 0.097 0.555 18792 85 1 15 "Average Difference" N 164 2.478 0.301 2.467 18792 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 18792 87 1 15 "Average Difference" C 164 1.206 -0.355 1.156 18792 88 1 15 "Average Difference" CA 164 1.345 0.346 1.304 18792 89 1 15 "Average Difference" CB 151 1.532 1.086 1.084 18792 90 1 15 "Average Difference" HN 164 0.545 0.052 0.544 18792 91 1 16 "Average Difference" N 164 2.587 0.123 2.592 18792 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 18792 93 1 16 "Average Difference" C 164 1.255 -0.329 1.215 18792 94 1 16 "Average Difference" CA 164 1.425 0.258 1.406 18792 95 1 16 "Average Difference" CB 151 1.449 1.009 1.044 18792 96 1 16 "Average Difference" HN 164 0.577 0.038 0.578 18792 97 1 17 "Average Difference" N 164 2.623 0.237 2.621 18792 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 18792 99 1 17 "Average Difference" C 164 1.288 -0.355 1.242 18792 100 1 17 "Average Difference" CA 164 1.328 0.401 1.270 18792 101 1 17 "Average Difference" CB 151 1.525 1.011 1.146 18792 102 1 17 "Average Difference" HN 164 0.604 0.024 0.605 18792 103 1 18 "Average Difference" N 164 2.419 0.280 2.410 18792 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 18792 105 1 18 "Average Difference" C 164 1.175 -0.363 1.121 18792 106 1 18 "Average Difference" CA 164 1.266 0.332 1.225 18792 107 1 18 "Average Difference" CB 151 1.551 1.091 1.106 18792 108 1 18 "Average Difference" HN 164 0.579 0.081 0.576 18792 109 1 19 "Average Difference" N 164 2.428 0.408 2.400 18792 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 18792 111 1 19 "Average Difference" C 164 1.222 -0.360 1.172 18792 112 1 19 "Average Difference" CA 164 1.287 0.299 1.256 18792 113 1 19 "Average Difference" CB 151 1.551 1.111 1.085 18792 114 1 19 "Average Difference" HN 164 0.606 0.074 0.603 18792 115 1 20 "Average Difference" N 164 2.515 0.265 2.509 18792 116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 18792 117 1 20 "Average Difference" C 164 1.300 -0.270 1.275 18792 118 1 20 "Average Difference" CA 164 1.317 0.433 1.248 18792 119 1 20 "Average Difference" CB 151 1.520 1.011 1.140 18792 120 1 20 "Average Difference" HN 164 0.582 0.084 0.578 18792 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 18792 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 4 4 ALA N N 4 124.786 124.786 123.866 0.920 18792 2 1 . 1 1 4 4 ALA C C 4 178.272 178.272 178.802 -0.530 18792 3 1 . 1 1 4 4 ALA CA C 4 52.566 52.566 54.173 -1.607 18792 4 1 . 1 1 4 4 ALA CB C 4 18.234 18.234 18.962 -0.728 18792 5 1 . 1 1 4 4 ALA H H 4 8.414 8.414 8.445 -0.031 18792 6 1 . 1 1 5 5 MET N N 5 119.681 119.681 117.422 2.259 18792 7 1 . 1 1 5 5 MET C C 5 176.929 176.929 177.227 -0.299 18792 8 1 . 1 1 5 5 MET CA C 5 55.594 55.594 56.210 -0.616 18792 9 1 . 1 1 5 5 MET CB C 5 31.540 31.540 32.095 -0.555 18792 10 1 . 1 1 5 5 MET H H 5 8.336 8.336 8.223 0.113 18792 11 1 . 1 1 6 6 SER N N 6 116.162 116.162 116.641 -0.479 18792 12 1 . 1 1 6 6 SER C C 6 175.924 175.924 176.341 -0.417 18792 13 1 . 1 1 6 6 SER CA C 6 59.009 59.009 61.306 -2.297 18792 14 1 . 1 1 6 6 SER CB C 6 62.537 62.537 62.744 -0.207 18792 15 1 . 1 1 6 6 SER H H 6 8.272 8.272 8.227 0.045 18792 16 1 . 1 1 7 7 GLN N N 7 122.263 122.263 120.962 1.301 18792 17 1 . 1 1 7 7 GLN C C 7 177.027 177.027 178.092 -1.065 18792 18 1 . 1 1 7 7 GLN CA C 7 56.270 56.270 58.770 -2.500 18792 19 1 . 1 1 7 7 GLN CB C 7 27.739 27.739 28.223 -0.484 18792 20 1 . 1 1 7 7 GLN H H 7 8.314 8.314 8.223 0.091 18792 21 1 . 1 1 8 8 SER N N 8 116.625 116.625 115.656 0.969 18792 22 1 . 1 1 8 8 SER C C 8 176.457 176.457 176.366 0.091 18792 23 1 . 1 1 8 8 SER CA C 8 59.650 59.650 61.712 -2.062 18792 24 1 . 1 1 8 8 SER CB C 8 62.226 62.226 62.842 -0.616 18792 25 1 . 1 1 8 8 SER H H 8 8.333 8.333 8.058 0.275 18792 26 1 . 1 1 9 9 ASN N N 9 121.307 121.307 120.060 1.247 18792 27 1 . 1 1 9 9 ASN C C 9 177.419 177.419 177.396 0.023 18792 28 1 . 1 1 9 9 ASN CA C 9 55.487 55.487 56.174 -0.687 18792 29 1 . 1 1 9 9 ASN CB C 9 37.133 37.133 38.540 -1.407 18792 30 1 . 1 1 9 9 ASN H H 9 8.611 8.611 8.024 0.586 18792 31 1 . 1 1 10 10 ARG N N 10 119.830 119.830 120.809 -0.979 18792 32 1 . 1 1 10 10 ARG C C 10 177.615 177.615 178.445 -0.830 18792 33 1 . 1 1 10 10 ARG CA C 10 59.258 59.258 59.621 -0.363 18792 34 1 . 1 1 10 10 ARG CB C 10 28.199 28.199 30.233 -2.034 18792 35 1 . 1 1 10 10 ARG H H 10 7.996 7.996 8.343 -0.347 18792 36 1 . 1 1 11 11 GLU N N 11 117.270 117.270 119.720 -2.450 18792 37 1 . 1 1 11 11 GLU C C 11 179.649 179.649 178.693 0.956 18792 38 1 . 1 1 11 11 GLU CA C 11 59.009 59.009 59.201 -0.192 18792 39 1 . 1 1 11 11 GLU CB C 11 28.121 28.121 29.442 -1.321 18792 40 1 . 1 1 11 11 GLU H H 11 7.885 7.885 8.279 -0.394 18792 41 1 . 1 1 12 12 LEU N N 12 119.900 119.900 121.188 -1.288 18792 42 1 . 1 1 12 12 LEU C C 12 178.473 178.473 178.663 -0.190 18792 43 1 . 1 1 12 12 LEU CA C 12 57.693 57.693 58.289 -0.596 18792 44 1 . 1 1 12 12 LEU CB C 12 40.629 40.629 41.790 -1.161 18792 45 1 . 1 1 12 12 LEU H H 12 7.691 7.691 8.016 -0.325 18792 46 1 . 1 1 13 13 VAL N N 13 117.320 117.320 118.552 -1.232 18792 47 1 . 1 1 13 13 VAL C C 13 177.272 177.272 178.062 -0.790 18792 48 1 . 1 1 13 13 VAL CA C 13 67.156 67.156 66.498 0.658 18792 49 1 . 1 1 13 13 VAL CB C 13 31.229 31.229 31.500 -0.271 18792 50 1 . 1 1 13 13 VAL H H 13 7.629 7.629 7.738 -0.109 18792 51 1 . 1 1 14 14 VAL N N 14 116.659 116.659 120.279 -3.620 18792 52 1 . 1 1 14 14 VAL C C 14 178.718 178.718 177.764 0.954 18792 53 1 . 1 1 14 14 VAL CA C 14 66.516 66.516 66.393 0.123 18792 54 1 . 1 1 14 14 VAL CB C 14 30.374 30.374 31.363 -0.989 18792 55 1 . 1 1 14 14 VAL H H 14 8.210 8.210 7.840 0.370 18792 56 1 . 1 1 15 15 ASP N N 15 120.374 120.374 121.361 -0.987 18792 57 1 . 1 1 15 15 ASP C C 15 177.557 177.557 178.258 -0.701 18792 58 1 . 1 1 15 15 ASP CA C 15 58.476 58.476 57.475 1.001 18792 59 1 . 1 1 15 15 ASP CB C 15 42.553 42.553 40.741 1.813 18792 60 1 . 1 1 15 15 ASP H H 15 7.967 7.967 8.647 -0.680 18792 61 1 . 1 1 16 16 PHE N N 16 119.864 119.864 120.785 -0.921 18792 62 1 . 1 1 16 16 PHE C C 16 178.252 178.252 177.503 0.749 18792 63 1 . 1 1 16 16 PHE CA C 16 62.780 62.780 61.140 1.640 18792 64 1 . 1 1 16 16 PHE CB C 16 39.060 39.060 38.992 0.068 18792 65 1 . 1 1 16 16 PHE H H 16 8.228 8.228 7.950 0.278 18792 66 1 . 1 1 17 17 LEU N N 17 116.312 116.312 119.232 -2.920 18792 67 1 . 1 1 17 17 LEU C C 17 179.649 179.649 178.804 0.845 18792 68 1 . 1 1 17 17 LEU CA C 17 57.764 57.764 58.249 -0.485 18792 69 1 . 1 1 17 17 LEU CB C 17 40.085 40.085 41.580 -1.495 18792 70 1 . 1 1 17 17 LEU H H 17 8.766 8.766 8.244 0.522 18792 71 1 . 1 1 18 18 SER N N 18 113.715 113.715 115.217 -1.502 18792 72 1 . 1 1 18 18 SER C C 18 177.362 177.362 176.486 0.876 18792 73 1 . 1 1 18 18 SER CA C 18 61.948 61.948 61.551 0.397 18792 74 1 . 1 1 18 18 SER CB C 18 63.003 63.003 63.298 -0.295 18792 75 1 . 1 1 18 18 SER H H 18 8.384 8.384 8.170 0.214 18792 76 1 . 1 1 19 19 TYR N N 19 124.570 124.570 122.868 1.702 18792 77 1 . 1 1 19 19 TYR C C 19 178.415 178.415 177.679 0.736 18792 78 1 . 1 1 19 19 TYR CA C 19 59.764 59.764 61.223 -1.459 18792 79 1 . 1 1 19 19 TYR CB C 19 37.016 37.016 38.518 -1.502 18792 80 1 . 1 1 19 19 TYR H H 19 8.155 8.155 8.784 -0.629 18792 81 1 . 1 1 20 20 LYS N N 20 119.739 119.739 120.122 -0.383 18792 82 1 . 1 1 20 20 LYS C C 20 180.456 180.456 178.918 1.538 18792 83 1 . 1 1 20 20 LYS CA C 20 56.488 56.488 59.067 -2.579 18792 84 1 . 1 1 20 20 LYS CB C 20 28.159 28.159 32.198 -4.039 18792 85 1 . 1 1 20 20 LYS H H 20 8.224 8.224 8.002 0.222 18792 86 1 . 1 1 21 21 LEU N N 21 118.092 118.092 120.402 -2.310 18792 87 1 . 1 1 21 21 LEU C C 21 179.989 179.989 178.581 1.408 18792 88 1 . 1 1 21 21 LEU CA C 21 58.126 58.126 58.180 -0.054 18792 89 1 . 1 1 21 21 LEU CB C 21 39.608 39.608 41.838 -2.230 18792 90 1 . 1 1 21 21 LEU H H 21 8.586 8.586 7.920 0.666 18792 91 1 . 1 1 22 22 SER N N 22 117.304 117.304 113.447 3.857 18792 92 1 . 1 1 22 22 SER C C 22 180.152 180.152 176.970 3.182 18792 93 1 . 1 1 22 22 SER CA C 22 61.287 61.287 61.034 0.253 18792 94 1 . 1 1 22 22 SER H H 22 8.266 8.266 7.676 0.590 18792 95 1 . 1 1 23 23 GLN N N 23 122.497 122.497 121.357 1.140 18792 96 1 . 1 1 23 23 GLN C C 23 177.297 177.297 177.493 -0.196 18792 97 1 . 1 1 23 23 GLN CA C 23 57.942 57.942 58.147 -0.205 18792 98 1 . 1 1 23 23 GLN CB C 23 27.811 27.811 28.530 -0.719 18792 99 1 . 1 1 23 23 GLN H H 23 7.571 7.571 8.070 -0.499 18792 100 1 . 1 1 24 24 LYS N N 24 116.038 116.038 117.199 -1.161 18792 101 1 . 1 1 24 24 LYS C C 24 175.704 175.704 176.563 -0.859 18792 102 1 . 1 1 24 24 LYS CA C 24 53.495 53.495 56.404 -2.909 18792 103 1 . 1 1 24 24 LYS CB C 24 31.229 31.229 33.298 -2.069 18792 104 1 . 1 1 24 24 LYS H H 24 7.134 7.134 7.633 -0.499 18792 105 1 . 1 1 25 25 GLY N N 25 105.283 105.283 106.062 -0.779 18792 106 1 . 1 1 25 25 GLY C C 25 174.013 174.013 173.447 0.566 18792 107 1 . 1 1 25 25 GLY CA C 25 44.779 44.779 44.806 -0.027 18792 108 1 . 1 1 25 25 GLY H H 25 7.483 7.483 7.816 -0.333 18792 109 1 . 1 1 26 26 TYR N N 26 119.547 119.547 120.088 -0.541 18792 110 1 . 1 1 26 26 TYR C C 26 175.122 175.122 174.200 0.922 18792 111 1 . 1 1 26 26 TYR CA C 26 55.132 55.132 56.875 -1.743 18792 112 1 . 1 1 26 26 TYR CB C 26 40.080 40.080 39.652 0.428 18792 113 1 . 1 1 26 26 TYR H H 26 7.788 7.788 7.615 0.173 18792 114 1 . 1 1 27 27 SER N N 27 115.088 115.088 118.379 -3.291 18792 115 1 . 1 1 27 27 SER C C 27 174.452 174.452 175.389 -0.937 18792 116 1 . 1 1 27 27 SER CA C 27 56.306 56.306 56.759 -0.453 18792 117 1 . 1 1 27 27 SER CB C 27 63.921 63.921 64.617 -0.696 18792 118 1 . 1 1 27 27 SER H H 27 8.473 8.473 8.445 0.028 18792 119 1 . 1 1 28 28 TRP N N 28 127.014 127.014 125.536 1.478 18792 120 1 . 1 1 28 28 TRP C C 28 177.002 177.002 177.557 -0.555 18792 121 1 . 1 1 28 28 TRP CA C 28 59.472 59.472 59.629 -0.157 18792 122 1 . 1 1 28 28 TRP CB C 28 29.830 29.830 29.003 0.827 18792 123 1 . 1 1 28 28 TRP H H 28 8.897 8.897 8.780 0.117 18792 124 1 . 1 1 29 29 SER N N 29 112.044 112.044 113.094 -1.050 18792 125 1 . 1 1 29 29 SER C C 29 175.106 175.106 175.502 -0.396 18792 126 1 . 1 1 29 29 SER CA C 29 59.472 59.472 59.711 -0.239 18792 127 1 . 1 1 29 29 SER CB C 29 62.226 62.226 63.010 -0.784 18792 128 1 . 1 1 29 29 SER H H 29 8.129 8.129 7.993 0.136 18792 129 1 . 1 1 30 30 GLN N N 30 119.160 119.160 119.813 -0.653 18792 130 1 . 1 1 30 30 GLN C C 30 176.218 176.218 176.431 -0.213 18792 131 1 . 1 1 30 30 GLN CA C 30 56.412 56.412 56.544 -0.132 18792 132 1 . 1 1 30 30 GLN CB C 30 27.578 27.578 29.498 -1.920 18792 133 1 . 1 1 30 30 GLN H H 30 7.370 7.370 7.809 -0.439 18792 134 1 . 1 1 31 31 PHE N N 31 116.277 116.277 117.898 -1.621 18792 135 1 . 1 1 31 31 PHE C C 31 175.217 175.217 175.034 0.183 18792 136 1 . 1 1 31 31 PHE CA C 31 56.234 56.234 58.868 -2.634 18792 137 1 . 1 1 31 31 PHE CB C 31 39.066 39.066 38.290 0.776 18792 138 1 . 1 1 31 31 PHE H H 31 7.248 7.248 7.948 -0.700 18792 139 1 . 1 1 32 32 SER N N 32 113.683 113.683 115.054 -1.371 18792 140 1 . 1 1 32 32 SER C C 32 173.793 173.793 173.945 -0.152 18792 141 1 . 1 1 32 32 SER CA C 32 57.124 57.124 58.182 -1.058 18792 142 1 . 1 1 32 32 SER CB C 32 63.081 63.081 64.026 -0.945 18792 143 1 . 1 1 32 32 SER H H 32 7.242 7.242 7.759 -0.517 18792 144 1 . 1 1 33 33 ASP N N 33 122.195 122.195 121.729 0.466 18792 145 1 . 1 1 33 33 ASP C C 33 176.394 176.394 176.021 0.373 18792 146 1 . 1 1 33 33 ASP CA C 33 53.748 53.748 55.358 -1.610 18792 147 1 . 1 1 33 33 ASP CB C 33 40.398 40.398 40.635 -0.237 18792 148 1 . 1 1 33 33 ASP H H 33 8.257 8.257 8.649 -0.392 18792 149 1 . 1 1 34 34 VAL N N 34 118.913 118.913 116.680 2.233 18792 150 1 . 1 1 34 34 VAL C C 34 176.328 176.328 175.541 0.787 18792 151 1 . 1 1 34 34 VAL CA C 34 61.891 61.891 62.883 -0.992 18792 152 1 . 1 1 34 34 VAL CB C 34 32.015 32.015 31.809 0.206 18792 153 1 . 1 1 34 34 VAL H H 34 7.852 7.852 7.780 0.072 18792 154 1 . 1 1 35 35 GLU N N 35 124.205 124.205 119.569 4.636 18792 155 1 . 1 1 35 35 GLU C C 35 176.586 176.586 175.522 1.064 18792 156 1 . 1 1 35 35 GLU CA C 35 56.057 56.057 57.163 -1.106 18792 157 1 . 1 1 35 35 GLU CB C 35 28.898 28.898 30.301 -1.403 18792 158 1 . 1 1 35 35 GLU H H 35 8.401 8.401 8.001 0.400 18792 159 1 . 1 1 36 36 GLU N N 36 121.670 121.670 119.680 1.990 18792 160 1 . 1 1 36 36 GLU C C 36 176.218 176.218 175.208 1.010 18792 161 1 . 1 1 36 36 GLU CA C 36 55.988 55.988 56.490 -0.502 18792 162 1 . 1 1 36 36 GLU CB C 36 29.442 29.442 30.332 -0.890 18792 163 1 . 1 1 36 36 GLU H H 36 8.239 8.239 8.538 -0.299 18792 164 1 . 1 1 37 37 ASN N N 37 119.252 119.252 119.053 0.199 18792 165 1 . 1 1 37 37 ASN C C 37 175.003 175.003 174.366 0.637 18792 166 1 . 1 1 37 37 ASN CA C 37 52.655 52.655 53.490 -0.835 18792 167 1 . 1 1 37 37 ASN CB C 37 38.212 38.212 39.226 -1.014 18792 168 1 . 1 1 37 37 ASN H H 37 8.412 8.412 8.322 0.090 18792 169 1 . 1 1 38 38 ARG N N 38 121.622 121.622 120.568 1.054 18792 170 1 . 1 1 38 38 ARG C C 38 176.610 176.610 175.145 1.465 18792 171 1 . 1 1 38 38 ARG CA C 38 55.364 55.364 56.177 -0.814 18792 172 1 . 1 1 38 38 ARG CB C 38 29.419 29.419 31.375 -1.956 18792 173 1 . 1 1 38 38 ARG H H 38 8.227 8.227 8.346 -0.119 18792 174 1 . 1 1 39 39 THR N N 39 115.681 115.681 114.198 1.483 18792 175 1 . 1 1 39 39 THR C C 39 174.500 174.500 174.306 0.194 18792 176 1 . 1 1 39 39 THR CA C 39 61.606 61.606 62.340 -0.734 18792 177 1 . 1 1 39 39 THR CB C 39 69.163 69.163 69.308 -0.145 18792 178 1 . 1 1 39 39 THR H H 39 8.173 8.173 8.260 -0.087 18792 179 1 . 1 1 40 40 GLU N N 40 122.708 122.708 121.175 1.533 18792 180 1 . 1 1 40 40 GLU C C 40 175.728 175.728 175.455 0.273 18792 181 1 . 1 1 40 40 GLU CA C 40 55.772 55.772 56.628 -0.856 18792 182 1 . 1 1 40 40 GLU CB C 40 29.054 29.054 29.588 -0.534 18792 183 1 . 1 1 40 40 GLU H H 40 8.298 8.298 8.432 -0.134 18792 184 1 . 1 1 41 41 ALA N N 41 125.922 125.922 123.306 2.616 18792 185 1 . 1 1 41 41 ALA C C 41 175.557 175.557 175.961 -0.404 18792 186 1 . 1 1 41 41 ALA CA C 41 49.973 49.973 51.537 -1.563 18792 187 1 . 1 1 41 41 ALA CB C 41 17.245 17.245 18.503 -1.258 18792 188 1 . 1 1 41 41 ALA H H 41 8.212 8.212 8.038 0.174 18792 189 1 . 1 1 43 43 GLU N N 43 120.783 120.783 119.982 0.801 18792 190 1 . 1 1 43 43 GLU C C 43 177.174 177.174 176.330 0.844 18792 191 1 . 1 1 43 43 GLU CA C 43 56.341 56.341 56.809 -0.468 18792 192 1 . 1 1 43 43 GLU CB C 43 29.287 29.287 29.609 -0.322 18792 193 1 . 1 1 43 43 GLU H H 43 8.519 8.519 8.615 -0.095 18792 194 1 . 1 1 44 44 GLY N N 44 110.022 110.022 108.428 1.594 18792 195 1 . 1 1 44 44 GLY C C 44 174.773 174.773 174.372 0.401 18792 196 1 . 1 1 44 44 GLY CA C 44 45.028 45.028 45.338 -0.310 18792 197 1 . 1 1 44 44 GLY H H 44 8.429 8.429 8.289 0.140 18792 198 1 . 1 1 45 45 THR N N 45 112.790 112.790 113.175 -0.385 18792 199 1 . 1 1 45 45 THR C C 45 175.726 175.726 175.032 0.694 18792 200 1 . 1 1 45 45 THR CA C 45 61.987 61.987 62.301 -0.314 18792 201 1 . 1 1 45 45 THR CB C 45 69.304 69.304 69.334 -0.030 18792 202 1 . 1 1 45 45 THR H H 45 8.125 8.125 8.004 0.121 18792 203 1 . 1 1 46 46 GLU N N 46 122.752 122.752 121.441 1.311 18792 204 1 . 1 1 46 46 GLU C C 46 177.419 177.419 176.302 1.117 18792 205 1 . 1 1 46 46 GLU CA C 46 57.231 57.231 56.971 0.260 18792 206 1 . 1 1 46 46 GLU CB C 46 28.199 28.199 29.881 -1.682 18792 207 1 . 1 1 46 46 GLU H H 46 8.765 8.765 8.480 0.285 18792 208 1 . 1 1 47 47 SER N N 47 114.895 114.895 112.570 2.325 18792 209 1 . 1 1 47 47 SER C C 47 175.826 175.826 175.151 0.675 18792 210 1 . 1 1 47 47 SER CA C 47 58.582 58.582 58.546 0.036 18792 211 1 . 1 1 47 47 SER CB C 47 62.537 62.537 63.398 -0.861 18792 212 1 . 1 1 47 47 SER H H 47 8.355 8.355 8.001 0.354 18792 213 1 . 1 1 48 48 GLU N N 48 122.429 122.429 121.618 0.811 18792 214 1 . 1 1 48 48 GLU C C 48 178.099 178.099 177.591 0.508 18792 215 1 . 1 1 48 48 GLU CA C 48 58.618 58.618 59.026 -0.408 18792 216 1 . 1 1 48 48 GLU CB C 48 28.475 28.475 29.338 -0.863 18792 217 1 . 1 1 48 48 GLU H H 48 8.139 8.139 8.545 -0.406 18792 218 1 . 1 1 49 49 ALA N N 49 120.374 120.374 122.375 -2.001 18792 219 1 . 1 1 49 49 ALA C C 49 180.843 180.843 179.224 1.619 18792 220 1 . 1 1 49 49 ALA CA C 49 54.483 54.483 54.984 -0.501 18792 221 1 . 1 1 49 49 ALA CB C 49 17.435 17.435 18.178 -0.743 18792 222 1 . 1 1 49 49 ALA H H 49 8.079 8.079 8.205 -0.126 18792 223 1 . 1 1 50 50 VAL N N 50 118.599 118.599 118.298 0.301 18792 224 1 . 1 1 50 50 VAL C C 50 176.921 176.921 177.618 -0.697 18792 225 1 . 1 1 50 50 VAL CA C 50 65.560 65.560 65.823 -0.263 18792 226 1 . 1 1 50 50 VAL CB C 50 30.297 30.297 31.056 -0.759 18792 227 1 . 1 1 50 50 VAL H H 50 7.419 7.419 7.767 -0.348 18792 228 1 . 1 1 51 51 LYS N N 51 117.469 117.469 120.502 -3.033 18792 229 1 . 1 1 51 51 LYS C C 51 179.061 179.061 178.791 0.270 18792 230 1 . 1 1 51 51 LYS CA C 51 59.223 59.223 59.849 -0.626 18792 231 1 . 1 1 51 51 LYS CB C 51 30.996 30.996 31.996 -1.000 18792 232 1 . 1 1 51 51 LYS H H 51 7.359 7.359 7.794 -0.435 18792 233 1 . 1 1 52 52 GLN N N 52 115.930 115.930 118.163 -2.233 18792 234 1 . 1 1 52 52 GLN C C 52 177.713 177.713 178.104 -0.391 18792 235 1 . 1 1 52 52 GLN CA C 52 58.476 58.476 58.660 -0.184 18792 236 1 . 1 1 52 52 GLN CB C 52 26.568 26.568 28.373 -1.805 18792 237 1 . 1 1 52 52 GLN H H 52 8.025 8.025 7.972 0.053 18792 238 1 . 1 1 53 53 ALA N N 53 119.782 119.782 122.369 -2.587 18792 239 1 . 1 1 53 53 ALA C C 53 180.008 180.008 179.192 0.816 18792 240 1 . 1 1 53 53 ALA CA C 53 54.385 54.385 54.629 -0.244 18792 241 1 . 1 1 53 53 ALA CB C 53 17.515 17.515 18.470 -0.955 18792 242 1 . 1 1 53 53 ALA H H 53 7.655 7.655 7.843 -0.188 18792 243 1 . 1 1 54 54 LEU N N 54 120.443 120.443 119.428 1.015 18792 244 1 . 1 1 54 54 LEU C C 54 179.330 179.330 178.187 1.143 18792 245 1 . 1 1 54 54 LEU CA C 54 58.013 58.013 56.962 1.051 18792 246 1 . 1 1 54 54 LEU CB C 54 40.862 40.862 41.681 -0.819 18792 247 1 . 1 1 54 54 LEU H H 54 8.419 8.419 8.041 0.378 18792 248 1 . 1 1 55 55 ARG N N 55 118.423 118.423 119.753 -1.330 18792 249 1 . 1 1 55 55 ARG C C 55 178.767 178.767 178.376 0.391 18792 250 1 . 1 1 55 55 ARG CA C 55 60.397 60.397 59.501 0.896 18792 251 1 . 1 1 55 55 ARG CB C 55 28.743 28.743 29.823 -1.080 18792 252 1 . 1 1 55 55 ARG H H 55 8.062 8.062 7.990 0.072 18792 253 1 . 1 1 56 56 GLU N N 56 115.988 115.988 118.911 -2.923 18792 254 1 . 1 1 56 56 GLU C C 56 180.090 180.090 178.473 1.617 18792 255 1 . 1 1 56 56 GLU CA C 56 58.760 58.760 59.315 -0.555 18792 256 1 . 1 1 56 56 GLU CB C 56 28.354 28.354 29.518 -1.164 18792 257 1 . 1 1 56 56 GLU H H 56 7.772 7.772 8.204 -0.432 18792 258 1 . 1 1 57 57 ALA N N 57 122.837 122.837 121.432 1.405 18792 259 1 . 1 1 57 57 ALA C C 57 181.861 181.861 179.745 2.115 18792 260 1 . 1 1 57 57 ALA CA C 57 54.634 54.634 54.777 -0.143 18792 261 1 . 1 1 57 57 ALA CB C 57 18.473 18.473 18.492 -0.019 18792 262 1 . 1 1 57 57 ALA H H 57 8.774 8.774 7.799 0.975 18792 263 1 . 1 1 58 58 GLY N N 58 108.409 108.409 106.514 1.895 18792 264 1 . 1 1 58 58 GLY C C 58 175.331 175.331 175.886 -0.555 18792 265 1 . 1 1 58 58 GLY CA C 58 46.668 46.668 46.846 -0.178 18792 266 1 . 1 1 58 58 GLY H H 58 9.073 9.073 8.344 0.729 18792 267 1 . 1 1 59 59 ASP N N 59 122.074 122.074 122.298 -0.224 18792 268 1 . 1 1 59 59 ASP C C 59 179.023 179.023 178.256 0.767 18792 269 1 . 1 1 59 59 ASP CA C 59 57.302 57.302 57.535 -0.233 18792 270 1 . 1 1 59 59 ASP CB C 59 38.842 38.842 40.978 -2.136 18792 271 1 . 1 1 59 59 ASP H H 59 8.049 8.049 8.249 -0.200 18792 272 1 . 1 1 60 60 GLU N N 60 120.131 120.131 120.107 0.024 18792 273 1 . 1 1 60 60 GLU C C 60 178.522 178.522 178.939 -0.417 18792 274 1 . 1 1 60 60 GLU CA C 60 59.009 59.009 59.325 -0.316 18792 275 1 . 1 1 60 60 GLU CB C 60 28.199 28.199 29.790 -1.591 18792 276 1 . 1 1 60 60 GLU H H 60 8.136 8.136 8.112 0.024 18792 277 1 . 1 1 61 61 PHE N N 61 121.309 121.309 119.588 1.721 18792 278 1 . 1 1 61 61 PHE C C 61 176.904 176.904 177.830 -0.926 18792 279 1 . 1 1 61 61 PHE CA C 61 61.322 61.322 61.449 -0.127 18792 280 1 . 1 1 61 61 PHE CB C 61 38.609 38.609 39.373 -0.764 18792 281 1 . 1 1 61 61 PHE H H 61 8.523 8.523 8.188 0.335 18792 282 1 . 1 1 62 62 GLU N N 62 115.971 115.971 119.789 -3.818 18792 283 1 . 1 1 62 62 GLU C C 62 177.713 177.713 178.239 -0.526 18792 284 1 . 1 1 62 62 GLU CA C 62 58.191 58.191 59.139 -0.948 18792 285 1 . 1 1 62 62 GLU CB C 62 28.277 28.277 29.653 -1.376 18792 286 1 . 1 1 62 62 GLU H H 62 7.969 7.969 8.390 -0.421 18792 287 1 . 1 1 63 63 LEU N N 63 116.703 116.703 119.487 -2.784 18792 288 1 . 1 1 63 63 LEU C C 63 178.963 178.963 178.696 0.267 18792 289 1 . 1 1 63 63 LEU CA C 63 56.412 56.412 56.970 -0.558 18792 290 1 . 1 1 63 63 LEU CB C 63 41.406 41.406 42.317 -0.911 18792 291 1 . 1 1 63 63 LEU H H 63 7.347 7.347 8.004 -0.657 18792 292 1 . 1 1 64 64 ARG N N 64 117.453 117.453 117.441 0.012 18792 293 1 . 1 1 64 64 ARG C C 64 177.297 177.297 176.837 0.460 18792 294 1 . 1 1 64 64 ARG CA C 64 57.337 57.337 57.312 0.026 18792 295 1 . 1 1 64 64 ARG CB C 64 29.597 29.597 30.957 -1.360 18792 296 1 . 1 1 64 64 ARG H H 64 7.995 7.995 7.930 0.065 18792 297 1 . 1 1 65 65 TYR N N 65 118.956 118.956 118.205 0.751 18792 298 1 . 1 1 65 65 TYR C C 65 175.278 175.278 175.237 0.041 18792 299 1 . 1 1 65 65 TYR CA C 65 55.701 55.701 57.929 -2.228 18792 300 1 . 1 1 65 65 TYR CB C 65 35.986 35.986 38.326 -2.340 18792 301 1 . 1 1 65 65 TYR H H 65 7.909 7.909 7.801 0.108 18792 302 1 . 1 1 66 66 ARG N N 66 119.438 119.438 119.677 -0.239 18792 303 1 . 1 1 66 66 ARG C C 66 178.424 178.424 177.378 1.046 18792 304 1 . 1 1 66 66 ARG CA C 66 58.476 58.476 57.685 0.791 18792 305 1 . 1 1 66 66 ARG CB C 66 28.821 28.821 30.272 -1.451 18792 306 1 . 1 1 66 66 ARG H H 66 7.244 7.244 8.036 -0.792 18792 307 1 . 1 1 67 67 ARG N N 67 118.936 118.936 121.203 -2.267 18792 308 1 . 1 1 67 67 ARG C C 67 177.542 177.542 177.852 -0.310 18792 309 1 . 1 1 67 67 ARG CA C 67 57.444 57.444 59.244 -1.800 18792 310 1 . 1 1 67 67 ARG CB C 67 28.121 28.121 29.826 -1.705 18792 311 1 . 1 1 67 67 ARG H H 67 8.417 8.417 8.497 -0.080 18792 312 1 . 1 1 68 68 ALA N N 68 121.797 121.797 121.537 0.260 18792 313 1 . 1 1 68 68 ALA C C 68 180.337 180.337 179.343 0.994 18792 314 1 . 1 1 68 68 ALA CA C 68 54.136 54.136 54.566 -0.430 18792 315 1 . 1 1 68 68 ALA CB C 68 17.467 17.467 18.153 -0.686 18792 316 1 . 1 1 68 68 ALA H H 68 7.827 7.827 8.199 -0.372 18792 317 1 . 1 1 69 69 PHE N N 69 115.986 115.986 117.809 -1.823 18792 318 1 . 1 1 69 69 PHE C C 69 177.468 177.468 177.270 0.198 18792 319 1 . 1 1 69 69 PHE CA C 69 58.049 58.049 59.574 -1.525 18792 320 1 . 1 1 69 69 PHE CB C 69 37.599 37.599 38.611 -1.012 18792 321 1 . 1 1 69 69 PHE H H 69 8.517 8.517 8.022 0.495 18792 322 1 . 1 1 70 70 SER N N 70 116.526 116.526 116.027 0.499 18792 323 1 . 1 1 70 70 SER C C 70 177.640 177.640 176.443 1.197 18792 324 1 . 1 1 70 70 SER CA C 70 61.073 61.073 61.639 -0.566 18792 325 1 . 1 1 70 70 SER CB C 70 61.993 61.993 62.858 -0.865 18792 326 1 . 1 1 70 70 SER H H 70 8.152 8.152 7.959 0.193 18792 327 1 . 1 1 71 71 ASP N N 71 121.181 121.181 121.961 -0.780 18792 328 1 . 1 1 71 71 ASP C C 71 178.546 178.546 178.424 0.122 18792 329 1 . 1 1 71 71 ASP CA C 71 56.448 56.448 57.195 -0.747 18792 330 1 . 1 1 71 71 ASP CB C 71 39.231 39.231 40.733 -1.502 18792 331 1 . 1 1 71 71 ASP H H 71 8.356 8.356 7.745 0.611 18792 332 1 . 1 1 72 72 LEU N N 72 120.747 120.747 120.423 0.325 18792 333 1 . 1 1 72 72 LEU C C 72 178.963 178.963 178.537 0.426 18792 334 1 . 1 1 72 72 LEU CA C 72 57.444 57.444 58.213 -0.769 18792 335 1 . 1 1 72 72 LEU CB C 72 41.017 41.017 41.984 -0.967 18792 336 1 . 1 1 72 72 LEU H H 72 7.738 7.738 7.879 -0.140 18792 337 1 . 1 1 73 73 THR N N 73 109.432 109.432 112.775 -3.343 18792 338 1 . 1 1 73 73 THR C C 73 177.481 177.481 176.337 1.144 18792 339 1 . 1 1 73 73 THR CA C 73 65.128 65.128 65.712 -0.584 18792 340 1 . 1 1 73 73 THR CB C 73 67.720 67.720 68.422 -0.702 18792 341 1 . 1 1 73 73 THR H H 73 8.296 8.296 8.027 0.269 18792 342 1 . 1 1 74 74 SER N N 74 115.862 115.862 115.523 0.339 18792 343 1 . 1 1 74 74 SER C C 74 175.361 175.361 175.866 -0.505 18792 344 1 . 1 1 74 74 SER CA C 74 60.112 60.112 60.493 -0.381 18792 345 1 . 1 1 74 74 SER CB C 74 62.537 62.537 63.123 -0.586 18792 346 1 . 1 1 74 74 SER H H 74 7.629 7.629 8.045 -0.416 18792 347 1 . 1 1 75 75 GLN N N 75 118.551 118.551 119.396 -0.845 18792 348 1 . 1 1 75 75 GLN C C 75 176.316 176.316 176.754 -0.438 18792 349 1 . 1 1 75 75 GLN CA C 75 56.804 56.804 56.971 -0.167 18792 350 1 . 1 1 75 75 GLN CB C 75 28.277 28.277 29.598 -1.321 18792 351 1 . 1 1 75 75 GLN H H 75 7.640 7.640 7.620 0.020 18792 352 1 . 1 1 76 76 LEU N N 76 118.313 118.313 117.845 0.467 18792 353 1 . 1 1 76 76 LEU C C 76 174.160 174.160 176.365 -2.205 18792 354 1 . 1 1 76 76 LEU CA C 76 54.740 54.740 55.500 -0.760 18792 355 1 . 1 1 76 76 LEU CB C 76 42.727 42.727 41.709 1.018 18792 356 1 . 1 1 76 76 LEU H H 76 7.411 7.411 7.615 -0.204 18792 357 1 . 1 1 77 77 HIS N N 77 120.104 120.104 117.608 2.496 18792 358 1 . 1 1 77 77 HIS C C 77 174.528 174.528 174.555 -0.027 18792 359 1 . 1 1 77 77 HIS CA C 77 54.207 54.207 57.014 -2.807 18792 360 1 . 1 1 77 77 HIS CB C 77 27.966 27.966 28.391 -0.425 18792 361 1 . 1 1 77 77 HIS H H 77 8.117 8.117 8.104 0.013 18792 362 1 . 1 1 78 78 ILE N N 78 122.298 122.298 120.759 1.539 18792 363 1 . 1 1 78 78 ILE C C 78 174.240 174.240 175.054 -0.814 18792 364 1 . 1 1 78 78 ILE CA C 78 61.402 61.402 61.899 -0.497 18792 365 1 . 1 1 78 78 ILE CB C 78 37.591 37.591 39.012 -1.421 18792 366 1 . 1 1 78 78 ILE H H 78 8.655 8.655 8.144 0.511 18792 367 1 . 1 1 79 79 THR N N 79 116.442 116.442 117.526 -1.084 18792 368 1 . 1 1 79 79 THR C C 79 174.291 174.291 173.276 1.015 18792 369 1 . 1 1 79 79 THR CA C 79 61.632 61.632 61.484 0.148 18792 370 1 . 1 1 79 79 THR CB C 79 68.704 68.704 68.494 0.210 18792 371 1 . 1 1 79 79 THR H H 79 8.245 8.245 8.182 0.063 18792 372 1 . 1 1 84 84 TYR N N 84 120.888 120.888 120.314 0.574 18792 373 1 . 1 1 84 84 TYR C C 84 176.708 176.708 177.373 -0.665 18792 374 1 . 1 1 84 84 TYR CA C 84 60.432 60.432 61.265 -0.833 18792 375 1 . 1 1 84 84 TYR CB C 84 36.745 36.745 37.874 -1.129 18792 376 1 . 1 1 84 84 TYR H H 84 8.733 8.733 8.515 0.218 18792 377 1 . 1 1 85 85 GLN N N 85 114.530 114.530 118.808 -4.278 18792 378 1 . 1 1 85 85 GLN C C 85 178.473 178.473 178.366 0.107 18792 379 1 . 1 1 85 85 GLN CA C 85 59.294 59.294 59.337 -0.042 18792 380 1 . 1 1 85 85 GLN CB C 85 26.801 26.801 28.077 -1.276 18792 381 1 . 1 1 85 85 GLN H H 85 8.413 8.413 8.182 0.231 18792 382 1 . 1 1 86 86 SER N N 86 114.032 114.032 115.795 -1.763 18792 383 1 . 1 1 86 86 SER C C 86 178.473 178.473 176.601 1.872 18792 384 1 . 1 1 86 86 SER CA C 86 62.175 62.175 61.485 0.690 18792 385 1 . 1 1 86 86 SER CB C 86 63.252 63.252 62.863 0.389 18792 386 1 . 1 1 86 86 SER H H 86 7.258 7.258 7.786 -0.528 18792 387 1 . 1 1 88 88 GLU N N 88 119.386 119.386 119.460 -0.074 18792 388 1 . 1 1 88 88 GLU C C 88 177.199 177.199 178.821 -1.622 18792 389 1 . 1 1 88 88 GLU CA C 88 58.582 58.582 59.796 -1.214 18792 390 1 . 1 1 88 88 GLU CB C 88 28.976 28.976 29.192 -0.216 18792 391 1 . 1 1 88 88 GLU H H 88 8.534 8.534 8.302 0.232 18792 392 1 . 1 1 89 89 GLN N N 89 114.678 114.678 119.236 -4.557 18792 393 1 . 1 1 89 89 GLN C C 89 178.669 178.669 178.543 0.126 18792 394 1 . 1 1 89 89 GLN CA C 89 58.582 58.582 59.009 -0.427 18792 395 1 . 1 1 89 89 GLN CB C 89 27.422 27.422 28.711 -1.289 18792 396 1 . 1 1 89 89 GLN H H 89 7.500 7.500 7.706 -0.206 18792 397 1 . 1 1 90 90 VAL N N 90 118.174 118.174 119.230 -1.056 18792 398 1 . 1 1 90 90 VAL C C 90 178.081 178.081 177.839 0.242 18792 399 1 . 1 1 90 90 VAL CA C 90 65.555 65.555 65.866 -0.311 18792 400 1 . 1 1 90 90 VAL CB C 90 30.607 30.607 31.053 -0.446 18792 401 1 . 1 1 90 90 VAL H H 90 7.017 7.017 7.797 -0.780 18792 402 1 . 1 1 91 91 VAL N N 91 119.489 119.489 120.387 -0.898 18792 403 1 . 1 1 91 91 VAL C C 91 177.914 177.914 177.973 -0.059 18792 404 1 . 1 1 91 91 VAL CA C 91 65.769 65.769 66.511 -0.742 18792 405 1 . 1 1 91 91 VAL CB C 91 30.291 30.291 30.890 -0.599 18792 406 1 . 1 1 91 91 VAL H H 91 7.833 7.833 8.225 -0.392 18792 407 1 . 1 1 92 92 ASN N N 92 117.180 117.180 117.905 -0.725 18792 408 1 . 1 1 92 92 ASN C C 92 179.110 179.110 177.135 1.975 18792 409 1 . 1 1 92 92 ASN CA C 92 54.918 54.918 56.179 -1.261 18792 410 1 . 1 1 92 92 ASN CB C 92 35.968 35.968 38.540 -2.571 18792 411 1 . 1 1 92 92 ASN H H 92 8.368 8.368 8.379 -0.011 18792 412 1 . 1 1 93 93 GLU N N 93 118.476 118.476 119.197 -0.721 18792 413 1 . 1 1 93 93 GLU C C 93 179.355 179.355 179.219 0.136 18792 414 1 . 1 1 93 93 GLU CA C 93 58.405 58.405 58.923 -0.518 18792 415 1 . 1 1 93 93 GLU CB C 93 27.733 27.733 29.997 -2.264 18792 416 1 . 1 1 93 93 GLU H H 93 7.213 7.213 7.888 -0.675 18792 417 1 . 1 1 94 94 LEU N N 94 120.889 120.889 120.627 0.262 18792 418 1 . 1 1 94 94 LEU C C 94 178.473 178.473 178.432 0.041 18792 419 1 . 1 1 94 94 LEU CA C 94 57.017 57.017 57.099 -0.081 18792 420 1 . 1 1 94 94 LEU CB C 94 39.930 39.930 41.877 -1.947 18792 421 1 . 1 1 94 94 LEU H H 94 7.446 7.446 8.008 -0.562 18792 422 1 . 1 1 95 95 PHE N N 95 112.902 112.902 117.888 -4.986 18792 423 1 . 1 1 95 95 PHE C C 95 176.586 176.586 176.701 -0.115 18792 424 1 . 1 1 95 95 PHE CA C 95 57.159 57.159 58.679 -1.520 18792 425 1 . 1 1 95 95 PHE CB C 95 38.221 38.221 38.936 -0.715 18792 426 1 . 1 1 95 95 PHE H H 95 6.916 6.916 8.082 -1.166 18792 427 1 . 1 1 96 96 ARG N N 96 123.729 123.729 119.107 4.622 18792 428 1 . 1 1 96 96 ARG C C 96 177.272 177.272 176.959 0.313 18792 429 1 . 1 1 96 96 ARG CA C 96 59.223 59.223 58.258 0.965 18792 430 1 . 1 1 96 96 ARG CB C 96 28.432 28.432 30.419 -1.987 18792 431 1 . 1 1 96 96 ARG H H 96 7.126 7.126 7.607 -0.481 18792 432 1 . 1 1 97 97 ASP N N 97 116.576 116.576 115.935 0.641 18792 433 1 . 1 1 97 97 ASP C C 97 175.687 175.687 175.181 0.506 18792 434 1 . 1 1 97 97 ASP CA C 97 53.673 53.673 54.584 -0.911 18792 435 1 . 1 1 97 97 ASP CB C 97 40.045 40.045 42.526 -2.482 18792 436 1 . 1 1 97 97 ASP H H 97 8.644 8.644 7.845 0.799 18792 437 1 . 1 1 98 98 GLY N N 98 108.551 108.551 106.863 1.688 18792 438 1 . 1 1 98 98 GLY C C 98 172.690 172.690 172.445 0.245 18792 439 1 . 1 1 98 98 GLY CA C 98 43.250 43.250 45.176 -1.926 18792 440 1 . 1 1 98 98 GLY H H 98 7.463 7.463 7.536 -0.073 18792 441 1 . 1 1 99 99 VAL N N 99 120.630 120.630 120.185 0.445 18792 442 1 . 1 1 99 99 VAL C C 99 174.503 174.503 174.372 0.131 18792 443 1 . 1 1 99 99 VAL CA C 99 62.318 62.318 62.362 -0.044 18792 444 1 . 1 1 99 99 VAL CB C 99 30.763 30.763 32.956 -2.193 18792 445 1 . 1 1 99 99 VAL H H 99 8.184 8.184 8.074 0.110 18792 446 1 . 1 1 100 100 ASN N N 100 115.485 115.485 117.419 -1.934 18792 447 1 . 1 1 100 100 ASN C C 100 175.239 175.239 176.474 -1.235 18792 448 1 . 1 1 100 100 ASN CA C 100 51.361 51.361 54.565 -3.204 18792 449 1 . 1 1 100 100 ASN CB C 100 38.920 38.920 38.122 0.798 18792 450 1 . 1 1 100 100 ASN H H 100 6.241 6.241 7.881 -1.640 18792 451 1 . 1 1 101 101 TRP N N 101 118.266 118.266 120.350 -2.084 18792 452 1 . 1 1 101 101 TRP C C 101 178.301 178.301 176.353 1.948 18792 453 1 . 1 1 101 101 TRP CA C 101 60.539 60.539 59.143 1.396 18792 454 1 . 1 1 101 101 TRP CB C 101 29.830 29.830 28.701 1.129 18792 455 1 . 1 1 101 101 TRP H H 101 8.409 8.409 8.181 0.228 18792 456 1 . 1 1 102 102 GLY N N 102 106.147 106.147 106.310 -0.163 18792 457 1 . 1 1 102 102 GLY C C 102 177.640 177.640 175.293 2.347 18792 458 1 . 1 1 102 102 GLY CA C 102 46.914 46.914 44.760 2.154 18792 459 1 . 1 1 102 102 GLY H H 102 8.504 8.504 7.568 0.936 18792 460 1 . 1 1 103 103 ARG N N 103 121.347 121.347 121.732 -0.385 18792 461 1 . 1 1 103 103 ARG C C 103 177.738 177.738 178.036 -0.298 18792 462 1 . 1 1 103 103 ARG CA C 103 57.942 57.942 58.570 -0.628 18792 463 1 . 1 1 103 103 ARG CB C 103 30.219 30.219 30.024 0.195 18792 464 1 . 1 1 103 103 ARG H H 103 8.099 8.099 8.119 -0.020 18792 465 1 . 1 1 104 104 ILE N N 104 120.930 120.930 119.778 1.152 18792 466 1 . 1 1 104 104 ILE C C 104 178.197 178.197 177.735 0.462 18792 467 1 . 1 1 104 104 ILE CA C 104 66.535 66.535 64.515 2.020 18792 468 1 . 1 1 104 104 ILE CB C 104 36.045 36.045 37.871 -1.826 18792 469 1 . 1 1 104 104 ILE H H 104 7.690 7.690 7.906 -0.216 18792 470 1 . 1 1 105 105 VAL N N 105 120.938 120.938 119.431 1.507 18792 471 1 . 1 1 105 105 VAL C C 105 177.854 177.854 177.684 0.170 18792 472 1 . 1 1 105 105 VAL CA C 105 67.458 67.458 66.266 1.193 18792 473 1 . 1 1 105 105 VAL CB C 105 30.374 30.374 30.688 -0.314 18792 474 1 . 1 1 105 105 VAL H H 105 8.245 8.245 7.552 0.693 18792 475 1 . 1 1 106 106 ALA N N 106 121.165 121.165 121.745 -0.580 18792 476 1 . 1 1 106 106 ALA C C 106 178.284 178.284 179.205 -0.921 18792 477 1 . 1 1 106 106 ALA CA C 106 54.598 54.598 54.260 0.338 18792 478 1 . 1 1 106 106 ALA CB C 106 17.515 17.515 18.465 -0.950 18792 479 1 . 1 1 106 106 ALA H H 106 7.529 7.529 7.709 -0.181 18792 480 1 . 1 1 107 107 PHE N N 107 119.242 119.242 120.531 -1.289 18792 481 1 . 1 1 107 107 PHE C C 107 176.390 176.390 177.008 -0.618 18792 482 1 . 1 1 107 107 PHE CA C 107 60.173 60.173 60.537 -0.364 18792 483 1 . 1 1 107 107 PHE CB C 107 37.087 37.087 38.926 -1.839 18792 484 1 . 1 1 107 107 PHE H H 107 7.974 7.974 7.860 0.114 18792 485 1 . 1 1 108 108 PHE N N 108 120.009 120.009 118.578 1.431 18792 486 1 . 1 1 108 108 PHE C C 108 177.640 177.640 177.094 0.546 18792 487 1 . 1 1 108 108 PHE CA C 108 62.424 62.424 61.114 1.310 18792 488 1 . 1 1 108 108 PHE CB C 108 35.346 35.346 38.471 -3.125 18792 489 1 . 1 1 108 108 PHE H H 108 7.946 7.946 8.295 -0.349 18792 490 1 . 1 1 109 109 SER N N 109 114.631 114.631 115.944 -1.313 18792 491 1 . 1 1 109 109 SER C C 109 177.770 177.770 176.334 1.436 18792 492 1 . 1 1 109 109 SER CA C 109 63.349 63.349 61.622 1.727 18792 493 1 . 1 1 109 109 SER H H 109 8.424 8.424 7.517 0.907 18792 494 1 . 1 1 110 110 PHE N N 110 124.230 124.230 123.428 0.802 18792 495 1 . 1 1 110 110 PHE C C 110 176.708 176.708 177.507 -0.799 18792 496 1 . 1 1 110 110 PHE CA C 110 59.614 59.614 59.620 -0.006 18792 497 1 . 1 1 110 110 PHE CB C 110 37.444 37.444 38.782 -1.338 18792 498 1 . 1 1 110 110 PHE H H 110 9.052 9.052 8.253 0.799 18792 499 1 . 1 1 111 111 GLY N N 111 105.893 105.893 106.354 -0.461 18792 500 1 . 1 1 111 111 GLY C C 111 176.795 176.795 175.920 0.875 18792 501 1 . 1 1 111 111 GLY CA C 111 47.376 47.376 46.533 0.843 18792 502 1 . 1 1 111 111 GLY H H 111 7.926 7.926 8.591 -0.664 18792 503 1 . 1 1 112 112 GLY N N 112 107.410 107.410 109.215 -1.805 18792 504 1 . 1 1 112 112 GLY C C 112 174.650 174.650 175.443 -0.793 18792 505 1 . 1 1 112 112 GLY CA C 112 47.305 47.305 46.114 1.191 18792 506 1 . 1 1 112 112 GLY H H 112 8.799 8.799 7.961 0.838 18792 507 1 . 1 1 113 113 ALA N N 113 124.313 124.313 124.959 -0.646 18792 508 1 . 1 1 113 113 ALA C C 113 181.300 181.300 179.134 2.166 18792 509 1 . 1 1 113 113 ALA CA C 113 54.527 54.527 54.769 -0.242 18792 510 1 . 1 1 113 113 ALA CB C 113 17.483 17.483 18.458 -0.975 18792 511 1 . 1 1 113 113 ALA H H 113 8.212 8.212 7.816 0.396 18792 512 1 . 1 1 114 114 LEU N N 114 118.878 118.878 118.863 0.015 18792 513 1 . 1 1 114 114 LEU C C 114 180.286 180.286 178.631 1.655 18792 514 1 . 1 1 114 114 LEU CA C 114 56.982 56.982 57.478 -0.496 18792 515 1 . 1 1 114 114 LEU CB C 114 41.017 41.017 41.509 -0.492 18792 516 1 . 1 1 114 114 LEU H H 114 8.161 8.161 7.858 0.303 18792 517 1 . 1 1 115 115 CYS N N 115 119.002 119.002 118.097 0.905 18792 518 1 . 1 1 115 115 CYS C C 115 176.087 176.087 176.736 -0.649 18792 519 1 . 1 1 115 115 CYS CA C 115 63.944 63.944 63.156 0.788 18792 520 1 . 1 1 115 115 CYS CB C 115 25.635 25.635 26.917 -1.282 18792 521 1 . 1 1 115 115 CYS H H 115 8.070 8.070 7.965 0.105 18792 522 1 . 1 1 116 116 VAL N N 116 118.737 118.737 119.992 -1.255 18792 523 1 . 1 1 116 116 VAL C C 116 177.494 177.494 178.043 -0.549 18792 524 1 . 1 1 116 116 VAL CA C 116 66.762 66.762 66.338 0.424 18792 525 1 . 1 1 116 116 VAL CB C 116 30.763 30.763 31.244 -0.481 18792 526 1 . 1 1 116 116 VAL H H 116 7.995 7.995 7.668 0.327 18792 527 1 . 1 1 117 117 GLU N N 117 118.886 118.886 119.761 -0.875 18792 528 1 . 1 1 117 117 GLU C C 117 178.424 178.424 178.959 -0.535 18792 529 1 . 1 1 117 117 GLU CA C 117 58.760 58.760 59.366 -0.606 18792 530 1 . 1 1 117 117 GLU CB C 117 28.054 28.054 29.391 -1.337 18792 531 1 . 1 1 117 117 GLU H H 117 8.059 8.059 7.951 0.108 18792 532 1 . 1 1 118 118 SER N N 118 113.417 113.417 115.820 -2.403 18792 533 1 . 1 1 118 118 SER C C 118 175.607 175.607 176.605 -0.998 18792 534 1 . 1 1 118 118 SER CA C 118 62.638 62.638 61.714 0.924 18792 535 1 . 1 1 118 118 SER CB C 118 61.061 61.061 63.052 -1.991 18792 536 1 . 1 1 118 118 SER H H 118 7.626 7.626 7.808 -0.182 18792 537 1 . 1 1 119 119 VAL N N 119 120.612 120.612 121.282 -0.670 18792 538 1 . 1 1 119 119 VAL C C 119 179.713 179.713 177.936 1.777 18792 539 1 . 1 1 119 119 VAL CA C 119 66.225 66.225 65.754 0.471 18792 540 1 . 1 1 119 119 VAL CB C 119 30.079 30.079 31.219 -1.140 18792 541 1 . 1 1 119 119 VAL H H 119 7.297 7.297 7.812 -0.514 18792 542 1 . 1 1 120 120 ASP N N 120 122.546 122.546 119.953 2.593 18792 543 1 . 1 1 120 120 ASP C C 120 178.057 178.057 177.434 0.623 18792 544 1 . 1 1 120 120 ASP CA C 120 56.989 56.989 56.538 0.451 18792 545 1 . 1 1 120 120 ASP CB C 120 39.923 39.923 40.837 -0.914 18792 546 1 . 1 1 120 120 ASP H H 120 8.264 8.264 7.917 0.347 18792 547 1 . 1 1 121 121 LYS N N 121 115.636 115.636 117.829 -2.193 18792 548 1 . 1 1 121 121 LYS C C 121 175.159 175.159 175.791 -0.632 18792 549 1 . 1 1 121 121 LYS CA C 121 55.260 55.260 56.344 -1.084 18792 550 1 . 1 1 121 121 LYS CB C 121 30.775 30.775 32.905 -2.130 18792 551 1 . 1 1 121 121 LYS H H 121 7.558 7.558 7.391 0.167 18792 552 1 . 1 1 122 122 GLU N N 122 113.915 113.915 115.775 -1.860 18792 553 1 . 1 1 122 122 GLU C C 122 176.109 176.109 175.975 0.134 18792 554 1 . 1 1 122 122 GLU CA C 122 57.307 57.307 57.731 -0.424 18792 555 1 . 1 1 122 122 GLU CB C 122 25.332 25.332 27.860 -2.528 18792 556 1 . 1 1 122 122 GLU H H 122 7.826 7.826 7.862 -0.036 18792 557 1 . 1 1 124 124 GLN N N 124 119.233 119.233 120.489 -1.256 18792 558 1 . 1 1 124 124 GLN C C 124 177.640 177.640 176.967 0.673 18792 559 1 . 1 1 124 124 GLN CA C 124 59.472 59.472 58.207 1.265 18792 560 1 . 1 1 124 124 GLN CB C 124 26.490 26.490 28.117 -1.627 18792 561 1 . 1 1 124 124 GLN H H 124 8.626 8.626 8.388 0.238 18792 562 1 . 1 1 125 125 VAL N N 125 117.011 117.011 116.441 0.570 18792 563 1 . 1 1 125 125 VAL C C 125 175.826 175.826 176.444 -0.618 18792 564 1 . 1 1 125 125 VAL CA C 125 63.136 63.136 63.983 -0.847 18792 565 1 . 1 1 125 125 VAL CB C 125 30.297 30.297 30.902 -0.605 18792 566 1 . 1 1 125 125 VAL H H 125 7.870 7.870 7.982 -0.112 18792 567 1 . 1 1 126 126 LEU N N 126 117.058 117.058 117.366 -0.308 18792 568 1 . 1 1 126 126 LEU C C 126 178.096 178.096 178.102 -0.006 18792 569 1 . 1 1 126 126 LEU CA C 126 55.085 55.085 57.083 -1.998 18792 570 1 . 1 1 126 126 LEU CB C 126 40.273 40.273 42.142 -1.869 18792 571 1 . 1 1 126 126 LEU H H 126 7.747 7.747 7.908 -0.161 18792 572 1 . 1 1 127 127 VAL N N 127 119.457 119.457 120.222 -0.765 18792 573 1 . 1 1 127 127 VAL C C 127 177.150 177.150 177.902 -0.752 18792 574 1 . 1 1 127 127 VAL CA C 127 67.156 67.156 66.341 0.815 18792 575 1 . 1 1 127 127 VAL CB C 127 29.753 29.753 30.841 -1.087 18792 576 1 . 1 1 127 127 VAL H H 127 7.306 7.306 7.881 -0.575 18792 577 1 . 1 1 128 128 SER N N 128 110.647 110.647 114.678 -4.031 18792 578 1 . 1 1 128 128 SER C C 128 177.222 177.222 176.704 0.518 18792 579 1 . 1 1 128 128 SER CA C 128 60.752 60.752 61.500 -0.748 18792 580 1 . 1 1 128 128 SER CB C 128 61.605 61.605 62.859 -1.254 18792 581 1 . 1 1 128 128 SER H H 128 8.237 8.237 8.128 0.109 18792 582 1 . 1 1 129 129 ARG N N 129 123.100 123.100 122.280 0.820 18792 583 1 . 1 1 129 129 ARG C C 129 175.802 175.802 178.703 -2.900 18792 584 1 . 1 1 129 129 ARG CA C 129 58.227 58.227 58.868 -0.641 18792 585 1 . 1 1 129 129 ARG CB C 129 28.199 28.199 30.139 -1.940 18792 586 1 . 1 1 129 129 ARG H H 129 6.564 6.564 7.839 -1.275 18792 587 1 . 1 1 130 130 ILE N N 130 118.182 118.182 118.042 0.140 18792 588 1 . 1 1 130 130 ILE C C 130 178.156 178.156 177.777 0.379 18792 589 1 . 1 1 130 130 ILE CA C 130 64.346 64.346 65.165 -0.819 18792 590 1 . 1 1 130 130 ILE CB C 130 36.682 36.682 37.476 -0.794 18792 591 1 . 1 1 130 130 ILE H H 130 7.955 7.955 8.388 -0.433 18792 592 1 . 1 1 131 131 ALA N N 131 119.029 119.029 122.196 -3.167 18792 593 1 . 1 1 131 131 ALA C C 131 179.593 179.593 179.269 0.324 18792 594 1 . 1 1 131 131 ALA CA C 131 54.598 54.598 55.050 -0.452 18792 595 1 . 1 1 131 131 ALA CB C 131 17.388 17.388 18.183 -0.795 18792 596 1 . 1 1 131 131 ALA H H 131 7.582 7.582 8.480 -0.898 18792 597 1 . 1 1 132 132 ALA N N 132 120.336 120.336 122.015 -1.679 18792 598 1 . 1 1 132 132 ALA C C 132 181.095 181.095 179.366 1.729 18792 599 1 . 1 1 132 132 ALA CA C 132 54.598 54.598 54.836 -0.238 18792 600 1 . 1 1 132 132 ALA CB C 132 16.701 16.701 18.580 -1.879 18792 601 1 . 1 1 132 132 ALA H H 132 7.224 7.224 7.879 -0.655 18792 602 1 . 1 1 133 133 TRP N N 133 121.194 121.194 120.403 0.791 18792 603 1 . 1 1 133 133 TRP C C 133 179.698 179.698 178.301 1.397 18792 604 1 . 1 1 133 133 TRP CA C 133 57.302 57.302 60.265 -2.963 18792 605 1 . 1 1 133 133 TRP CB C 133 27.655 27.655 29.890 -2.235 18792 606 1 . 1 1 133 133 TRP H H 133 8.925 8.925 8.619 0.306 18792 607 1 . 1 1 134 134 MET N N 134 116.987 116.987 117.947 -0.960 18792 608 1 . 1 1 134 134 MET C C 134 178.277 178.277 178.170 0.107 18792 609 1 . 1 1 134 134 MET CA C 134 59.578 59.578 58.774 0.804 18792 610 1 . 1 1 134 134 MET CB C 134 33.559 33.559 32.385 1.174 18792 611 1 . 1 1 134 134 MET H H 134 8.863 8.863 8.493 0.370 18792 612 1 . 1 1 135 135 ALA N N 135 120.523 120.523 121.281 -0.758 18792 613 1 . 1 1 135 135 ALA C C 135 179.298 179.298 179.478 -0.180 18792 614 1 . 1 1 135 135 ALA CA C 135 55.433 55.433 55.134 0.298 18792 615 1 . 1 1 135 135 ALA CB C 135 16.637 16.637 18.267 -1.629 18792 616 1 . 1 1 135 135 ALA H H 135 8.152 8.152 8.297 -0.145 18792 617 1 . 1 1 136 136 THR N N 136 116.715 116.715 117.083 -0.368 18792 618 1 . 1 1 136 136 THR C C 136 175.106 175.106 176.333 -1.227 18792 619 1 . 1 1 136 136 THR CA C 136 66.729 66.729 67.069 -0.340 18792 620 1 . 1 1 136 136 THR CB C 136 68.441 68.441 68.958 -0.517 18792 621 1 . 1 1 136 136 THR H H 136 8.532 8.532 8.072 0.460 18792 622 1 . 1 1 137 137 TYR N N 137 123.204 123.204 121.954 1.250 18792 623 1 . 1 1 137 137 TYR C C 137 179.592 179.592 177.661 1.931 18792 624 1 . 1 1 137 137 TYR CA C 137 63.065 63.065 61.257 1.808 18792 625 1 . 1 1 137 137 TYR CB C 137 37.988 37.988 38.027 -0.040 18792 626 1 . 1 1 137 137 TYR H H 137 8.809 8.809 7.809 1.000 18792 627 1 . 1 1 138 138 LEU N N 138 119.247 119.247 120.814 -1.567 18792 628 1 . 1 1 138 138 LEU C C 138 178.385 178.385 178.003 0.382 18792 629 1 . 1 1 138 138 LEU CA C 138 58.938 58.938 58.295 0.643 18792 630 1 . 1 1 138 138 LEU CB C 138 41.708 41.708 42.073 -0.365 18792 631 1 . 1 1 138 138 LEU H H 138 8.742 8.742 8.222 0.520 18792 632 1 . 1 1 139 139 ASN N N 139 117.122 117.122 115.963 1.160 18792 633 1 . 1 1 139 139 ASN C C 139 176.417 176.417 177.233 -0.817 18792 634 1 . 1 1 139 139 ASN CA C 139 56.448 56.448 55.486 0.962 18792 635 1 . 1 1 139 139 ASN CB C 139 38.652 38.652 38.049 0.604 18792 636 1 . 1 1 139 139 ASN H H 139 8.307 8.307 7.985 0.321 18792 637 1 . 1 1 140 140 ASP N N 140 115.394 115.394 119.831 -4.437 18792 638 1 . 1 1 140 140 ASP C C 140 177.919 177.919 176.919 1.000 18792 639 1 . 1 1 140 140 ASP CA C 140 55.953 55.953 56.860 -0.907 18792 640 1 . 1 1 140 140 ASP CB C 140 39.386 39.386 40.946 -1.560 18792 641 1 . 1 1 140 140 ASP H H 140 8.439 8.439 8.062 0.377 18792 642 1 . 1 1 141 141 HIS N N 141 111.695 111.695 113.210 -1.515 18792 643 1 . 1 1 141 141 HIS C C 141 175.949 175.949 176.058 -0.109 18792 644 1 . 1 1 141 141 HIS CA C 141 56.057 56.057 56.460 -0.404 18792 645 1 . 1 1 141 141 HIS CB C 141 29.908 29.908 32.054 -2.146 18792 646 1 . 1 1 141 141 HIS H H 141 8.043 8.043 7.336 0.707 18792 647 1 . 1 1 142 142 LEU N N 142 117.054 117.054 122.295 -5.241 18792 648 1 . 1 1 142 142 LEU C C 142 176.530 176.530 177.817 -1.287 18792 649 1 . 1 1 142 142 LEU CA C 142 55.309 55.309 57.824 -2.515 18792 650 1 . 1 1 142 142 LEU CB C 142 42.338 42.338 41.731 0.607 18792 651 1 . 1 1 142 142 LEU H H 142 7.198 7.198 8.055 -0.857 18792 652 1 . 1 1 143 143 GLU N N 143 121.335 121.335 120.018 1.317 18792 653 1 . 1 1 143 143 GLU C C 143 173.964 173.964 175.681 -1.717 18792 654 1 . 1 1 143 143 GLU CA C 143 60.254 60.254 60.803 -0.549 18792 655 1 . 1 1 143 143 GLU CB C 143 26.257 26.257 28.059 -1.802 18792 656 1 . 1 1 143 143 GLU H H 143 8.565 8.565 7.875 0.690 18792 657 1 . 1 1 145 145 TRP N N 145 117.973 117.973 120.030 -2.057 18792 658 1 . 1 1 145 145 TRP C C 145 179.526 179.526 177.703 1.823 18792 659 1 . 1 1 145 145 TRP CA C 145 61.606 61.606 60.132 1.474 18792 660 1 . 1 1 145 145 TRP CB C 145 27.888 27.888 29.640 -1.752 18792 661 1 . 1 1 145 145 TRP H H 145 7.078 7.078 8.277 -1.199 18792 662 1 . 1 1 146 146 ILE N N 146 122.101 122.101 111.395 10.706 18792 663 1 . 1 1 146 146 ILE C C 146 179.110 179.110 177.238 1.872 18792 664 1 . 1 1 146 146 ILE CA C 146 65.334 65.334 61.389 3.945 18792 665 1 . 1 1 146 146 ILE CB C 146 36.822 36.822 38.007 -1.185 18792 666 1 . 1 1 146 146 ILE H H 146 8.389 8.389 7.570 0.819 18792 667 1 . 1 1 147 147 GLN N N 147 116.344 116.344 121.314 -4.970 18792 668 1 . 1 1 147 147 GLN C C 147 179.526 179.526 177.640 1.886 18792 669 1 . 1 1 147 147 GLN CA C 147 58.013 58.013 58.779 -0.766 18792 670 1 . 1 1 147 147 GLN CB C 147 26.723 26.723 28.000 -1.277 18792 671 1 . 1 1 147 147 GLN H H 147 8.376 8.376 8.103 0.273 18792 672 1 . 1 1 148 148 GLU N N 148 118.913 118.913 120.254 -1.341 18792 673 1 . 1 1 148 148 GLU C C 148 176.880 176.880 177.954 -1.074 18792 674 1 . 1 1 148 148 GLU CA C 148 57.373 57.373 60.323 -2.950 18792 675 1 . 1 1 148 148 GLU CB C 148 28.432 28.432 29.486 -1.054 18792 676 1 . 1 1 148 148 GLU H H 148 7.504 7.504 8.003 -0.499 18792 677 1 . 1 1 149 149 ASN N N 149 116.616 116.616 113.772 2.844 18792 678 1 . 1 1 149 149 ASN C C 149 173.964 173.964 176.823 -2.859 18792 679 1 . 1 1 149 149 ASN CA C 149 53.246 53.246 53.661 -0.415 18792 680 1 . 1 1 149 149 ASN CB C 149 37.133 37.133 39.379 -2.246 18792 681 1 . 1 1 149 149 ASN H H 149 7.070 7.070 8.173 -1.103 18792 682 1 . 1 1 150 150 GLY N N 150 104.750 104.750 106.496 -1.746 18792 683 1 . 1 1 150 150 GLY C C 150 176.022 176.022 174.209 1.813 18792 684 1 . 1 1 150 150 GLY CA C 150 45.242 45.242 45.450 -0.208 18792 685 1 . 1 1 150 150 GLY H H 150 7.313 7.313 8.089 -0.776 18792 686 1 . 1 1 151 151 GLY N N 151 108.385 108.385 108.332 0.053 18792 687 1 . 1 1 151 151 GLY C C 151 173.449 173.449 175.011 -1.562 18792 688 1 . 1 1 151 151 GLY CA C 151 44.032 44.032 44.945 -0.913 18792 689 1 . 1 1 151 151 GLY H H 151 8.452 8.452 7.392 1.060 18792 690 1 . 1 1 152 152 TRP N N 152 118.092 118.092 122.099 -4.007 18792 691 1 . 1 1 152 152 TRP C C 152 178.571 178.571 178.088 0.483 18792 692 1 . 1 1 152 152 TRP CA C 152 60.077 60.077 60.860 -0.783 18792 693 1 . 1 1 152 152 TRP CB C 152 28.588 28.588 29.620 -1.032 18792 694 1 . 1 1 152 152 TRP H H 152 8.644 8.644 8.712 -0.068 18792 695 1 . 1 1 153 153 ASP N N 153 117.758 117.758 118.242 -0.484 18792 696 1 . 1 1 153 153 ASP C C 153 179.796 179.796 178.613 1.183 18792 697 1 . 1 1 153 153 ASP CA C 153 57.302 57.302 57.785 -0.483 18792 698 1 . 1 1 153 153 ASP CB C 153 39.231 39.231 40.927 -1.696 18792 699 1 . 1 1 153 153 ASP H H 153 8.827 8.827 8.339 0.488 18792 700 1 . 1 1 154 154 THR N N 154 116.817 116.817 117.214 -0.397 18792 701 1 . 1 1 154 154 THR C C 154 175.352 175.352 176.611 -1.259 18792 702 1 . 1 1 154 154 THR CA C 154 65.910 65.910 66.553 -0.643 18792 703 1 . 1 1 154 154 THR CB C 154 67.712 67.712 68.945 -1.233 18792 704 1 . 1 1 154 154 THR H H 154 7.494 7.494 7.617 -0.123 18792 705 1 . 1 1 155 155 PHE N N 155 122.196 122.196 121.657 0.539 18792 706 1 . 1 1 155 155 PHE C C 155 176.831 176.831 177.651 -0.820 18792 707 1 . 1 1 155 155 PHE CA C 155 61.286 61.286 60.976 0.310 18792 708 1 . 1 1 155 155 PHE CB C 155 36.667 36.667 38.335 -1.668 18792 709 1 . 1 1 155 155 PHE H H 155 6.477 6.477 8.679 -2.202 18792 710 1 . 1 1 156 156 VAL N N 156 117.387 117.387 118.596 -1.209 18792 711 1 . 1 1 156 156 VAL C C 156 178.497 178.497 177.910 0.587 18792 712 1 . 1 1 156 156 VAL CA C 156 66.231 66.231 66.359 -0.128 18792 713 1 . 1 1 156 156 VAL CB C 156 30.685 30.685 31.200 -0.515 18792 714 1 . 1 1 156 156 VAL H H 156 7.788 7.788 8.316 -0.528 18792 715 1 . 1 1 157 157 GLU N N 157 119.876 119.876 120.085 -0.209 18792 716 1 . 1 1 157 157 GLU C C 157 178.399 178.399 178.482 -0.083 18792 717 1 . 1 1 157 157 GLU CA C 157 58.760 58.760 59.190 -0.430 18792 718 1 . 1 1 157 157 GLU CB C 157 28.277 28.277 29.896 -1.619 18792 719 1 . 1 1 157 157 GLU H H 157 7.409 7.409 8.103 -0.694 18792 720 1 . 1 1 158 158 LEU N N 158 117.194 117.194 119.351 -2.157 18792 721 1 . 1 1 158 158 LEU C C 158 178.595 178.595 177.785 0.810 18792 722 1 . 1 1 158 158 LEU CA C 158 56.377 56.377 56.513 -0.136 18792 723 1 . 1 1 158 158 LEU CB C 158 42.571 42.571 42.334 0.237 18792 724 1 . 1 1 158 158 LEU H H 158 7.584 7.584 7.885 -0.301 18792 725 1 . 1 1 159 159 TYR N N 159 115.549 115.549 117.199 -1.650 18792 726 1 . 1 1 159 159 TYR C C 159 177.032 177.032 176.505 0.527 18792 727 1 . 1 1 159 159 TYR CA C 159 59.116 59.116 59.104 0.012 18792 728 1 . 1 1 159 159 TYR CB C 159 37.599 37.599 37.755 -0.156 18792 729 1 . 1 1 159 159 TYR H H 159 8.099 8.099 7.934 0.166 18792 730 1 . 1 1 160 160 GLY N N 160 108.334 108.334 106.150 2.184 18792 731 1 . 1 1 160 160 GLY C C 160 173.973 173.973 174.061 -0.088 18792 732 1 . 1 1 160 160 GLY CA C 160 45.064 45.064 44.957 0.106 18792 733 1 . 1 1 160 160 GLY H H 160 8.020 8.020 8.063 -0.043 18792 734 1 . 1 1 161 161 ASN N N 161 118.189 118.189 118.317 -0.128 18792 735 1 . 1 1 161 161 ASN C C 161 175.513 175.513 174.184 1.329 18792 736 1 . 1 1 161 161 ASN CA C 161 53.104 53.104 53.923 -0.819 18792 737 1 . 1 1 161 161 ASN CB C 161 38.203 38.203 39.148 -0.945 18792 738 1 . 1 1 161 161 ASN H H 161 8.327 8.327 7.947 0.380 18792 739 1 . 1 1 162 162 ASN N N 162 119.022 119.022 118.776 0.246 18792 740 1 . 1 1 162 162 ASN C C 162 175.690 175.690 174.165 1.525 18792 741 1 . 1 1 162 162 ASN CA C 162 53.424 53.424 53.264 0.161 18792 742 1 . 1 1 162 162 ASN CB C 162 38.203 38.203 38.997 -0.794 18792 743 1 . 1 1 162 162 ASN H H 162 8.363 8.363 8.507 -0.144 18792 744 1 . 1 1 163 163 ALA N N 163 123.275 123.275 124.817 -1.542 18792 745 1 . 1 1 163 163 ALA C C 163 178.598 178.598 177.971 0.627 18792 746 1 . 1 1 163 163 ALA CA C 163 53.238 53.238 53.228 0.010 18792 747 1 . 1 1 163 163 ALA CB C 163 17.611 17.611 19.485 -1.874 18792 748 1 . 1 1 163 163 ALA H H 163 8.103 8.103 8.340 -0.237 18792 749 1 . 1 1 164 164 ALA N N 164 121.521 121.521 121.329 0.193 18792 750 1 . 1 1 164 164 ALA C C 164 178.642 178.642 179.030 -0.388 18792 751 1 . 1 1 164 164 ALA CA C 164 52.584 52.584 53.847 -1.263 18792 752 1 . 1 1 164 164 ALA CB C 164 17.819 17.819 18.511 -0.692 18792 753 1 . 1 1 164 164 ALA H H 164 8.053 8.053 8.330 -0.277 18792 754 1 . 1 1 165 165 ALA N N 165 122.101 122.101 120.174 1.927 18792 755 1 . 1 1 165 165 ALA C C 165 179.124 179.124 178.498 0.626 18792 756 1 . 1 1 165 165 ALA CA C 165 53.139 53.139 53.625 -0.486 18792 757 1 . 1 1 165 165 ALA CB C 165 17.978 17.978 18.631 -0.653 18792 758 1 . 1 1 165 165 ALA H H 165 7.949 7.949 8.073 -0.124 18792 759 1 . 1 1 166 166 GLU N N 166 118.381 118.381 118.060 0.321 18792 760 1 . 1 1 166 166 GLU C C 166 177.664 177.664 177.337 0.327 18792 761 1 . 1 1 166 166 GLU CA C 166 57.088 57.088 57.226 -0.138 18792 762 1 . 1 1 166 166 GLU CB C 166 28.354 28.354 29.305 -0.951 18792 763 1 . 1 1 166 166 GLU H H 166 8.202 8.202 8.189 0.013 18792 764 1 . 1 1 167 167 SER N N 167 115.193 115.193 115.108 0.085 18792 765 1 . 1 1 167 167 SER C C 167 175.312 175.312 175.203 0.109 18792 766 1 . 1 1 167 167 SER CA C 167 58.831 58.831 60.359 -1.528 18792 767 1 . 1 1 167 167 SER CB C 167 62.537 62.537 63.523 -0.986 18792 768 1 . 1 1 167 167 SER H H 167 8.029 8.029 7.818 0.211 18792 769 1 . 1 1 168 168 ARG N N 168 121.696 121.696 119.071 2.625 18792 770 1 . 1 1 168 168 ARG C C 168 176.880 176.880 175.316 1.564 18792 771 1 . 1 1 168 168 ARG CA C 168 56.163 56.163 56.627 -0.464 18792 772 1 . 1 1 168 168 ARG CB C 168 29.209 29.209 29.571 -0.362 18792 773 1 . 1 1 168 168 ARG H H 168 7.967 7.967 8.106 -0.139 18792 774 1 . 1 1 169 169 LYS N N 169 120.917 120.917 119.446 1.471 18792 775 1 . 1 1 169 169 LYS C C 169 177.640 177.640 176.028 1.612 18792 776 1 . 1 1 169 169 LYS CA C 169 56.697 56.697 56.721 -0.024 18792 777 1 . 1 1 169 169 LYS CB C 169 31.462 31.462 32.775 -1.313 18792 778 1 . 1 1 169 169 LYS H H 169 8.011 8.011 8.064 -0.054 18792 779 1 . 1 1 170 170 GLY N N 170 109.155 109.155 108.835 0.320 18792 780 1 . 1 1 170 170 GLY C C 170 174.479 174.479 173.300 1.179 18792 781 1 . 1 1 170 170 GLY CA C 170 45.064 45.064 45.073 -0.009 18792 782 1 . 1 1 170 170 GLY H H 170 8.329 8.329 8.376 -0.047 18792 783 1 . 1 1 171 171 GLN N N 171 119.292 119.292 119.845 -0.553 18792 784 1 . 1 1 171 171 GLN C C 171 176.463 176.463 174.872 1.591 18792 785 1 . 1 1 171 171 GLN CA C 171 55.666 55.666 55.548 0.118 18792 786 1 . 1 1 171 171 GLN CB C 171 28.199 28.199 30.097 -1.898 18792 787 1 . 1 1 171 171 GLN H H 171 8.035 8.035 8.389 -0.354 18792 788 1 . 1 1 172 172 GLU N N 172 121.703 121.703 120.207 1.496 18792 789 1 . 1 1 172 172 GLU C C 172 176.414 176.414 175.151 1.263 18792 790 1 . 1 1 172 172 GLU CA C 172 56.341 56.341 56.056 0.285 18792 791 1 . 1 1 172 172 GLU CB C 172 28.821 28.821 31.158 -2.337 18792 792 1 . 1 1 172 172 GLU H H 172 8.405 8.405 8.566 -0.161 18792 793 1 . 1 1 173 173 ARG N N 173 121.852 121.852 120.915 0.937 18792 794 1 . 1 1 173 173 ARG C C 173 176.365 176.365 174.860 1.505 18792 795 1 . 1 1 173 173 ARG CA C 173 56.199 56.199 55.829 0.370 18792 796 1 . 1 1 173 173 ARG CB C 173 29.131 29.131 31.445 -2.314 18792 797 1 . 1 1 173 173 ARG H H 173 8.335 8.335 8.496 -0.161 18792 798 1 . 1 1 174 174 LEU N N 174 122.640 122.640 121.243 1.397 18792 799 1 . 1 1 174 174 LEU C C 174 176.523 176.523 175.846 0.677 18792 800 1 . 1 1 174 174 LEU CA C 174 54.768 54.768 54.978 -0.210 18792 801 1 . 1 1 174 174 LEU CB C 174 40.784 40.784 43.246 -2.462 18792 802 1 . 1 1 174 174 LEU H H 174 8.082 8.082 8.548 -0.466 18792 803 1 . 1 1 175 175 GLU N N 175 125.909 125.909 120.400 5.509 18792 804 1 . 1 1 175 175 GLU C C 175 181.029 181.029 175.129 5.900 18792 805 1 . 1 1 175 175 GLU CA C 175 57.398 57.398 56.150 1.248 18792 806 1 . 1 1 175 175 GLU CB C 175 30.050 30.050 31.396 -1.346 18792 807 1 . 1 1 175 175 GLU H H 175 7.785 7.785 8.549 -0.764 18792 stop_ save_