data_17890 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17890 _Entry.PDB_ID 2LIE 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 17890 _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 2 2 GLY CA C 2 43.294 43.294 45.619 -2.325 17890 2 1 1 . 1 1 8 8 HIS HA H 8 4.622 4.622 5.363 -0.741 17890 3 1 1 . 1 1 8 8 HIS CA C 8 55.661 55.661 55.308 0.353 17890 4 1 1 . 1 1 8 8 HIS CB C 8 29.880 29.880 31.799 -1.919 17890 5 1 1 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.788 -0.142 17890 6 1 1 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.107 0.577 17890 7 1 1 . 1 1 9 9 HIS CB C 9 29.831 29.831 33.284 -3.453 17890 8 1 1 . 1 1 10 10 HIS N N 10 120.811 120.811 116.420 4.391 17890 9 1 1 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.847 -0.167 17890 10 1 1 . 1 1 10 10 HIS C C 10 174.875 174.875 175.300 -0.425 17890 11 1 1 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.147 0.599 17890 12 1 1 . 1 1 10 10 HIS CB C 10 29.889 29.889 33.529 -3.640 17890 13 1 1 . 1 1 10 10 HIS H H 10 8.583 8.583 7.281 1.302 17890 14 1 1 . 1 1 11 11 SER N N 11 118.009 118.009 114.397 3.612 17890 15 1 1 . 1 1 11 11 SER HA H 11 4.424 4.424 4.067 0.357 17890 16 1 1 . 1 1 11 11 SER C C 11 174.962 174.962 174.006 0.956 17890 17 1 1 . 1 1 11 11 SER CA C 11 58.660 58.660 59.335 -0.675 17890 18 1 1 . 1 1 11 11 SER CB C 11 63.822 63.822 62.007 1.815 17890 19 1 1 . 1 1 11 11 SER H H 11 8.438 8.438 8.655 -0.217 17890 20 1 1 . 1 1 12 12 GLY N N 12 111.011 111.011 106.173 4.838 17890 21 1 1 . 1 1 12 12 GLY C C 12 173.907 173.907 173.036 0.871 17890 22 1 1 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.218 0.203 17890 23 1 1 . 1 1 12 12 GLY H H 12 8.433 8.433 7.844 0.589 17890 24 1 1 . 1 1 13 13 ASP N N 13 120.291 120.291 119.096 1.195 17890 25 1 1 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.834 -0.172 17890 26 1 1 . 1 1 13 13 ASP C C 13 176.115 176.115 175.656 0.459 17890 27 1 1 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.756 0.547 17890 28 1 1 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.158 0.306 17890 29 1 1 . 1 1 13 13 ASP H H 13 8.153 8.153 8.208 -0.055 17890 30 1 1 . 1 1 14 14 SER N N 14 116.987 116.987 114.868 2.119 17890 31 1 1 . 1 1 14 14 SER HA H 14 4.754 4.754 4.785 -0.031 17890 32 1 1 . 1 1 14 14 SER CA C 14 56.469 56.469 56.045 0.424 17890 33 1 1 . 1 1 14 14 SER CB C 14 63.553 63.553 63.266 0.287 17890 34 1 1 . 1 1 14 14 SER H H 14 8.210 8.210 7.752 0.458 17890 35 1 1 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.463 -0.021 17890 36 1 1 . 1 1 15 15 PRO C C 15 176.424 176.424 176.113 0.311 17890 37 1 1 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.042 0.191 17890 38 1 1 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.328 -0.180 17890 39 1 1 . 1 1 16 16 ALA N N 16 124.219 124.219 122.644 1.575 17890 40 1 1 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.500 -0.150 17890 41 1 1 . 1 1 16 16 ALA C C 16 177.552 177.552 176.480 1.072 17890 42 1 1 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.206 0.227 17890 43 1 1 . 1 1 16 16 ALA CB C 16 19.319 19.319 20.241 -0.922 17890 44 1 1 . 1 1 16 16 ALA H H 16 8.284 8.284 8.309 -0.025 17890 45 1 1 . 1 1 17 17 VAL N N 17 119.504 119.504 118.478 1.026 17890 46 1 1 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.381 -0.132 17890 47 1 1 . 1 1 17 17 VAL C C 17 176.322 176.322 175.201 1.121 17890 48 1 1 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.194 0.084 17890 49 1 1 . 1 1 17 17 VAL CB C 17 32.957 32.957 33.825 -0.868 17890 50 1 1 . 1 1 17 17 VAL H H 17 8.046 8.046 7.639 0.407 17890 51 1 1 . 1 1 18 18 THR N N 18 118.186 118.186 117.505 0.681 17890 52 1 1 . 1 1 18 18 THR HA H 18 4.473 4.473 4.605 -0.132 17890 53 1 1 . 1 1 18 18 THR C C 18 174.248 174.248 174.827 -0.579 17890 54 1 1 . 1 1 18 18 THR CA C 18 61.565 61.565 61.511 0.054 17890 55 1 1 . 1 1 18 18 THR CB C 18 70.165 70.165 69.457 0.708 17890 56 1 1 . 1 1 18 18 THR H H 18 8.276 8.276 8.378 -0.102 17890 57 1 1 . 1 1 19 19 LEU N N 19 125.265 125.265 119.914 5.351 17890 58 1 1 . 1 1 19 19 LEU HA H 19 4.293 4.293 4.008 0.285 17890 59 1 1 . 1 1 19 19 LEU C C 19 175.689 175.689 175.673 0.016 17890 60 1 1 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.766 -0.339 17890 61 1 1 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.373 1.906 17890 62 1 1 . 1 1 19 19 LEU H H 19 8.091 8.091 8.231 -0.140 17890 63 1 1 . 1 1 20 20 SER N N 20 114.622 114.622 115.031 -0.409 17890 64 1 1 . 1 1 20 20 SER HA H 20 4.947 4.947 4.883 0.064 17890 65 1 1 . 1 1 20 20 SER C C 20 174.220 174.220 173.358 0.862 17890 66 1 1 . 1 1 20 20 SER CA C 20 56.583 56.583 57.369 -0.786 17890 67 1 1 . 1 1 20 20 SER CB C 20 65.653 65.653 65.937 -0.284 17890 68 1 1 . 1 1 20 20 SER H H 20 7.316 7.316 8.183 -0.867 17890 69 1 1 . 1 1 21 21 ALA N N 21 125.517 125.517 124.131 1.386 17890 70 1 1 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.999 -0.331 17890 71 1 1 . 1 1 21 21 ALA C C 21 177.960 177.960 177.598 0.362 17890 72 1 1 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.486 1.524 17890 73 1 1 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.426 -0.201 17890 74 1 1 . 1 1 21 21 ALA H H 21 8.993 8.993 8.553 0.440 17890 75 1 1 . 1 1 22 22 GLY N N 22 109.543 109.543 112.007 -2.464 17890 76 1 1 . 1 1 22 22 GLY C C 22 170.422 170.422 172.076 -1.654 17890 77 1 1 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.081 0.300 17890 78 1 1 . 1 1 22 22 GLY H H 22 8.411 8.411 9.029 -0.618 17890 79 1 1 . 1 1 23 23 ASN N N 23 119.649 119.649 119.973 -0.324 17890 80 1 1 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.723 0.164 17890 81 1 1 . 1 1 23 23 ASN C C 23 175.207 175.207 174.568 0.639 17890 82 1 1 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.699 -0.878 17890 83 1 1 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.965 -1.210 17890 84 1 1 . 1 1 23 23 ASN H H 23 8.092 8.092 8.378 -0.286 17890 85 1 1 . 1 1 24 24 TYR N N 24 120.889 120.889 121.516 -0.627 17890 86 1 1 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.156 0.099 17890 87 1 1 . 1 1 24 24 TYR C C 24 175.667 175.667 174.449 1.218 17890 88 1 1 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.254 0.859 17890 89 1 1 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.703 0.123 17890 90 1 1 . 1 1 24 24 TYR H H 24 9.914 9.914 9.025 0.889 17890 91 1 1 . 1 1 25 25 ILE N N 25 115.978 115.978 113.586 2.392 17890 92 1 1 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.065 0.021 17890 93 1 1 . 1 1 25 25 ILE C C 25 175.200 175.200 174.257 0.943 17890 94 1 1 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.602 0.943 17890 95 1 1 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.868 -0.746 17890 96 1 1 . 1 1 25 25 ILE H H 25 9.216 9.216 9.309 -0.093 17890 97 1 1 . 1 1 26 26 ILE N N 26 123.957 123.957 122.538 1.419 17890 98 1 1 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.246 -0.270 17890 99 1 1 . 1 1 26 26 ILE C C 26 174.810 174.810 174.911 -0.101 17890 100 1 1 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.233 0.376 17890 101 1 1 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.247 0.875 17890 102 1 1 . 1 1 26 26 ILE H H 26 9.559 9.559 9.060 0.499 17890 103 1 1 . 1 1 27 27 TYR N N 27 121.371 121.371 124.013 -2.642 17890 104 1 1 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.559 0.631 17890 105 1 1 . 1 1 27 27 TYR C C 27 173.963 173.963 173.495 0.468 17890 106 1 1 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.876 -0.207 17890 107 1 1 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.915 0.783 17890 108 1 1 . 1 1 27 27 TYR H H 27 9.378 9.378 9.090 0.288 17890 109 1 1 . 1 1 28 28 ASN N N 28 121.991 121.991 119.946 2.045 17890 110 1 1 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.006 -0.238 17890 111 1 1 . 1 1 28 28 ASN C C 28 174.352 174.352 176.055 -1.703 17890 112 1 1 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.386 1.734 17890 113 1 1 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.889 1.557 17890 114 1 1 . 1 1 28 28 ASN H H 28 8.466 8.466 8.478 -0.012 17890 115 1 1 . 1 1 29 29 ARG N N 29 121.103 121.103 127.257 -6.154 17890 116 1 1 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.140 -0.279 17890 117 1 1 . 1 1 29 29 ARG C C 29 173.635 173.635 177.460 -3.825 17890 118 1 1 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.554 1.739 17890 119 1 1 . 1 1 29 29 ARG CB C 29 30.399 30.399 29.868 0.531 17890 120 1 1 . 1 1 29 29 ARG H H 29 7.756 7.756 8.271 -0.515 17890 121 1 1 . 1 1 30 30 VAL N N 30 118.412 118.412 117.566 0.846 17890 122 1 1 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.820 0.124 17890 123 1 1 . 1 1 30 30 VAL C C 30 176.199 176.199 175.749 0.450 17890 124 1 1 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.941 -1.365 17890 125 1 1 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.256 -2.034 17890 126 1 1 . 1 1 30 30 VAL H H 30 8.976 8.976 7.655 1.321 17890 127 1 1 . 1 1 31 31 LEU N N 31 125.418 125.418 114.377 11.041 17890 128 1 1 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.020 0.465 17890 129 1 1 . 1 1 31 31 LEU C C 31 179.123 179.123 176.146 2.977 17890 130 1 1 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.416 -1.391 17890 131 1 1 . 1 1 31 31 LEU CB C 31 45.581 45.581 40.995 4.586 17890 132 1 1 . 1 1 31 31 LEU H H 31 8.856 8.856 7.470 1.386 17890 133 1 1 . 1 1 32 32 SER N N 32 116.890 116.890 116.114 0.776 17890 134 1 1 . 1 1 32 32 SER HA H 32 5.365 5.365 4.741 0.624 17890 135 1 1 . 1 1 32 32 SER CA C 32 57.269 57.269 56.197 1.072 17890 136 1 1 . 1 1 32 32 SER CB C 32 62.213 62.213 64.724 -2.511 17890 137 1 1 . 1 1 32 32 SER H H 32 9.307 9.307 8.360 0.947 17890 138 1 1 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.464 -0.584 17890 139 1 1 . 1 1 33 33 PRO C C 33 175.137 175.137 177.589 -2.452 17890 140 1 1 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.302 0.983 17890 141 1 1 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.616 0.415 17890 142 1 1 . 1 1 34 34 ARG N N 34 110.279 110.279 119.600 -9.321 17890 143 1 1 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.255 0.237 17890 144 1 1 . 1 1 34 34 ARG C C 34 176.844 176.844 177.146 -0.302 17890 145 1 1 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.772 -1.336 17890 146 1 1 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.407 0.177 17890 147 1 1 . 1 1 34 34 ARG H H 34 7.257 7.257 7.820 -0.563 17890 148 1 1 . 1 1 35 35 GLY N N 35 110.288 110.288 105.817 4.471 17890 149 1 1 . 1 1 35 35 GLY C C 35 173.336 173.336 173.862 -0.526 17890 150 1 1 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.867 2.163 17890 151 1 1 . 1 1 35 35 GLY H H 35 8.589 8.589 7.871 0.718 17890 152 1 1 . 1 1 36 36 GLU N N 36 116.838 116.838 118.299 -1.461 17890 153 1 1 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.559 -0.211 17890 154 1 1 . 1 1 36 36 GLU C C 36 176.915 176.915 175.514 1.401 17890 155 1 1 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.937 0.970 17890 156 1 1 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.116 -2.701 17890 157 1 1 . 1 1 36 36 GLU H H 36 7.769 7.769 7.729 0.040 17890 158 1 1 . 1 1 37 37 LYS N N 37 123.775 123.775 120.638 3.137 17890 159 1 1 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.154 0.269 17890 160 1 1 . 1 1 37 37 LYS C C 37 176.067 176.067 175.551 0.516 17890 161 1 1 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.583 -0.682 17890 162 1 1 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.765 0.909 17890 163 1 1 . 1 1 37 37 LYS H H 37 8.667 8.667 8.616 0.051 17890 164 1 1 . 1 1 38 38 LEU N N 38 126.658 126.658 126.120 0.538 17890 165 1 1 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.932 -0.705 17890 166 1 1 . 1 1 38 38 LEU C C 38 174.332 174.332 175.000 -0.668 17890 167 1 1 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.601 -0.258 17890 168 1 1 . 1 1 38 38 LEU CB C 38 41.651 41.651 43.075 -1.424 17890 169 1 1 . 1 1 38 38 LEU H H 38 10.455 10.455 8.987 1.468 17890 170 1 1 . 1 1 39 39 ALA N N 39 127.018 127.018 126.918 0.100 17890 171 1 1 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.218 0.011 17890 172 1 1 . 1 1 39 39 ALA C C 39 178.694 178.694 176.189 2.505 17890 173 1 1 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.291 -0.066 17890 174 1 1 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.584 0.765 17890 175 1 1 . 1 1 39 39 ALA H H 39 8.773 8.773 8.559 0.214 17890 176 1 1 . 1 1 40 40 LEU N N 40 126.771 126.771 124.447 2.324 17890 177 1 1 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.556 -0.202 17890 178 1 1 . 1 1 40 40 LEU C C 40 178.309 178.309 176.518 1.791 17890 179 1 1 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.051 0.794 17890 180 1 1 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.985 0.338 17890 181 1 1 . 1 1 40 40 LEU H H 40 9.665 9.665 8.798 0.867 17890 182 1 1 . 1 1 41 41 THR N N 41 126.578 126.578 125.118 1.460 17890 183 1 1 . 1 1 41 41 THR HA H 41 4.916 4.916 5.144 -0.229 17890 184 1 1 . 1 1 41 41 THR C C 41 172.547 172.547 173.391 -0.844 17890 185 1 1 . 1 1 41 41 THR CA C 41 63.253 63.253 61.441 1.812 17890 186 1 1 . 1 1 41 41 THR CB C 41 71.832 71.832 70.430 1.402 17890 187 1 1 . 1 1 41 41 THR H H 41 9.802 9.802 9.193 0.609 17890 188 1 1 . 1 1 42 42 TYR N N 42 130.506 130.506 129.751 0.755 17890 189 1 1 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.651 0.451 17890 190 1 1 . 1 1 42 42 TYR CA C 42 53.986 53.986 58.326 -4.340 17890 191 1 1 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.742 0.413 17890 192 1 1 . 1 1 42 42 TYR H H 42 9.428 9.428 8.886 0.542 17890 193 1 1 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.399 0.091 17890 194 1 1 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.274 0.299 17890 195 1 1 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.837 -0.193 17890 196 1 1 . 1 1 44 44 GLY N N 44 113.736 113.736 107.209 6.527 17890 197 1 1 . 1 1 44 44 GLY C C 44 171.790 171.790 173.300 -1.510 17890 198 1 1 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.252 0.464 17890 199 1 1 . 1 1 44 44 GLY H H 44 8.337 8.337 7.710 0.627 17890 200 1 1 . 1 1 45 45 ARG N N 45 113.899 113.899 116.647 -2.748 17890 201 1 1 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.547 0.029 17890 202 1 1 . 1 1 45 45 ARG C C 45 175.151 175.151 173.766 1.385 17890 203 1 1 . 1 1 45 45 ARG CA C 45 54.165 54.165 53.918 0.247 17890 204 1 1 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.907 1.312 17890 205 1 1 . 1 1 45 45 ARG H H 45 6.463 6.463 7.339 -0.876 17890 206 1 1 . 1 1 46 46 GLN N N 46 119.000 119.000 118.817 0.183 17890 207 1 1 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.456 -0.007 17890 208 1 1 . 1 1 46 46 GLN C C 46 177.282 177.282 176.656 0.626 17890 209 1 1 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.107 1.506 17890 210 1 1 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.421 1.075 17890 211 1 1 . 1 1 46 46 GLN H H 46 8.683 8.683 8.518 0.165 17890 212 1 1 . 1 1 47 47 ARG N N 47 113.526 113.526 116.991 -3.465 17890 213 1 1 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.088 -0.558 17890 214 1 1 . 1 1 47 47 ARG C C 47 174.130 174.130 175.165 -1.035 17890 215 1 1 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.093 1.723 17890 216 1 1 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.231 1.839 17890 217 1 1 . 1 1 47 47 ARG H H 47 9.677 9.677 8.665 1.012 17890 218 1 1 . 1 1 48 48 THR N N 48 114.672 114.672 114.743 -0.071 17890 219 1 1 . 1 1 48 48 THR HA H 48 4.938 4.938 4.738 0.200 17890 220 1 1 . 1 1 48 48 THR CA C 48 59.987 59.987 59.577 0.410 17890 221 1 1 . 1 1 48 48 THR CB C 48 71.947 71.947 70.833 1.114 17890 222 1 1 . 1 1 48 48 THR H H 48 8.104 8.104 7.564 0.540 17890 223 1 1 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.547 -0.179 17890 224 1 1 . 1 1 49 49 PRO C C 49 175.651 175.651 176.307 -0.656 17890 225 1 1 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.236 0.945 17890 226 1 1 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.225 0.472 17890 227 1 1 . 1 1 50 50 VAL N N 50 122.562 122.562 119.896 2.666 17890 228 1 1 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.273 -0.326 17890 229 1 1 . 1 1 50 50 VAL C C 50 174.493 174.493 175.731 -1.238 17890 230 1 1 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.056 2.755 17890 231 1 1 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.092 -1.924 17890 232 1 1 . 1 1 50 50 VAL H H 50 8.123 8.123 8.150 -0.027 17890 233 1 1 . 1 1 51 51 THR N N 51 113.549 113.549 118.645 -5.096 17890 234 1 1 . 1 1 51 51 THR HA H 51 5.372 5.372 4.678 0.694 17890 235 1 1 . 1 1 51 51 THR C C 51 174.841 174.841 172.662 2.179 17890 236 1 1 . 1 1 51 51 THR CA C 51 59.196 59.196 60.965 -1.769 17890 237 1 1 . 1 1 51 51 THR CB C 51 72.703 72.703 72.000 0.703 17890 238 1 1 . 1 1 51 51 THR H H 51 7.057 7.057 8.170 -1.113 17890 239 1 1 . 1 1 52 52 VAL N N 52 107.374 107.374 120.669 -13.295 17890 240 1 1 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.045 0.469 17890 241 1 1 . 1 1 52 52 VAL C C 52 175.697 175.697 174.190 1.507 17890 242 1 1 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.885 -1.413 17890 243 1 1 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.070 -0.296 17890 244 1 1 . 1 1 52 52 VAL H H 52 8.062 8.062 8.593 -0.531 17890 245 1 1 . 1 1 53 53 SER N N 53 114.662 114.662 121.617 -6.955 17890 246 1 1 . 1 1 53 53 SER HA H 53 4.690 4.690 4.985 -0.295 17890 247 1 1 . 1 1 53 53 SER CA C 53 56.828 56.828 55.640 1.188 17890 248 1 1 . 1 1 53 53 SER CB C 53 64.789 64.789 65.599 -0.810 17890 249 1 1 . 1 1 53 53 SER H H 53 8.681 8.681 9.066 -0.385 17890 250 1 1 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.675 0.101 17890 251 1 1 . 1 1 54 54 PRO C C 54 177.724 177.724 176.417 1.307 17890 252 1 1 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.881 0.544 17890 253 1 1 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.130 -0.033 17890 254 1 1 . 1 1 55 55 LEU N N 55 128.655 128.655 124.896 3.759 17890 255 1 1 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.232 0.295 17890 256 1 1 . 1 1 55 55 LEU C C 55 178.696 178.696 176.409 2.287 17890 257 1 1 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.178 0.068 17890 258 1 1 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.328 1.278 17890 259 1 1 . 1 1 55 55 LEU H H 55 8.675 8.675 8.405 0.270 17890 260 1 1 . 1 1 56 56 ASP N N 56 126.651 126.651 125.800 0.851 17890 261 1 1 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.788 -0.079 17890 262 1 1 . 1 1 56 56 ASP C C 56 177.729 177.729 176.903 0.826 17890 263 1 1 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.029 -0.406 17890 264 1 1 . 1 1 56 56 ASP CB C 56 41.632 41.632 44.039 -2.407 17890 265 1 1 . 1 1 56 56 ASP H H 56 9.683 9.683 9.481 0.202 17890 266 1 1 . 1 1 57 57 GLY N N 57 109.299 109.299 109.016 0.283 17890 267 1 1 . 1 1 57 57 GLY C C 57 174.558 174.558 174.467 0.091 17890 268 1 1 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.890 1.065 17890 269 1 1 . 1 1 57 57 GLY H H 57 8.157 8.157 8.635 -0.478 17890 270 1 1 . 1 1 58 58 SER N N 58 116.740 116.740 115.775 0.965 17890 271 1 1 . 1 1 58 58 SER HA H 58 4.288 4.288 4.484 -0.196 17890 272 1 1 . 1 1 58 58 SER C C 58 177.252 177.252 176.177 1.075 17890 273 1 1 . 1 1 58 58 SER CA C 58 58.737 58.737 57.718 1.019 17890 274 1 1 . 1 1 58 58 SER CB C 58 64.576 64.576 64.673 -0.097 17890 275 1 1 . 1 1 58 58 SER H H 58 8.328 8.328 7.764 0.564 17890 276 1 1 . 1 1 59 59 SER N N 59 119.768 119.768 117.311 2.457 17890 277 1 1 . 1 1 59 59 SER HA H 59 4.046 4.046 4.125 -0.079 17890 278 1 1 . 1 1 59 59 SER C C 59 176.671 176.671 175.738 0.933 17890 279 1 1 . 1 1 59 59 SER CA C 59 61.691 61.691 60.788 0.902 17890 280 1 1 . 1 1 59 59 SER CB C 59 63.154 63.154 62.807 0.347 17890 281 1 1 . 1 1 59 59 SER H H 59 9.020 9.020 8.796 0.224 17890 282 1 1 . 1 1 60 60 GLU N N 60 119.133 119.133 119.933 -0.800 17890 283 1 1 . 1 1 60 60 GLU HA H 60 4.186 4.186 3.997 0.189 17890 284 1 1 . 1 1 60 60 GLU C C 60 177.435 177.435 177.967 -0.532 17890 285 1 1 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.649 1.384 17890 286 1 1 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.337 -1.111 17890 287 1 1 . 1 1 60 60 GLU H H 60 8.832 8.832 7.870 0.962 17890 288 1 1 . 1 1 61 61 GLN N N 61 118.818 118.818 116.175 2.643 17890 289 1 1 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.781 0.396 17890 290 1 1 . 1 1 61 61 GLN C C 61 173.254 173.254 174.773 -1.519 17890 291 1 1 . 1 1 61 61 GLN CA C 61 54.373 54.373 55.656 -1.283 17890 292 1 1 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.135 -2.213 17890 293 1 1 . 1 1 61 61 GLN H H 61 7.648 7.648 7.540 0.108 17890 294 1 1 . 1 1 62 62 ALA N N 62 122.562 122.562 122.199 0.363 17890 295 1 1 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.505 0.559 17890 296 1 1 . 1 1 62 62 ALA C C 62 176.637 176.637 175.466 1.171 17890 297 1 1 . 1 1 62 62 ALA CA C 62 51.179 51.179 50.844 0.335 17890 298 1 1 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.256 -0.661 17890 299 1 1 . 1 1 62 62 ALA H H 62 7.315 7.315 6.810 0.505 17890 300 1 1 . 1 1 63 63 TRP N N 63 124.787 124.787 119.732 5.055 17890 301 1 1 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.304 -0.340 17890 302 1 1 . 1 1 63 63 TRP C C 63 174.351 174.351 175.250 -0.899 17890 303 1 1 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.142 -0.240 17890 304 1 1 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.884 -1.767 17890 305 1 1 . 1 1 63 63 TRP H H 63 9.544 9.544 9.051 0.493 17890 306 1 1 . 1 1 64 64 ILE N N 64 122.482 122.482 119.279 3.203 17890 307 1 1 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.936 -0.242 17890 308 1 1 . 1 1 64 64 ILE C C 64 177.078 177.078 174.255 2.823 17890 309 1 1 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.581 0.450 17890 310 1 1 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.225 -0.856 17890 311 1 1 . 1 1 64 64 ILE H H 64 10.235 10.235 9.443 0.792 17890 312 1 1 . 1 1 65 65 LEU N N 65 132.183 132.183 128.755 3.428 17890 313 1 1 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.506 -0.041 17890 314 1 1 . 1 1 65 65 LEU C C 65 177.048 177.048 174.453 2.595 17890 315 1 1 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.819 0.530 17890 316 1 1 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.111 -3.767 17890 317 1 1 . 1 1 65 65 LEU H H 65 9.432 9.432 9.320 0.112 17890 318 1 1 . 1 1 66 66 ARG N N 66 120.807 120.807 125.936 -5.129 17890 319 1 1 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.948 -0.060 17890 320 1 1 . 1 1 66 66 ARG C C 66 175.275 175.275 174.456 0.819 17890 321 1 1 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.450 0.605 17890 322 1 1 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.355 -1.365 17890 323 1 1 . 1 1 66 66 ARG H H 66 8.491 8.491 8.580 -0.089 17890 324 1 1 . 1 1 67 67 SER N N 67 119.709 119.709 116.659 3.050 17890 325 1 1 . 1 1 67 67 SER HA H 67 3.186 3.186 3.390 -0.204 17890 326 1 1 . 1 1 67 67 SER C C 67 174.508 174.508 173.429 1.079 17890 327 1 1 . 1 1 67 67 SER CA C 67 58.521 58.521 59.173 -0.652 17890 328 1 1 . 1 1 67 67 SER CB C 67 62.590 62.590 63.387 -0.797 17890 329 1 1 . 1 1 67 67 SER H H 67 8.557 8.557 8.711 -0.154 17890 330 1 1 . 1 1 68 68 TYR N N 68 131.011 131.011 127.541 3.470 17890 331 1 1 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.546 -0.098 17890 332 1 1 . 1 1 68 68 TYR C C 68 174.687 174.687 174.886 -0.199 17890 333 1 1 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.341 0.424 17890 334 1 1 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.157 -2.169 17890 335 1 1 . 1 1 68 68 TYR H H 68 8.531 8.531 8.470 0.061 17890 336 1 1 . 1 1 69 69 ASP N N 69 117.066 117.066 119.901 -2.835 17890 337 1 1 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.817 -0.192 17890 338 1 1 . 1 1 69 69 ASP C C 69 176.455 176.455 176.216 0.239 17890 339 1 1 . 1 1 69 69 ASP CA C 69 53.091 53.091 54.029 -0.938 17890 340 1 1 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.977 -0.830 17890 341 1 1 . 1 1 69 69 ASP H H 69 7.122 7.122 7.769 -0.647 17890 342 1 1 . 1 1 70 70 SER N N 70 122.869 122.869 120.181 2.688 17890 343 1 1 . 1 1 70 70 SER HA H 70 4.270 4.270 4.056 0.214 17890 344 1 1 . 1 1 70 70 SER C C 70 177.010 177.010 176.232 0.778 17890 345 1 1 . 1 1 70 70 SER CA C 70 60.837 60.837 61.530 -0.693 17890 346 1 1 . 1 1 70 70 SER CB C 70 62.722 62.722 63.257 -0.535 17890 347 1 1 . 1 1 70 70 SER H H 70 8.757 8.757 8.811 -0.054 17890 348 1 1 . 1 1 71 71 ASN N N 71 119.873 119.873 119.618 0.255 17890 349 1 1 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.572 -0.001 17890 350 1 1 . 1 1 71 71 ASN C C 71 176.226 176.226 175.966 0.260 17890 351 1 1 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.402 0.312 17890 352 1 1 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.440 0.201 17890 353 1 1 . 1 1 71 71 ASN H H 71 8.342 8.342 8.659 -0.317 17890 354 1 1 . 1 1 72 72 SER N N 72 112.202 112.202 112.998 -0.796 17890 355 1 1 . 1 1 72 72 SER HA H 72 4.567 4.567 4.696 -0.129 17890 356 1 1 . 1 1 72 72 SER C C 72 173.789 173.789 173.568 0.221 17890 357 1 1 . 1 1 72 72 SER CA C 72 57.816 57.816 57.620 0.196 17890 358 1 1 . 1 1 72 72 SER CB C 72 63.935 63.935 64.446 -0.511 17890 359 1 1 . 1 1 72 72 SER H H 72 7.560 7.560 7.714 -0.154 17890 360 1 1 . 1 1 73 73 ASN N N 73 117.437 117.437 118.742 -1.305 17890 361 1 1 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.404 0.130 17890 362 1 1 . 1 1 73 73 ASN C C 73 173.647 173.647 174.134 -0.487 17890 363 1 1 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.527 -0.004 17890 364 1 1 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.157 0.056 17890 365 1 1 . 1 1 73 73 ASN H H 73 7.940 7.940 8.059 -0.119 17890 366 1 1 . 1 1 74 74 THR N N 74 104.227 104.227 109.762 -5.535 17890 367 1 1 . 1 1 74 74 THR HA H 74 5.477 5.477 4.993 0.484 17890 368 1 1 . 1 1 74 74 THR C C 74 176.824 176.824 173.900 2.924 17890 369 1 1 . 1 1 74 74 THR CA C 74 59.768 59.768 61.696 -1.928 17890 370 1 1 . 1 1 74 74 THR CB C 74 71.985 71.985 69.907 2.078 17890 371 1 1 . 1 1 74 74 THR H H 74 7.737 7.737 7.825 -0.088 17890 372 1 1 . 1 1 75 75 TRP N N 75 124.636 124.636 124.259 0.377 17890 373 1 1 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.378 -0.171 17890 374 1 1 . 1 1 75 75 TRP C C 75 175.876 175.876 176.229 -0.353 17890 375 1 1 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.031 1.575 17890 376 1 1 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.535 -0.019 17890 377 1 1 . 1 1 75 75 TRP H H 75 9.442 9.442 9.157 0.285 17890 378 1 1 . 1 1 76 76 THR N N 76 110.544 110.544 115.059 -4.515 17890 379 1 1 . 1 1 76 76 THR HA H 76 5.129 5.129 5.069 0.060 17890 380 1 1 . 1 1 76 76 THR C C 76 174.506 174.506 174.249 0.257 17890 381 1 1 . 1 1 76 76 THR CA C 76 60.561 60.561 61.594 -1.034 17890 382 1 1 . 1 1 76 76 THR CB C 76 71.688 71.688 70.178 1.510 17890 383 1 1 . 1 1 76 76 THR H H 76 9.415 9.415 9.342 0.073 17890 384 1 1 . 1 1 77 77 ILE N N 77 121.567 121.567 123.978 -2.411 17890 385 1 1 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.234 -0.095 17890 386 1 1 . 1 1 77 77 ILE C C 77 176.148 176.148 175.092 1.056 17890 387 1 1 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.666 2.042 17890 388 1 1 . 1 1 77 77 ILE CB C 77 40.987 40.987 40.301 0.686 17890 389 1 1 . 1 1 77 77 ILE H H 77 9.255 9.255 8.334 0.921 17890 390 1 1 . 1 1 78 78 SER N N 78 122.269 122.269 121.102 1.167 17890 391 1 1 . 1 1 78 78 SER HA H 78 5.601 5.601 5.258 0.343 17890 392 1 1 . 1 1 78 78 SER CA C 78 55.835 55.835 56.130 -0.295 17890 393 1 1 . 1 1 78 78 SER CB C 78 65.858 65.858 66.552 -0.693 17890 394 1 1 . 1 1 78 78 SER H H 78 9.226 9.226 8.687 0.539 17890 395 1 1 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.336 -0.472 17890 396 1 1 . 1 1 79 79 PRO C C 79 178.175 178.175 177.917 0.258 17890 397 1 1 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.074 0.810 17890 398 1 1 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.613 -1.341 17890 399 1 1 . 1 1 80 80 VAL N N 80 121.906 121.906 119.445 2.461 17890 400 1 1 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.858 -0.277 17890 401 1 1 . 1 1 80 80 VAL C C 80 177.751 177.751 176.800 0.951 17890 402 1 1 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.662 1.405 17890 403 1 1 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.098 0.387 17890 404 1 1 . 1 1 80 80 VAL H H 80 7.328 7.328 7.910 -0.582 17890 405 1 1 . 1 1 81 81 GLY N N 81 104.643 104.643 107.627 -2.984 17890 406 1 1 . 1 1 81 81 GLY C C 81 174.979 174.979 174.681 0.298 17890 407 1 1 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.547 -0.459 17890 408 1 1 . 1 1 81 81 GLY H H 81 8.949 8.949 8.403 0.546 17890 409 1 1 . 1 1 82 82 SER N N 82 111.865 111.865 115.913 -4.048 17890 410 1 1 . 1 1 82 82 SER HA H 82 4.646 4.646 4.819 -0.173 17890 411 1 1 . 1 1 82 82 SER CA C 82 55.441 55.441 55.063 0.378 17890 412 1 1 . 1 1 82 82 SER CB C 82 62.277 62.277 63.910 -1.633 17890 413 1 1 . 1 1 82 82 SER H H 82 6.968 6.968 7.228 -0.260 17890 414 1 1 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.525 -0.178 17890 415 1 1 . 1 1 83 83 PRO C C 83 176.660 176.660 176.380 0.280 17890 416 1 1 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.317 0.886 17890 417 1 1 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.874 0.945 17890 418 1 1 . 1 1 84 84 ASN N N 84 116.542 116.542 116.280 0.262 17890 419 1 1 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.720 0.281 17890 420 1 1 . 1 1 84 84 ASN C C 84 175.825 175.825 174.873 0.952 17890 421 1 1 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.654 -0.763 17890 422 1 1 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.473 0.271 17890 423 1 1 . 1 1 84 84 ASN H H 84 8.502 8.502 8.567 -0.065 17890 424 1 1 . 1 1 85 85 SER N N 85 114.633 114.633 112.673 1.960 17890 425 1 1 . 1 1 85 85 SER HA H 85 4.624 4.624 4.888 -0.264 17890 426 1 1 . 1 1 85 85 SER C C 85 172.963 172.963 172.380 0.583 17890 427 1 1 . 1 1 85 85 SER CA C 85 59.210 59.210 57.409 1.801 17890 428 1 1 . 1 1 85 85 SER CB C 85 64.697 64.697 66.196 -1.499 17890 429 1 1 . 1 1 85 85 SER H H 85 7.980 7.980 7.893 0.087 17890 430 1 1 . 1 1 86 86 GLN N N 86 119.016 119.016 117.518 1.498 17890 431 1 1 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.584 -0.138 17890 432 1 1 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.439 0.013 17890 433 1 1 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.521 -0.123 17890 434 1 1 . 1 1 86 86 GLN H H 86 9.399 9.399 9.059 0.340 17890 435 1 1 . 1 1 87 87 ILE N N 87 119.691 119.691 119.156 0.535 17890 436 1 1 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.216 -0.641 17890 437 1 1 . 1 1 87 87 ILE C C 87 176.505 176.505 176.076 0.429 17890 438 1 1 . 1 1 87 87 ILE CA C 87 63.494 63.494 59.004 4.490 17890 439 1 1 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.091 -0.894 17890 440 1 1 . 1 1 87 87 ILE H H 87 8.970 8.970 8.283 0.687 17890 441 1 1 . 1 1 88 88 GLY N N 88 118.378 118.378 114.802 3.576 17890 442 1 1 . 1 1 88 88 GLY C C 88 171.397 171.397 171.669 -0.272 17890 443 1 1 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.016 -1.412 17890 444 1 1 . 1 1 88 88 GLY H H 88 9.752 9.752 9.087 0.665 17890 445 1 1 . 1 1 89 89 TRP N N 89 122.749 122.749 121.962 0.787 17890 446 1 1 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.433 -0.835 17890 447 1 1 . 1 1 89 89 TRP C C 89 175.924 175.924 174.758 1.166 17890 448 1 1 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.053 0.230 17890 449 1 1 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.481 -2.395 17890 450 1 1 . 1 1 89 89 TRP H H 89 8.215 8.215 8.194 0.021 17890 451 1 1 . 1 1 90 90 GLY N N 90 116.305 116.305 110.540 5.765 17890 452 1 1 . 1 1 90 90 GLY C C 90 173.725 173.725 172.409 1.316 17890 453 1 1 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.526 0.529 17890 454 1 1 . 1 1 90 90 GLY H H 90 8.922 8.922 8.185 0.737 17890 455 1 1 . 1 1 91 91 ALA N N 91 123.795 123.795 122.122 1.673 17890 456 1 1 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.161 0.082 17890 457 1 1 . 1 1 91 91 ALA C C 91 178.510 178.510 178.927 -0.417 17890 458 1 1 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.479 0.011 17890 459 1 1 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.746 -0.337 17890 460 1 1 . 1 1 91 91 ALA H H 91 8.367 8.367 8.158 0.209 17890 461 1 1 . 1 1 92 92 GLY N N 92 108.871 108.871 112.910 -4.039 17890 462 1 1 . 1 1 92 92 GLY C C 92 174.528 174.528 174.842 -0.314 17890 463 1 1 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.721 0.537 17890 464 1 1 . 1 1 92 92 GLY H H 92 8.776 8.776 8.620 0.156 17890 465 1 1 . 1 1 93 93 ASN N N 93 114.921 114.921 116.750 -1.829 17890 466 1 1 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.741 -0.292 17890 467 1 1 . 1 1 93 93 ASN C C 93 172.774 172.774 173.850 -1.076 17890 468 1 1 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.162 0.811 17890 469 1 1 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.142 -0.813 17890 470 1 1 . 1 1 93 93 ASN H H 93 8.647 8.647 8.356 0.291 17890 471 1 1 . 1 1 94 94 VAL N N 94 112.437 112.437 118.986 -6.549 17890 472 1 1 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.564 0.501 17890 473 1 1 . 1 1 94 94 VAL CA C 94 56.915 56.915 57.989 -1.074 17890 474 1 1 . 1 1 94 94 VAL CB C 94 34.155 34.155 36.256 -2.101 17890 475 1 1 . 1 1 94 94 VAL H H 94 6.989 6.989 7.513 -0.524 17890 476 1 1 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.995 -0.067 17890 477 1 1 . 1 1 95 95 PRO C C 95 176.041 176.041 175.627 0.414 17890 478 1 1 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.332 -1.131 17890 479 1 1 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.607 -0.882 17890 480 1 1 . 1 1 96 96 VAL N N 96 113.564 113.564 117.555 -3.991 17890 481 1 1 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.920 -0.185 17890 482 1 1 . 1 1 96 96 VAL C C 96 173.656 173.656 175.210 -1.554 17890 483 1 1 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.469 -0.616 17890 484 1 1 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.467 1.686 17890 485 1 1 . 1 1 96 96 VAL H H 96 8.199 8.199 8.895 -0.696 17890 486 1 1 . 1 1 97 97 VAL N N 97 122.328 122.328 122.976 -0.648 17890 487 1 1 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.640 -0.009 17890 488 1 1 . 1 1 97 97 VAL C C 97 174.776 174.776 175.797 -1.021 17890 489 1 1 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.607 0.050 17890 490 1 1 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.818 -0.690 17890 491 1 1 . 1 1 97 97 VAL H H 97 8.957 8.957 8.141 0.816 17890 492 1 1 . 1 1 98 98 LEU N N 98 130.258 130.258 126.324 3.934 17890 493 1 1 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.930 0.120 17890 494 1 1 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.615 1.208 17890 495 1 1 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.241 0.877 17890 496 1 1 . 1 1 98 98 LEU H H 98 9.245 9.245 9.095 0.150 17890 497 1 1 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.764 0.015 17890 498 1 1 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.157 0.332 17890 499 1 1 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.116 -0.662 17890 500 1 1 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.544 -0.559 17890 501 1 1 . 1 1 100 100 PRO C C 100 177.309 177.309 175.801 1.508 17890 502 1 1 . 1 1 100 100 PRO CA C 100 63.824 63.824 62.989 0.835 17890 503 1 1 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.217 -0.112 17890 504 1 1 . 1 1 101 101 ASN N N 101 119.284 119.284 126.050 -6.766 17890 505 1 1 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.648 -0.106 17890 506 1 1 . 1 1 101 101 ASN C C 101 171.920 171.920 173.953 -2.033 17890 507 1 1 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.796 -0.596 17890 508 1 1 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.524 -1.899 17890 509 1 1 . 1 1 101 101 ASN H H 101 7.273 7.273 9.379 -2.106 17890 510 1 1 . 1 1 102 102 ASN N N 102 115.674 115.674 116.225 -0.551 17890 511 1 1 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.706 -0.788 17890 512 1 1 . 1 1 102 102 ASN C C 102 173.264 173.264 174.288 -1.024 17890 513 1 1 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.768 1.271 17890 514 1 1 . 1 1 102 102 ASN CB C 102 36.982 36.982 37.978 -0.996 17890 515 1 1 . 1 1 102 102 ASN H H 102 8.197 8.197 7.840 0.357 17890 516 1 1 . 1 1 103 103 TYR N N 103 118.775 118.775 121.820 -3.045 17890 517 1 1 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.323 0.162 17890 518 1 1 . 1 1 103 103 TYR C C 103 175.248 175.248 175.063 0.185 17890 519 1 1 . 1 1 103 103 TYR CA C 103 57.490 57.490 60.174 -2.684 17890 520 1 1 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.676 -1.144 17890 521 1 1 . 1 1 103 103 TYR H H 103 7.745 7.745 7.407 0.338 17890 522 1 1 . 1 1 104 104 VAL N N 104 116.205 116.205 114.274 1.931 17890 523 1 1 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.999 -0.022 17890 524 1 1 . 1 1 104 104 VAL C C 104 174.361 174.361 173.659 0.702 17890 525 1 1 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.669 -1.418 17890 526 1 1 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.683 -0.140 17890 527 1 1 . 1 1 104 104 VAL H H 104 7.498 7.498 7.971 -0.473 17890 528 1 1 . 1 1 105 105 TRP N N 105 119.557 119.557 119.665 -0.108 17890 529 1 1 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.094 -0.219 17890 530 1 1 . 1 1 105 105 TRP C C 105 175.526 175.526 176.457 -0.931 17890 531 1 1 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.334 -0.450 17890 532 1 1 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.414 0.125 17890 533 1 1 . 1 1 105 105 TRP H H 105 8.926 8.926 8.905 0.021 17890 534 1 1 . 1 1 106 106 THR N N 106 120.480 120.480 120.020 0.460 17890 535 1 1 . 1 1 106 106 THR HA H 106 4.966 4.966 4.647 0.319 17890 536 1 1 . 1 1 106 106 THR C C 106 174.177 174.177 173.993 0.184 17890 537 1 1 . 1 1 106 106 THR CA C 106 62.091 62.091 64.458 -2.367 17890 538 1 1 . 1 1 106 106 THR CB C 106 69.649 69.649 68.936 0.713 17890 539 1 1 . 1 1 106 106 THR H H 106 9.525 9.525 9.060 0.465 17890 540 1 1 . 1 1 107 107 LEU N N 107 127.146 127.146 130.006 -2.860 17890 541 1 1 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.163 -0.336 17890 542 1 1 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.685 0.024 17890 543 1 1 . 1 1 107 107 LEU CB C 107 41.523 41.523 44.119 -2.596 17890 544 1 1 . 1 1 107 107 LEU H H 107 7.591 7.591 9.103 -1.512 17890 545 1 1 . 1 1 108 108 THR N N 108 119.928 119.928 120.318 -0.390 17890 546 1 1 . 1 1 108 108 THR HA H 108 4.411 4.411 4.743 -0.332 17890 547 1 1 . 1 1 108 108 THR C C 108 173.319 173.319 173.080 0.239 17890 548 1 1 . 1 1 108 108 THR CA C 108 62.243 62.243 61.506 0.737 17890 549 1 1 . 1 1 108 108 THR CB C 108 70.138 70.138 71.339 -1.201 17890 550 1 1 . 1 1 108 108 THR H H 108 8.141 8.141 8.628 -0.487 17890 551 1 1 . 1 1 109 109 LEU N N 109 130.557 130.557 129.053 1.504 17890 552 1 1 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.096 -0.551 17890 553 1 1 . 1 1 109 109 LEU C C 109 175.217 175.217 176.556 -1.339 17890 554 1 1 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.114 0.173 17890 555 1 1 . 1 1 109 109 LEU CB C 109 40.606 40.606 43.085 -2.479 17890 556 1 1 . 1 1 109 109 LEU H H 109 8.924 8.924 8.652 0.272 17890 557 1 1 . 1 1 110 110 THR N N 110 120.160 120.160 116.120 4.040 17890 558 1 1 . 1 1 110 110 THR HA H 110 4.911 4.911 4.724 0.187 17890 559 1 1 . 1 1 110 110 THR CA C 110 60.141 60.141 60.078 0.063 17890 560 1 1 . 1 1 110 110 THR CB C 110 72.785 72.785 70.897 1.888 17890 561 1 1 . 1 1 110 110 THR H H 110 7.677 7.677 8.295 -0.618 17890 562 1 1 . 1 1 111 111 SER HA H 111 4.204 4.204 4.289 -0.085 17890 563 1 1 . 1 1 111 111 SER C C 111 174.755 174.755 175.296 -0.541 17890 564 1 1 . 1 1 111 111 SER CA C 111 60.710 60.710 59.371 1.339 17890 565 1 1 . 1 1 111 111 SER CB C 111 62.660 62.660 62.989 -0.329 17890 566 1 1 . 1 1 112 112 GLY N N 112 107.313 107.313 107.900 -0.587 17890 567 1 1 . 1 1 112 112 GLY C C 112 173.023 173.023 172.707 0.316 17890 568 1 1 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.132 -0.982 17890 569 1 1 . 1 1 112 112 GLY H H 112 8.249 8.249 7.559 0.690 17890 570 1 1 . 1 1 113 113 GLY N N 113 105.618 105.618 107.634 -2.016 17890 571 1 1 . 1 1 113 113 GLY C C 113 175.844 175.844 171.699 4.145 17890 572 1 1 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.967 -3.208 17890 573 1 1 . 1 1 113 113 GLY H H 113 7.444 7.444 7.501 -0.057 17890 574 1 1 . 1 1 114 114 TYR N N 114 121.548 121.548 117.841 3.707 17890 575 1 1 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.410 -0.558 17890 576 1 1 . 1 1 114 114 TYR C C 114 175.605 175.605 174.275 1.330 17890 577 1 1 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.492 4.771 17890 578 1 1 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.419 -4.486 17890 579 1 1 . 1 1 114 114 TYR H H 114 9.677 9.677 8.973 0.704 17890 580 1 1 . 1 1 115 115 ASN N N 115 123.274 123.274 117.542 5.732 17890 581 1 1 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.226 -0.128 17890 582 1 1 . 1 1 115 115 ASN C C 115 174.355 174.355 173.135 1.220 17890 583 1 1 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.005 -0.959 17890 584 1 1 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.570 -2.221 17890 585 1 1 . 1 1 115 115 ASN H H 115 9.350 9.350 9.025 0.325 17890 586 1 1 . 1 1 116 116 ILE N N 116 130.611 130.611 122.795 7.816 17890 587 1 1 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.892 -0.653 17890 588 1 1 . 1 1 116 116 ILE C C 116 173.998 173.998 174.137 -0.139 17890 589 1 1 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.930 2.269 17890 590 1 1 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.835 -2.735 17890 591 1 1 . 1 1 116 116 ILE H H 116 9.473 9.473 8.735 0.738 17890 592 1 1 . 1 1 117 117 GLN N N 117 121.633 121.633 124.884 -3.251 17890 593 1 1 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.035 0.900 17890 594 1 1 . 1 1 117 117 GLN C C 117 177.902 177.902 175.976 1.926 17890 595 1 1 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.962 -0.643 17890 596 1 1 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.570 3.887 17890 597 1 1 . 1 1 117 117 GLN H H 117 8.781 8.781 8.661 0.120 17890 598 1 1 . 1 1 118 118 ASP N N 118 116.836 116.836 119.871 -3.035 17890 599 1 1 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.891 0.892 17890 600 1 1 . 1 1 118 118 ASP C C 118 178.084 178.084 176.654 1.430 17890 601 1 1 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.343 -1.573 17890 602 1 1 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.227 -0.859 17890 603 1 1 . 1 1 118 118 ASP H H 118 9.330 9.330 8.495 0.835 17890 604 1 1 . 1 1 119 119 GLY N N 119 111.037 111.037 107.995 3.042 17890 605 1 1 . 1 1 119 119 GLY C C 119 174.196 174.196 175.663 -1.467 17890 606 1 1 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.984 1.992 17890 607 1 1 . 1 1 119 119 GLY H H 119 8.986 8.986 8.339 0.647 17890 608 1 1 . 1 1 120 120 LYS N N 120 114.809 114.809 122.069 -7.260 17890 609 1 1 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.481 -0.132 17890 610 1 1 . 1 1 120 120 LYS C C 120 175.174 175.174 176.386 -1.212 17890 611 1 1 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.489 1.444 17890 612 1 1 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.536 -0.060 17890 613 1 1 . 1 1 120 120 LYS H H 120 7.045 7.045 8.745 -1.700 17890 614 1 1 . 1 1 121 121 ARG N N 121 116.291 116.291 113.816 2.475 17890 615 1 1 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.057 -0.471 17890 616 1 1 . 1 1 121 121 ARG C C 121 175.097 175.097 177.035 -1.938 17890 617 1 1 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.829 1.240 17890 618 1 1 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.815 -0.192 17890 619 1 1 . 1 1 121 121 ARG H H 121 7.683 7.683 8.115 -0.432 17890 620 1 1 . 1 1 122 122 THR N N 122 113.730 113.730 110.066 3.664 17890 621 1 1 . 1 1 122 122 THR HA H 122 4.540 4.540 4.195 0.345 17890 622 1 1 . 1 1 122 122 THR C C 122 175.302 175.302 174.683 0.619 17890 623 1 1 . 1 1 122 122 THR CA C 122 62.871 62.871 64.427 -1.556 17890 624 1 1 . 1 1 122 122 THR CB C 122 71.552 71.552 69.821 1.731 17890 625 1 1 . 1 1 122 122 THR H H 122 11.059 11.059 8.086 2.973 17890 626 1 1 . 1 1 123 123 VAL N N 123 118.350 118.350 113.814 4.536 17890 627 1 1 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.764 0.046 17890 628 1 1 . 1 1 123 123 VAL C C 123 174.730 174.730 173.650 1.080 17890 629 1 1 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.973 0.338 17890 630 1 1 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.897 2.185 17890 631 1 1 . 1 1 123 123 VAL H H 123 8.181 8.181 7.541 0.640 17890 632 1 1 . 1 1 124 124 SER N N 124 113.053 113.053 114.374 -1.321 17890 633 1 1 . 1 1 124 124 SER HA H 124 5.820 5.820 5.197 0.623 17890 634 1 1 . 1 1 124 124 SER C C 124 175.521 175.521 173.550 1.971 17890 635 1 1 . 1 1 124 124 SER CA C 124 58.087 58.087 57.508 0.579 17890 636 1 1 . 1 1 124 124 SER CB C 124 67.405 67.405 66.477 0.928 17890 637 1 1 . 1 1 124 124 SER H H 124 9.138 9.138 8.677 0.461 17890 638 1 1 . 1 1 125 125 TRP N N 125 124.900 124.900 123.356 1.544 17890 639 1 1 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.971 0.639 17890 640 1 1 . 1 1 125 125 TRP C C 125 178.114 178.114 177.568 0.546 17890 641 1 1 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.482 -1.008 17890 642 1 1 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.125 0.898 17890 643 1 1 . 1 1 125 125 TRP H H 125 8.843 8.843 8.167 0.676 17890 644 1 1 . 1 1 126 126 SER N N 126 119.243 119.243 114.075 5.168 17890 645 1 1 . 1 1 126 126 SER HA H 126 5.443 5.443 5.196 0.247 17890 646 1 1 . 1 1 126 126 SER C C 126 171.668 171.668 172.790 -1.122 17890 647 1 1 . 1 1 126 126 SER CA C 126 58.696 58.696 57.188 1.508 17890 648 1 1 . 1 1 126 126 SER CB C 126 66.176 66.176 66.204 -0.028 17890 649 1 1 . 1 1 126 126 SER H H 126 9.835 9.835 9.375 0.460 17890 650 1 1 . 1 1 127 127 LEU N N 127 113.708 113.708 118.856 -5.148 17890 651 1 1 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.724 0.431 17890 652 1 1 . 1 1 127 127 LEU C C 127 176.563 176.563 177.301 -0.738 17890 653 1 1 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.095 -0.450 17890 654 1 1 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.392 -1.696 17890 655 1 1 . 1 1 127 127 LEU H H 127 6.559 6.559 8.296 -1.737 17890 656 1 1 . 1 1 128 128 ASN N N 128 121.739 121.739 119.091 2.648 17890 657 1 1 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.758 -0.069 17890 658 1 1 . 1 1 128 128 ASN C C 128 175.452 175.452 175.324 0.128 17890 659 1 1 . 1 1 128 128 ASN CA C 128 56.007 56.007 55.211 0.796 17890 660 1 1 . 1 1 128 128 ASN CB C 128 39.291 39.291 39.406 -0.115 17890 661 1 1 . 1 1 128 128 ASN H H 128 8.662 8.662 9.093 -0.431 17890 662 1 1 . 1 1 129 129 ASN N N 129 119.586 119.586 115.099 4.487 17890 663 1 1 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.737 0.260 17890 664 1 1 . 1 1 129 129 ASN C C 129 175.900 175.900 174.625 1.275 17890 665 1 1 . 1 1 129 129 ASN CA C 129 54.233 54.233 52.731 1.502 17890 666 1 1 . 1 1 129 129 ASN CB C 129 41.256 41.256 38.312 2.944 17890 667 1 1 . 1 1 129 129 ASN H H 129 10.962 10.962 7.951 3.011 17890 668 1 1 . 1 1 130 130 ALA N N 130 128.292 128.292 121.638 6.654 17890 669 1 1 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.051 -0.481 17890 670 1 1 . 1 1 130 130 ALA C C 130 172.620 172.620 177.654 -5.034 17890 671 1 1 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.241 -0.602 17890 672 1 1 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.205 -1.105 17890 673 1 1 . 1 1 130 130 ALA H H 130 10.629 10.629 8.264 2.365 17890 674 1 1 . 1 1 131 131 THR N N 131 105.584 105.584 111.870 -6.286 17890 675 1 1 . 1 1 131 131 THR HA H 131 4.462 4.462 4.330 0.132 17890 676 1 1 . 1 1 131 131 THR C C 131 173.552 173.552 174.853 -1.301 17890 677 1 1 . 1 1 131 131 THR CA C 131 58.338 58.338 61.332 -2.994 17890 678 1 1 . 1 1 131 131 THR CB C 131 71.569 71.569 70.163 1.406 17890 679 1 1 . 1 1 131 131 THR H H 131 7.092 7.092 8.297 -1.205 17890 680 1 1 . 1 1 132 132 ALA N N 132 121.773 121.773 124.296 -2.523 17890 681 1 1 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.092 -0.343 17890 682 1 1 . 1 1 132 132 ALA C C 132 178.819 178.819 178.026 0.793 17890 683 1 1 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.016 1.268 17890 684 1 1 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.574 -0.347 17890 685 1 1 . 1 1 132 132 ALA H H 132 8.952 8.952 8.319 0.633 17890 686 1 1 . 1 1 133 133 GLY N N 133 113.965 113.965 110.815 3.150 17890 687 1 1 . 1 1 133 133 GLY C C 133 173.453 173.453 174.567 -1.114 17890 688 1 1 . 1 1 133 133 GLY CA C 133 45.166 45.166 45.079 0.087 17890 689 1 1 . 1 1 133 133 GLY H H 133 9.016 9.016 8.377 0.639 17890 690 1 1 . 1 1 134 134 GLU N N 134 123.460 123.460 121.641 1.819 17890 691 1 1 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.367 -0.409 17890 692 1 1 . 1 1 134 134 GLU C C 134 176.120 176.120 175.491 0.629 17890 693 1 1 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.478 1.921 17890 694 1 1 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.728 0.657 17890 695 1 1 . 1 1 134 134 GLU H H 134 7.598 7.598 7.760 -0.162 17890 696 1 1 . 1 1 135 135 GLU N N 135 122.633 122.633 123.820 -1.187 17890 697 1 1 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.247 0.064 17890 698 1 1 . 1 1 135 135 GLU C C 135 176.014 176.014 176.275 -0.261 17890 699 1 1 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.002 0.180 17890 700 1 1 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.238 -0.785 17890 701 1 1 . 1 1 135 135 GLU H H 135 8.258 8.258 8.562 -0.304 17890 702 1 1 . 1 1 136 136 VAL N N 136 123.635 123.635 125.890 -2.255 17890 703 1 1 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.864 -0.172 17890 704 1 1 . 1 1 136 136 VAL C C 136 173.932 173.932 175.144 -1.212 17890 705 1 1 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.239 0.593 17890 706 1 1 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.688 -0.824 17890 707 1 1 . 1 1 136 136 VAL H H 136 7.267 7.267 8.422 -1.155 17890 708 1 1 . 1 1 137 137 SER N N 137 118.950 118.950 121.068 -2.118 17890 709 1 1 . 1 1 137 137 SER HA H 137 4.887 4.887 5.060 -0.173 17890 710 1 1 . 1 1 137 137 SER C C 137 173.780 173.780 172.962 0.818 17890 711 1 1 . 1 1 137 137 SER CA C 137 57.895 57.895 56.887 1.008 17890 712 1 1 . 1 1 137 137 SER CB C 137 65.027 65.027 66.848 -1.821 17890 713 1 1 . 1 1 137 137 SER H H 137 8.454 8.454 8.687 -0.233 17890 714 1 1 . 1 1 138 138 ILE N N 138 123.511 123.511 119.511 4.000 17890 715 1 1 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.051 -0.803 17890 716 1 1 . 1 1 138 138 ILE C C 138 176.142 176.142 175.693 0.449 17890 717 1 1 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.372 1.478 17890 718 1 1 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.520 -2.925 17890 719 1 1 . 1 1 138 138 ILE H H 138 7.915 7.915 8.386 -0.471 17890 720 1 1 . 1 1 139 139 GLY N N 139 115.638 115.638 111.041 4.597 17890 721 1 1 . 1 1 139 139 GLY C C 139 171.947 171.947 172.171 -0.224 17890 722 1 1 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.215 1.871 17890 723 1 1 . 1 1 139 139 GLY H H 139 8.490 8.490 8.414 0.076 17890 724 1 1 . 1 1 140 140 ALA N N 140 128.563 128.563 122.014 6.549 17890 725 1 1 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.207 0.189 17890 726 1 1 . 1 1 140 140 ALA C C 140 177.956 177.956 177.422 0.534 17890 727 1 1 . 1 1 140 140 ALA CA C 140 52.646 52.646 52.594 0.052 17890 728 1 1 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.343 -0.139 17890 729 1 1 . 1 1 140 140 ALA H H 140 8.531 8.531 8.187 0.344 17890 730 1 1 . 1 1 141 141 ASP N N 141 120.886 120.886 122.139 -1.253 17890 731 1 1 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.414 0.184 17890 732 1 1 . 1 1 141 141 ASP C C 141 175.411 175.411 176.137 -0.726 17890 733 1 1 . 1 1 141 141 ASP CA C 141 53.916 53.916 54.737 -0.821 17890 734 1 1 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.015 -0.323 17890 735 1 1 . 1 1 141 141 ASP H H 141 8.507 8.507 8.467 0.040 17890 736 1 1 . 1 1 142 142 ALA N N 142 125.604 125.604 128.665 -3.061 17890 737 1 1 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.346 0.171 17890 738 1 1 . 1 1 142 142 ALA C C 142 177.671 177.671 178.071 -0.400 17890 739 1 1 . 1 1 142 142 ALA CA C 142 51.993 51.993 52.026 -0.033 17890 740 1 1 . 1 1 142 142 ALA CB C 142 21.535 21.535 19.807 1.728 17890 741 1 1 . 1 1 142 142 ALA H H 142 7.894 7.894 8.399 -0.505 17890 742 1 1 . 1 1 143 143 THR N N 143 118.085 118.085 115.270 2.815 17890 743 1 1 . 1 1 143 143 THR HA H 143 3.744 3.744 4.196 -0.452 17890 744 1 1 . 1 1 143 143 THR C C 143 175.464 175.464 175.127 0.337 17890 745 1 1 . 1 1 143 143 THR CA C 143 64.548 64.548 63.931 0.617 17890 746 1 1 . 1 1 143 143 THR CB C 143 69.305 69.305 68.696 0.609 17890 747 1 1 . 1 1 143 143 THR H H 143 8.268 8.268 8.751 -0.483 17890 748 1 1 . 1 1 144 144 PHE N N 144 118.635 118.635 117.951 0.684 17890 749 1 1 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.791 -0.445 17890 750 1 1 . 1 1 144 144 PHE C C 144 176.209 176.209 175.281 0.928 17890 751 1 1 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.582 3.880 17890 752 1 1 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.733 -0.129 17890 753 1 1 . 1 1 144 144 PHE H H 144 8.719 8.719 7.742 0.977 17890 754 1 1 . 1 1 145 145 SER N N 145 113.446 113.446 115.444 -1.998 17890 755 1 1 . 1 1 145 145 SER HA H 145 4.866 4.866 4.284 0.582 17890 756 1 1 . 1 1 145 145 SER C C 145 176.605 176.605 175.949 0.656 17890 757 1 1 . 1 1 145 145 SER CA C 145 59.432 59.432 57.684 1.748 17890 758 1 1 . 1 1 145 145 SER CB C 145 62.167 62.167 63.555 -1.388 17890 759 1 1 . 1 1 145 145 SER H H 145 8.657 8.657 7.244 1.413 17890 760 1 1 . 1 1 146 146 GLY N N 146 109.277 109.277 110.206 -0.929 17890 761 1 1 . 1 1 146 146 GLY C C 146 174.293 174.293 173.231 1.062 17890 762 1 1 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.377 -0.437 17890 763 1 1 . 1 1 146 146 GLY H H 146 7.467 7.467 8.105 -0.638 17890 764 1 1 . 1 1 147 147 ARG N N 147 122.863 122.863 116.325 6.538 17890 765 1 1 . 1 1 147 147 ARG HA H 147 5.441 5.441 5.174 0.267 17890 766 1 1 . 1 1 147 147 ARG C C 147 173.849 173.849 174.372 -0.523 17890 767 1 1 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.015 -1.788 17890 768 1 1 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.121 -0.524 17890 769 1 1 . 1 1 147 147 ARG H H 147 7.556 7.556 7.068 0.488 17890 770 1 1 . 1 1 148 148 TRP N N 148 118.465 118.465 120.410 -1.945 17890 771 1 1 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.230 -0.384 17890 772 1 1 . 1 1 148 148 TRP C C 148 174.353 174.353 174.283 0.070 17890 773 1 1 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.976 -1.314 17890 774 1 1 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.545 -1.546 17890 775 1 1 . 1 1 148 148 TRP H H 148 8.709 8.709 9.230 -0.521 17890 776 1 1 . 1 1 149 149 VAL N N 149 125.852 125.852 117.967 7.885 17890 777 1 1 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.489 -0.346 17890 778 1 1 . 1 1 149 149 VAL C C 149 173.613 173.613 173.302 0.311 17890 779 1 1 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.911 1.829 17890 780 1 1 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.155 -2.772 17890 781 1 1 . 1 1 149 149 VAL H H 149 9.700 9.700 8.733 0.967 17890 782 1 1 . 1 1 150 150 ILE N N 150 125.140 125.140 128.007 -2.867 17890 783 1 1 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.094 -0.232 17890 784 1 1 . 1 1 150 150 ILE C C 150 175.661 175.661 174.916 0.745 17890 785 1 1 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.477 1.344 17890 786 1 1 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.849 -1.029 17890 787 1 1 . 1 1 150 150 ILE H H 150 7.747 7.747 7.705 0.042 17890 788 1 1 . 1 1 151 151 GLU N N 151 126.762 126.762 128.494 -1.732 17890 789 1 1 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.871 0.009 17890 790 1 1 . 1 1 151 151 GLU C C 151 174.424 174.424 174.780 -0.356 17890 791 1 1 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.832 0.964 17890 792 1 1 . 1 1 151 151 GLU CB C 151 34.251 34.251 34.069 0.182 17890 793 1 1 . 1 1 151 151 GLU H H 151 8.892 8.892 8.878 0.014 17890 794 1 1 . 1 1 152 152 LYS N N 152 126.299 126.299 122.533 3.766 17890 795 1 1 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.840 0.021 17890 796 1 1 . 1 1 152 152 LYS C C 152 176.282 176.282 176.719 -0.437 17890 797 1 1 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.879 0.626 17890 798 1 1 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.637 0.699 17890 799 1 1 . 1 1 152 152 LYS H H 152 8.640 8.640 8.360 0.280 17890 800 1 2 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.425 -2.131 17890 801 1 2 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.782 -0.160 17890 802 1 2 . 1 1 8 8 HIS CA C 8 55.661 55.661 56.770 -1.109 17890 803 1 2 . 1 1 8 8 HIS CB C 8 29.880 29.880 32.433 -2.553 17890 804 1 2 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.586 0.060 17890 805 1 2 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.316 -0.632 17890 806 1 2 . 1 1 9 9 HIS CB C 9 29.831 29.831 32.153 -2.322 17890 807 1 2 . 1 1 10 10 HIS N N 10 120.811 120.811 116.853 3.958 17890 808 1 2 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.670 0.010 17890 809 1 2 . 1 1 10 10 HIS C C 10 174.875 174.875 174.797 0.078 17890 810 1 2 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.309 -0.563 17890 811 1 2 . 1 1 10 10 HIS CB C 10 29.889 29.889 31.161 -1.272 17890 812 1 2 . 1 1 10 10 HIS H H 10 8.583 8.583 8.220 0.363 17890 813 1 2 . 1 1 11 11 SER N N 11 118.009 118.009 113.214 4.795 17890 814 1 2 . 1 1 11 11 SER HA H 11 4.424 4.424 4.512 -0.088 17890 815 1 2 . 1 1 11 11 SER C C 11 174.962 174.962 174.729 0.233 17890 816 1 2 . 1 1 11 11 SER CA C 11 58.660 58.660 58.433 0.227 17890 817 1 2 . 1 1 11 11 SER CB C 11 63.822 63.822 63.880 -0.058 17890 818 1 2 . 1 1 11 11 SER H H 11 8.438 8.438 8.117 0.321 17890 819 1 2 . 1 1 12 12 GLY N N 12 111.011 111.011 108.322 2.689 17890 820 1 2 . 1 1 12 12 GLY C C 12 173.907 173.907 173.381 0.526 17890 821 1 2 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.093 0.328 17890 822 1 2 . 1 1 12 12 GLY H H 12 8.433 8.433 8.038 0.395 17890 823 1 2 . 1 1 13 13 ASP N N 13 120.291 120.291 119.791 0.500 17890 824 1 2 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.742 -0.080 17890 825 1 2 . 1 1 13 13 ASP C C 13 176.115 176.115 175.346 0.769 17890 826 1 2 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.576 0.727 17890 827 1 2 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.337 0.129 17890 828 1 2 . 1 1 13 13 ASP H H 13 8.153 8.153 8.032 0.121 17890 829 1 2 . 1 1 14 14 SER N N 14 116.987 116.987 115.398 1.589 17890 830 1 2 . 1 1 14 14 SER HA H 14 4.754 4.754 4.810 -0.056 17890 831 1 2 . 1 1 14 14 SER CA C 14 56.469 56.469 55.980 0.489 17890 832 1 2 . 1 1 14 14 SER CB C 14 63.553 63.553 64.371 -0.818 17890 833 1 2 . 1 1 14 14 SER H H 14 8.210 8.210 7.429 0.781 17890 834 1 2 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.585 -0.143 17890 835 1 2 . 1 1 15 15 PRO C C 15 176.424 176.424 175.922 0.502 17890 836 1 2 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.767 0.466 17890 837 1 2 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.438 -0.290 17890 838 1 2 . 1 1 16 16 ALA N N 16 124.219 124.219 123.415 0.804 17890 839 1 2 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.421 -0.071 17890 840 1 2 . 1 1 16 16 ALA C C 16 177.552 177.552 176.355 1.197 17890 841 1 2 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.240 0.193 17890 842 1 2 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.599 -0.280 17890 843 1 2 . 1 1 16 16 ALA H H 16 8.284 8.284 8.399 -0.115 17890 844 1 2 . 1 1 17 17 VAL N N 17 119.504 119.504 120.089 -0.585 17890 845 1 2 . 1 1 17 17 VAL HA H 17 4.249 4.249 3.980 0.269 17890 846 1 2 . 1 1 17 17 VAL C C 17 176.322 176.322 176.916 -0.594 17890 847 1 2 . 1 1 17 17 VAL CA C 17 62.278 62.278 63.352 -1.074 17890 848 1 2 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.355 0.602 17890 849 1 2 . 1 1 17 17 VAL H H 17 8.046 8.046 7.670 0.376 17890 850 1 2 . 1 1 18 18 THR N N 18 118.186 118.186 121.275 -3.089 17890 851 1 2 . 1 1 18 18 THR HA H 18 4.473 4.473 4.513 -0.040 17890 852 1 2 . 1 1 18 18 THR C C 18 174.248 174.248 174.669 -0.421 17890 853 1 2 . 1 1 18 18 THR CA C 18 61.565 61.565 61.988 -0.423 17890 854 1 2 . 1 1 18 18 THR CB C 18 70.165 70.165 69.093 1.072 17890 855 1 2 . 1 1 18 18 THR H H 18 8.276 8.276 8.774 -0.498 17890 856 1 2 . 1 1 19 19 LEU N N 19 125.265 125.265 121.464 3.801 17890 857 1 2 . 1 1 19 19 LEU HA H 19 4.293 4.293 4.168 0.125 17890 858 1 2 . 1 1 19 19 LEU C C 19 175.689 175.689 176.918 -1.229 17890 859 1 2 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.454 -0.027 17890 860 1 2 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.937 1.342 17890 861 1 2 . 1 1 19 19 LEU H H 19 8.091 8.091 7.901 0.190 17890 862 1 2 . 1 1 20 20 SER N N 20 114.622 114.622 114.599 0.023 17890 863 1 2 . 1 1 20 20 SER HA H 20 4.947 4.947 4.875 0.072 17890 864 1 2 . 1 1 20 20 SER C C 20 174.220 174.220 172.908 1.312 17890 865 1 2 . 1 1 20 20 SER CA C 20 56.583 56.583 57.279 -0.696 17890 866 1 2 . 1 1 20 20 SER CB C 20 65.653 65.653 65.313 0.340 17890 867 1 2 . 1 1 20 20 SER H H 20 7.316 7.316 7.966 -0.650 17890 868 1 2 . 1 1 21 21 ALA N N 21 125.517 125.517 124.126 1.391 17890 869 1 2 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.856 -0.188 17890 870 1 2 . 1 1 21 21 ALA C C 21 177.960 177.960 177.397 0.563 17890 871 1 2 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.398 1.612 17890 872 1 2 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.016 0.209 17890 873 1 2 . 1 1 21 21 ALA H H 21 8.993 8.993 8.608 0.385 17890 874 1 2 . 1 1 22 22 GLY N N 22 109.543 109.543 111.457 -1.914 17890 875 1 2 . 1 1 22 22 GLY C C 22 170.422 170.422 171.739 -1.317 17890 876 1 2 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.312 0.069 17890 877 1 2 . 1 1 22 22 GLY H H 22 8.411 8.411 9.015 -0.604 17890 878 1 2 . 1 1 23 23 ASN N N 23 119.649 119.649 118.806 0.843 17890 879 1 2 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.704 0.183 17890 880 1 2 . 1 1 23 23 ASN C C 23 175.207 175.207 174.555 0.652 17890 881 1 2 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.526 -0.705 17890 882 1 2 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.570 -0.815 17890 883 1 2 . 1 1 23 23 ASN H H 23 8.092 8.092 8.420 -0.328 17890 884 1 2 . 1 1 24 24 TYR N N 24 120.889 120.889 121.734 -0.845 17890 885 1 2 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.173 0.082 17890 886 1 2 . 1 1 24 24 TYR C C 24 175.667 175.667 174.481 1.186 17890 887 1 2 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.229 0.884 17890 888 1 2 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.664 0.162 17890 889 1 2 . 1 1 24 24 TYR H H 24 9.914 9.914 8.998 0.916 17890 890 1 2 . 1 1 25 25 ILE N N 25 115.978 115.978 113.664 2.314 17890 891 1 2 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.042 0.044 17890 892 1 2 . 1 1 25 25 ILE C C 25 175.200 175.200 174.196 1.004 17890 893 1 2 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.679 0.866 17890 894 1 2 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.755 -0.633 17890 895 1 2 . 1 1 25 25 ILE H H 25 9.216 9.216 9.315 -0.099 17890 896 1 2 . 1 1 26 26 ILE N N 26 123.957 123.957 122.764 1.193 17890 897 1 2 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.225 -0.249 17890 898 1 2 . 1 1 26 26 ILE C C 26 174.810 174.810 174.890 -0.080 17890 899 1 2 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.313 0.296 17890 900 1 2 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.168 0.954 17890 901 1 2 . 1 1 26 26 ILE H H 26 9.559 9.559 9.006 0.553 17890 902 1 2 . 1 1 27 27 TYR N N 27 121.371 121.371 124.060 -2.689 17890 903 1 2 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.567 0.623 17890 904 1 2 . 1 1 27 27 TYR C C 27 173.963 173.963 173.479 0.484 17890 905 1 2 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.840 -0.171 17890 906 1 2 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.054 0.644 17890 907 1 2 . 1 1 27 27 TYR H H 27 9.378 9.378 9.103 0.275 17890 908 1 2 . 1 1 28 28 ASN N N 28 121.991 121.991 120.240 1.751 17890 909 1 2 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.106 -0.338 17890 910 1 2 . 1 1 28 28 ASN C C 28 174.352 174.352 176.148 -1.796 17890 911 1 2 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.899 2.221 17890 912 1 2 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.768 1.678 17890 913 1 2 . 1 1 28 28 ASN H H 28 8.466 8.466 8.472 -0.006 17890 914 1 2 . 1 1 29 29 ARG N N 29 121.103 121.103 127.047 -5.944 17890 915 1 2 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.054 -0.193 17890 916 1 2 . 1 1 29 29 ARG C C 29 173.635 173.635 177.476 -3.841 17890 917 1 2 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.304 0.989 17890 918 1 2 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.148 0.251 17890 919 1 2 . 1 1 29 29 ARG H H 29 7.756 7.756 8.351 -0.595 17890 920 1 2 . 1 1 30 30 VAL N N 30 118.412 118.412 116.832 1.580 17890 921 1 2 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.839 0.105 17890 922 1 2 . 1 1 30 30 VAL C C 30 176.199 176.199 176.055 0.144 17890 923 1 2 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.778 -1.201 17890 924 1 2 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.139 -1.917 17890 925 1 2 . 1 1 30 30 VAL H H 30 8.976 8.976 7.685 1.291 17890 926 1 2 . 1 1 31 31 LEU N N 31 125.418 125.418 114.674 10.744 17890 927 1 2 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.018 0.467 17890 928 1 2 . 1 1 31 31 LEU C C 31 179.123 179.123 175.959 3.164 17890 929 1 2 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.428 -1.403 17890 930 1 2 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.078 4.503 17890 931 1 2 . 1 1 31 31 LEU H H 31 8.856 8.856 7.476 1.380 17890 932 1 2 . 1 1 32 32 SER N N 32 116.890 116.890 115.933 0.957 17890 933 1 2 . 1 1 32 32 SER HA H 32 5.365 5.365 4.853 0.512 17890 934 1 2 . 1 1 32 32 SER CA C 32 57.269 57.269 55.888 1.381 17890 935 1 2 . 1 1 32 32 SER CB C 32 62.213 62.213 64.682 -2.469 17890 936 1 2 . 1 1 32 32 SER H H 32 9.307 9.307 8.335 0.972 17890 937 1 2 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.364 -0.484 17890 938 1 2 . 1 1 33 33 PRO C C 33 175.137 175.137 177.593 -2.456 17890 939 1 2 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.479 0.806 17890 940 1 2 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.678 0.353 17890 941 1 2 . 1 1 34 34 ARG N N 34 110.279 110.279 118.714 -8.435 17890 942 1 2 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.235 0.257 17890 943 1 2 . 1 1 34 34 ARG C C 34 176.844 176.844 177.193 -0.349 17890 944 1 2 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.915 -1.479 17890 945 1 2 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.406 0.178 17890 946 1 2 . 1 1 34 34 ARG H H 34 7.257 7.257 7.753 -0.496 17890 947 1 2 . 1 1 35 35 GLY N N 35 110.288 110.288 105.712 4.576 17890 948 1 2 . 1 1 35 35 GLY C C 35 173.336 173.336 173.938 -0.602 17890 949 1 2 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.959 2.071 17890 950 1 2 . 1 1 35 35 GLY H H 35 8.589 8.589 7.972 0.617 17890 951 1 2 . 1 1 36 36 GLU N N 36 116.838 116.838 118.215 -1.377 17890 952 1 2 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.610 -0.262 17890 953 1 2 . 1 1 36 36 GLU C C 36 176.915 176.915 175.164 1.751 17890 954 1 2 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.445 0.462 17890 955 1 2 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.706 -2.291 17890 956 1 2 . 1 1 36 36 GLU H H 36 7.769 7.769 7.834 -0.065 17890 957 1 2 . 1 1 37 37 LYS N N 37 123.775 123.775 119.668 4.107 17890 958 1 2 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.143 0.280 17890 959 1 2 . 1 1 37 37 LYS C C 37 176.067 176.067 175.340 0.727 17890 960 1 2 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.260 -0.359 17890 961 1 2 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.165 1.509 17890 962 1 2 . 1 1 37 37 LYS H H 37 8.667 8.667 8.592 0.075 17890 963 1 2 . 1 1 38 38 LEU N N 38 126.658 126.658 126.084 0.574 17890 964 1 2 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.946 -0.719 17890 965 1 2 . 1 1 38 38 LEU C C 38 174.332 174.332 175.192 -0.860 17890 966 1 2 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.634 -0.291 17890 967 1 2 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.803 -1.152 17890 968 1 2 . 1 1 38 38 LEU H H 38 10.455 10.455 8.947 1.508 17890 969 1 2 . 1 1 39 39 ALA N N 39 127.018 127.018 127.439 -0.421 17890 970 1 2 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.223 0.006 17890 971 1 2 . 1 1 39 39 ALA C C 39 178.694 178.694 176.211 2.483 17890 972 1 2 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.390 -0.165 17890 973 1 2 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.570 0.779 17890 974 1 2 . 1 1 39 39 ALA H H 39 8.773 8.773 8.742 0.031 17890 975 1 2 . 1 1 40 40 LEU N N 40 126.771 126.771 123.464 3.307 17890 976 1 2 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.644 -0.290 17890 977 1 2 . 1 1 40 40 LEU C C 40 178.309 178.309 176.613 1.696 17890 978 1 2 . 1 1 40 40 LEU CA C 40 56.845 56.845 55.923 0.922 17890 979 1 2 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.996 0.327 17890 980 1 2 . 1 1 40 40 LEU H H 40 9.665 9.665 8.700 0.965 17890 981 1 2 . 1 1 41 41 THR N N 41 126.578 126.578 124.790 1.788 17890 982 1 2 . 1 1 41 41 THR HA H 41 4.916 4.916 5.137 -0.221 17890 983 1 2 . 1 1 41 41 THR C C 41 172.547 172.547 173.652 -1.105 17890 984 1 2 . 1 1 41 41 THR CA C 41 63.253 63.253 61.611 1.642 17890 985 1 2 . 1 1 41 41 THR CB C 41 71.832 71.832 70.112 1.720 17890 986 1 2 . 1 1 41 41 THR H H 41 9.802 9.802 9.097 0.705 17890 987 1 2 . 1 1 42 42 TYR N N 42 130.506 130.506 129.609 0.897 17890 988 1 2 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.574 0.528 17890 989 1 2 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.581 -3.595 17890 990 1 2 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.559 -0.404 17890 991 1 2 . 1 1 42 42 TYR H H 42 9.428 9.428 8.918 0.510 17890 992 1 2 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.313 0.177 17890 993 1 2 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.098 0.475 17890 994 1 2 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.230 0.414 17890 995 1 2 . 1 1 44 44 GLY N N 44 113.736 113.736 105.677 8.059 17890 996 1 2 . 1 1 44 44 GLY C C 44 171.790 171.790 173.085 -1.295 17890 997 1 2 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.928 0.788 17890 998 1 2 . 1 1 44 44 GLY H H 44 8.337 8.337 7.372 0.965 17890 999 1 2 . 1 1 45 45 ARG N N 45 113.899 113.899 116.825 -2.926 17890 1000 1 2 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.512 0.064 17890 1001 1 2 . 1 1 45 45 ARG C C 45 175.151 175.151 173.874 1.277 17890 1002 1 2 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.463 -0.298 17890 1003 1 2 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.998 1.221 17890 1004 1 2 . 1 1 45 45 ARG H H 45 6.463 6.463 7.328 -0.865 17890 1005 1 2 . 1 1 46 46 GLN N N 46 119.000 119.000 118.977 0.023 17890 1006 1 2 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.457 -0.008 17890 1007 1 2 . 1 1 46 46 GLN C C 46 177.282 177.282 176.709 0.573 17890 1008 1 2 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.335 1.278 17890 1009 1 2 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.407 1.089 17890 1010 1 2 . 1 1 46 46 GLN H H 46 8.683 8.683 8.511 0.172 17890 1011 1 2 . 1 1 47 47 ARG N N 47 113.526 113.526 116.610 -3.084 17890 1012 1 2 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.077 -0.547 17890 1013 1 2 . 1 1 47 47 ARG C C 47 174.130 174.130 175.158 -1.028 17890 1014 1 2 . 1 1 47 47 ARG CA C 47 58.816 58.816 56.987 1.829 17890 1015 1 2 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.155 1.915 17890 1016 1 2 . 1 1 47 47 ARG H H 47 9.677 9.677 8.731 0.946 17890 1017 1 2 . 1 1 48 48 THR N N 48 114.672 114.672 115.014 -0.342 17890 1018 1 2 . 1 1 48 48 THR HA H 48 4.938 4.938 4.760 0.178 17890 1019 1 2 . 1 1 48 48 THR CA C 48 59.987 59.987 59.569 0.418 17890 1020 1 2 . 1 1 48 48 THR CB C 48 71.947 71.947 70.771 1.176 17890 1021 1 2 . 1 1 48 48 THR H H 48 8.104 8.104 7.618 0.486 17890 1022 1 2 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.692 -0.324 17890 1023 1 2 . 1 1 49 49 PRO C C 49 175.651 175.651 176.516 -0.865 17890 1024 1 2 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.925 1.256 17890 1025 1 2 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.239 0.458 17890 1026 1 2 . 1 1 50 50 VAL N N 50 122.562 122.562 120.085 2.477 17890 1027 1 2 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.281 -0.334 17890 1028 1 2 . 1 1 50 50 VAL C C 50 174.493 174.493 176.032 -1.539 17890 1029 1 2 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.327 2.484 17890 1030 1 2 . 1 1 50 50 VAL CB C 50 32.168 32.168 33.330 -1.162 17890 1031 1 2 . 1 1 50 50 VAL H H 50 8.123 8.123 8.194 -0.071 17890 1032 1 2 . 1 1 51 51 THR N N 51 113.549 113.549 118.309 -4.760 17890 1033 1 2 . 1 1 51 51 THR HA H 51 5.372 5.372 4.887 0.485 17890 1034 1 2 . 1 1 51 51 THR C C 51 174.841 174.841 172.912 1.929 17890 1035 1 2 . 1 1 51 51 THR CA C 51 59.196 59.196 60.898 -1.702 17890 1036 1 2 . 1 1 51 51 THR CB C 51 72.703 72.703 71.980 0.723 17890 1037 1 2 . 1 1 51 51 THR H H 51 7.057 7.057 8.428 -1.371 17890 1038 1 2 . 1 1 52 52 VAL N N 52 107.374 107.374 120.202 -12.828 17890 1039 1 2 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.086 0.428 17890 1040 1 2 . 1 1 52 52 VAL C C 52 175.697 175.697 174.008 1.689 17890 1041 1 2 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.992 -1.520 17890 1042 1 2 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.551 -0.777 17890 1043 1 2 . 1 1 52 52 VAL H H 52 8.062 8.062 8.407 -0.345 17890 1044 1 2 . 1 1 53 53 SER N N 53 114.662 114.662 120.397 -5.735 17890 1045 1 2 . 1 1 53 53 SER HA H 53 4.690 4.690 4.970 -0.280 17890 1046 1 2 . 1 1 53 53 SER CA C 53 56.828 56.828 56.368 0.460 17890 1047 1 2 . 1 1 53 53 SER CB C 53 64.789 64.789 65.868 -1.079 17890 1048 1 2 . 1 1 53 53 SER H H 53 8.681 8.681 9.149 -0.468 17890 1049 1 2 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.696 0.080 17890 1050 1 2 . 1 1 54 54 PRO C C 54 177.724 177.724 176.742 0.982 17890 1051 1 2 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.546 0.879 17890 1052 1 2 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.014 0.083 17890 1053 1 2 . 1 1 55 55 LEU N N 55 128.655 128.655 125.082 3.573 17890 1054 1 2 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.440 0.087 17890 1055 1 2 . 1 1 55 55 LEU C C 55 178.696 178.696 176.917 1.779 17890 1056 1 2 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.124 0.122 17890 1057 1 2 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.867 0.738 17890 1058 1 2 . 1 1 55 55 LEU H H 55 8.675 8.675 8.203 0.472 17890 1059 1 2 . 1 1 56 56 ASP N N 56 126.651 126.651 125.380 1.271 17890 1060 1 2 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.721 -0.012 17890 1061 1 2 . 1 1 56 56 ASP C C 56 177.729 177.729 176.873 0.856 17890 1062 1 2 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.908 -0.285 17890 1063 1 2 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.237 0.395 17890 1064 1 2 . 1 1 56 56 ASP H H 56 9.683 9.683 8.432 1.251 17890 1065 1 2 . 1 1 57 57 GLY N N 57 109.299 109.299 107.894 1.405 17890 1066 1 2 . 1 1 57 57 GLY C C 57 174.558 174.558 174.283 0.275 17890 1067 1 2 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.344 0.611 17890 1068 1 2 . 1 1 57 57 GLY H H 57 8.157 8.157 8.249 -0.092 17890 1069 1 2 . 1 1 58 58 SER N N 58 116.740 116.740 115.629 1.111 17890 1070 1 2 . 1 1 58 58 SER HA H 58 4.288 4.288 4.571 -0.283 17890 1071 1 2 . 1 1 58 58 SER C C 58 177.252 177.252 176.367 0.885 17890 1072 1 2 . 1 1 58 58 SER CA C 58 58.737 58.737 56.620 2.117 17890 1073 1 2 . 1 1 58 58 SER CB C 58 64.576 64.576 64.013 0.563 17890 1074 1 2 . 1 1 58 58 SER H H 58 8.328 8.328 7.830 0.498 17890 1075 1 2 . 1 1 59 59 SER N N 59 119.768 119.768 122.787 -3.019 17890 1076 1 2 . 1 1 59 59 SER HA H 59 4.046 4.046 4.189 -0.143 17890 1077 1 2 . 1 1 59 59 SER C C 59 176.671 176.671 176.112 0.559 17890 1078 1 2 . 1 1 59 59 SER CA C 59 61.691 61.691 60.056 1.635 17890 1079 1 2 . 1 1 59 59 SER CB C 59 63.154 63.154 62.808 0.346 17890 1080 1 2 . 1 1 59 59 SER H H 59 9.020 9.020 8.923 0.097 17890 1081 1 2 . 1 1 60 60 GLU N N 60 119.133 119.133 121.751 -2.618 17890 1082 1 2 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.081 0.105 17890 1083 1 2 . 1 1 60 60 GLU C C 60 177.435 177.435 176.990 0.445 17890 1084 1 2 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.448 1.585 17890 1085 1 2 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.709 -1.483 17890 1086 1 2 . 1 1 60 60 GLU H H 60 8.832 8.832 7.726 1.106 17890 1087 1 2 . 1 1 61 61 GLN N N 61 118.818 118.818 115.094 3.724 17890 1088 1 2 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.997 0.180 17890 1089 1 2 . 1 1 61 61 GLN C C 61 173.254 173.254 174.765 -1.511 17890 1090 1 2 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.648 -0.275 17890 1091 1 2 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.405 -2.483 17890 1092 1 2 . 1 1 61 61 GLN H H 61 7.648 7.648 7.544 0.104 17890 1093 1 2 . 1 1 62 62 ALA N N 62 122.562 122.562 122.468 0.094 17890 1094 1 2 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.606 0.458 17890 1095 1 2 . 1 1 62 62 ALA C C 62 176.637 176.637 175.200 1.437 17890 1096 1 2 . 1 1 62 62 ALA CA C 62 51.179 51.179 50.887 0.292 17890 1097 1 2 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.466 -0.871 17890 1098 1 2 . 1 1 62 62 ALA H H 62 7.315 7.315 6.996 0.319 17890 1099 1 2 . 1 1 63 63 TRP N N 63 124.787 124.787 119.614 5.173 17890 1100 1 2 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.316 -0.352 17890 1101 1 2 . 1 1 63 63 TRP C C 63 174.351 174.351 175.279 -0.928 17890 1102 1 2 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.155 -0.253 17890 1103 1 2 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.806 -1.688 17890 1104 1 2 . 1 1 63 63 TRP H H 63 9.544 9.544 9.038 0.506 17890 1105 1 2 . 1 1 64 64 ILE N N 64 122.482 122.482 119.196 3.286 17890 1106 1 2 . 1 1 64 64 ILE HA H 64 4.694 4.694 5.023 -0.329 17890 1107 1 2 . 1 1 64 64 ILE C C 64 177.078 177.078 174.248 2.830 17890 1108 1 2 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.580 0.452 17890 1109 1 2 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.356 -0.987 17890 1110 1 2 . 1 1 64 64 ILE H H 64 10.235 10.235 9.407 0.828 17890 1111 1 2 . 1 1 65 65 LEU N N 65 132.183 132.183 128.782 3.401 17890 1112 1 2 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.547 -0.082 17890 1113 1 2 . 1 1 65 65 LEU C C 65 177.048 177.048 174.497 2.551 17890 1114 1 2 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.827 0.522 17890 1115 1 2 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.122 -3.778 17890 1116 1 2 . 1 1 65 65 LEU H H 65 9.432 9.432 9.278 0.154 17890 1117 1 2 . 1 1 66 66 ARG N N 66 120.807 120.807 125.688 -4.881 17890 1118 1 2 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.938 -0.050 17890 1119 1 2 . 1 1 66 66 ARG C C 66 175.275 175.275 174.311 0.964 17890 1120 1 2 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.619 0.436 17890 1121 1 2 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.459 -1.468 17890 1122 1 2 . 1 1 66 66 ARG H H 66 8.491 8.491 8.546 -0.055 17890 1123 1 2 . 1 1 67 67 SER N N 67 119.709 119.709 116.586 3.123 17890 1124 1 2 . 1 1 67 67 SER HA H 67 3.186 3.186 3.169 0.017 17890 1125 1 2 . 1 1 67 67 SER C C 67 174.508 174.508 173.335 1.173 17890 1126 1 2 . 1 1 67 67 SER CA C 67 58.521 58.521 58.873 -0.352 17890 1127 1 2 . 1 1 67 67 SER CB C 67 62.590 62.590 63.265 -0.675 17890 1128 1 2 . 1 1 67 67 SER H H 67 8.557 8.557 8.574 -0.017 17890 1129 1 2 . 1 1 68 68 TYR N N 68 131.011 131.011 127.356 3.655 17890 1130 1 2 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.519 -0.071 17890 1131 1 2 . 1 1 68 68 TYR C C 68 174.687 174.687 174.835 -0.148 17890 1132 1 2 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.544 0.221 17890 1133 1 2 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.231 -2.243 17890 1134 1 2 . 1 1 68 68 TYR H H 68 8.531 8.531 8.534 -0.003 17890 1135 1 2 . 1 1 69 69 ASP N N 69 117.066 117.066 120.123 -3.057 17890 1136 1 2 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.886 -0.261 17890 1137 1 2 . 1 1 69 69 ASP C C 69 176.455 176.455 176.009 0.446 17890 1138 1 2 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.886 -0.795 17890 1139 1 2 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.831 -0.684 17890 1140 1 2 . 1 1 69 69 ASP H H 69 7.122 7.122 7.663 -0.541 17890 1141 1 2 . 1 1 70 70 SER N N 70 122.869 122.869 120.196 2.673 17890 1142 1 2 . 1 1 70 70 SER HA H 70 4.270 4.270 4.160 0.110 17890 1143 1 2 . 1 1 70 70 SER C C 70 177.010 177.010 176.115 0.895 17890 1144 1 2 . 1 1 70 70 SER CA C 70 60.837 60.837 60.995 -0.158 17890 1145 1 2 . 1 1 70 70 SER CB C 70 62.722 62.722 63.124 -0.403 17890 1146 1 2 . 1 1 70 70 SER H H 70 8.757 8.757 8.813 -0.056 17890 1147 1 2 . 1 1 71 71 ASN N N 71 119.873 119.873 119.532 0.341 17890 1148 1 2 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.597 -0.026 17890 1149 1 2 . 1 1 71 71 ASN C C 71 176.226 176.226 175.933 0.293 17890 1150 1 2 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.372 0.342 17890 1151 1 2 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.484 0.157 17890 1152 1 2 . 1 1 71 71 ASN H H 71 8.342 8.342 8.653 -0.311 17890 1153 1 2 . 1 1 72 72 SER N N 72 112.202 112.202 113.518 -1.316 17890 1154 1 2 . 1 1 72 72 SER HA H 72 4.567 4.567 4.737 -0.170 17890 1155 1 2 . 1 1 72 72 SER C C 72 173.789 173.789 173.255 0.534 17890 1156 1 2 . 1 1 72 72 SER CA C 72 57.816 57.816 57.559 0.257 17890 1157 1 2 . 1 1 72 72 SER CB C 72 63.935 63.935 64.414 -0.479 17890 1158 1 2 . 1 1 72 72 SER H H 72 7.560 7.560 7.735 -0.175 17890 1159 1 2 . 1 1 73 73 ASN N N 73 117.437 117.437 118.788 -1.351 17890 1160 1 2 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.457 0.077 17890 1161 1 2 . 1 1 73 73 ASN C C 73 173.647 173.647 174.110 -0.463 17890 1162 1 2 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.554 -0.031 17890 1163 1 2 . 1 1 73 73 ASN CB C 73 37.213 37.213 36.892 0.321 17890 1164 1 2 . 1 1 73 73 ASN H H 73 7.940 7.940 7.928 0.012 17890 1165 1 2 . 1 1 74 74 THR N N 74 104.227 104.227 108.700 -4.473 17890 1166 1 2 . 1 1 74 74 THR HA H 74 5.477 5.477 5.052 0.425 17890 1167 1 2 . 1 1 74 74 THR C C 74 176.824 176.824 173.950 2.874 17890 1168 1 2 . 1 1 74 74 THR CA C 74 59.768 59.768 61.452 -1.684 17890 1169 1 2 . 1 1 74 74 THR CB C 74 71.985 71.985 70.180 1.805 17890 1170 1 2 . 1 1 74 74 THR H H 74 7.737 7.737 7.880 -0.143 17890 1171 1 2 . 1 1 75 75 TRP N N 75 124.636 124.636 124.272 0.364 17890 1172 1 2 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.435 -0.228 17890 1173 1 2 . 1 1 75 75 TRP C C 75 175.876 175.876 176.300 -0.424 17890 1174 1 2 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.196 1.410 17890 1175 1 2 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.324 0.192 17890 1176 1 2 . 1 1 75 75 TRP H H 75 9.442 9.442 9.362 0.080 17890 1177 1 2 . 1 1 76 76 THR N N 76 110.544 110.544 114.481 -3.937 17890 1178 1 2 . 1 1 76 76 THR HA H 76 5.129 5.129 4.990 0.139 17890 1179 1 2 . 1 1 76 76 THR C C 76 174.506 174.506 174.555 -0.049 17890 1180 1 2 . 1 1 76 76 THR CA C 76 60.561 60.561 61.392 -0.831 17890 1181 1 2 . 1 1 76 76 THR CB C 76 71.688 71.688 70.013 1.675 17890 1182 1 2 . 1 1 76 76 THR H H 76 9.415 9.415 9.383 0.032 17890 1183 1 2 . 1 1 77 77 ILE N N 77 121.567 121.567 123.605 -2.038 17890 1184 1 2 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.212 -0.073 17890 1185 1 2 . 1 1 77 77 ILE C C 77 176.148 176.148 175.117 1.031 17890 1186 1 2 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.761 1.947 17890 1187 1 2 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.830 1.157 17890 1188 1 2 . 1 1 77 77 ILE H H 77 9.255 9.255 8.380 0.875 17890 1189 1 2 . 1 1 78 78 SER N N 78 122.269 122.269 121.435 0.834 17890 1190 1 2 . 1 1 78 78 SER HA H 78 5.601 5.601 5.237 0.364 17890 1191 1 2 . 1 1 78 78 SER CA C 78 55.835 55.835 56.104 -0.269 17890 1192 1 2 . 1 1 78 78 SER CB C 78 65.858 65.858 66.552 -0.694 17890 1193 1 2 . 1 1 78 78 SER H H 78 9.226 9.226 8.701 0.525 17890 1194 1 2 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.204 -0.340 17890 1195 1 2 . 1 1 79 79 PRO C C 79 178.175 178.175 178.053 0.122 17890 1196 1 2 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.052 0.832 17890 1197 1 2 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.663 -1.391 17890 1198 1 2 . 1 1 80 80 VAL N N 80 121.906 121.906 118.826 3.080 17890 1199 1 2 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.837 -0.256 17890 1200 1 2 . 1 1 80 80 VAL C C 80 177.751 177.751 176.589 1.162 17890 1201 1 2 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.640 1.427 17890 1202 1 2 . 1 1 80 80 VAL CB C 80 31.485 31.485 30.613 0.872 17890 1203 1 2 . 1 1 80 80 VAL H H 80 7.328 7.328 7.928 -0.600 17890 1204 1 2 . 1 1 81 81 GLY N N 81 104.643 104.643 108.329 -3.686 17890 1205 1 2 . 1 1 81 81 GLY C C 81 174.979 174.979 174.503 0.476 17890 1206 1 2 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.414 -0.327 17890 1207 1 2 . 1 1 81 81 GLY H H 81 8.949 8.949 8.424 0.525 17890 1208 1 2 . 1 1 82 82 SER N N 82 111.865 111.865 115.968 -4.103 17890 1209 1 2 . 1 1 82 82 SER HA H 82 4.646 4.646 4.813 -0.167 17890 1210 1 2 . 1 1 82 82 SER CA C 82 55.441 55.441 55.023 0.418 17890 1211 1 2 . 1 1 82 82 SER CB C 82 62.277 62.277 64.034 -1.756 17890 1212 1 2 . 1 1 82 82 SER H H 82 6.968 6.968 7.209 -0.241 17890 1213 1 2 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.522 -0.175 17890 1214 1 2 . 1 1 83 83 PRO C C 83 176.660 176.660 176.378 0.282 17890 1215 1 2 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.580 0.623 17890 1216 1 2 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.775 1.044 17890 1217 1 2 . 1 1 84 84 ASN N N 84 116.542 116.542 114.567 1.975 17890 1218 1 2 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.698 0.303 17890 1219 1 2 . 1 1 84 84 ASN C C 84 175.825 175.825 174.691 1.134 17890 1220 1 2 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.130 -0.239 17890 1221 1 2 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.381 0.363 17890 1222 1 2 . 1 1 84 84 ASN H H 84 8.502 8.502 8.283 0.219 17890 1223 1 2 . 1 1 85 85 SER N N 85 114.633 114.633 113.037 1.596 17890 1224 1 2 . 1 1 85 85 SER HA H 85 4.624 4.624 4.892 -0.268 17890 1225 1 2 . 1 1 85 85 SER C C 85 172.963 172.963 172.555 0.408 17890 1226 1 2 . 1 1 85 85 SER CA C 85 59.210 59.210 57.172 2.038 17890 1227 1 2 . 1 1 85 85 SER CB C 85 64.697 64.697 65.920 -1.223 17890 1228 1 2 . 1 1 85 85 SER H H 85 7.980 7.980 7.758 0.222 17890 1229 1 2 . 1 1 86 86 GLN N N 86 119.016 119.016 117.398 1.618 17890 1230 1 2 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.582 -0.136 17890 1231 1 2 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.507 -0.055 17890 1232 1 2 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.554 -0.156 17890 1233 1 2 . 1 1 86 86 GLN H H 86 9.399 9.399 9.001 0.398 17890 1234 1 2 . 1 1 87 87 ILE N N 87 119.691 119.691 119.213 0.478 17890 1235 1 2 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.192 -0.617 17890 1236 1 2 . 1 1 87 87 ILE C C 87 176.505 176.505 175.995 0.510 17890 1237 1 2 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.935 4.559 17890 1238 1 2 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.220 -1.023 17890 1239 1 2 . 1 1 87 87 ILE H H 87 8.970 8.970 8.268 0.702 17890 1240 1 2 . 1 1 88 88 GLY N N 88 118.378 118.378 114.579 3.799 17890 1241 1 2 . 1 1 88 88 GLY C C 88 171.397 171.397 171.618 -0.221 17890 1242 1 2 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.036 -1.432 17890 1243 1 2 . 1 1 88 88 GLY H H 88 9.752 9.752 8.962 0.790 17890 1244 1 2 . 1 1 89 89 TRP N N 89 122.749 122.749 122.349 0.400 17890 1245 1 2 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.345 -0.747 17890 1246 1 2 . 1 1 89 89 TRP C C 89 175.924 175.924 175.051 0.873 17890 1247 1 2 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.339 -0.056 17890 1248 1 2 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.623 -2.537 17890 1249 1 2 . 1 1 89 89 TRP H H 89 8.215 8.215 8.442 -0.227 17890 1250 1 2 . 1 1 90 90 GLY N N 90 116.305 116.305 111.305 5.000 17890 1251 1 2 . 1 1 90 90 GLY C C 90 173.725 173.725 173.009 0.716 17890 1252 1 2 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.574 0.481 17890 1253 1 2 . 1 1 90 90 GLY H H 90 8.922 8.922 8.152 0.770 17890 1254 1 2 . 1 1 91 91 ALA N N 91 123.795 123.795 122.092 1.703 17890 1255 1 2 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.167 0.076 17890 1256 1 2 . 1 1 91 91 ALA C C 91 178.510 178.510 178.977 -0.467 17890 1257 1 2 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.409 0.081 17890 1258 1 2 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.841 -0.432 17890 1259 1 2 . 1 1 91 91 ALA H H 91 8.367 8.367 8.179 0.188 17890 1260 1 2 . 1 1 92 92 GLY N N 92 108.871 108.871 112.470 -3.599 17890 1261 1 2 . 1 1 92 92 GLY C C 92 174.528 174.528 174.842 -0.314 17890 1262 1 2 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.801 0.457 17890 1263 1 2 . 1 1 92 92 GLY H H 92 8.776 8.776 8.640 0.136 17890 1264 1 2 . 1 1 93 93 ASN N N 93 114.921 114.921 116.945 -2.024 17890 1265 1 2 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.785 -0.336 17890 1266 1 2 . 1 1 93 93 ASN C C 93 172.774 172.774 174.051 -1.277 17890 1267 1 2 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.406 0.567 17890 1268 1 2 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.000 -0.671 17890 1269 1 2 . 1 1 93 93 ASN H H 93 8.647 8.647 8.278 0.369 17890 1270 1 2 . 1 1 94 94 VAL N N 94 112.437 112.437 112.628 -0.191 17890 1271 1 2 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.646 0.419 17890 1272 1 2 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.378 -1.463 17890 1273 1 2 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.384 -0.229 17890 1274 1 2 . 1 1 94 94 VAL H H 94 6.989 6.989 7.449 -0.460 17890 1275 1 2 . 1 1 95 95 PRO HA H 95 4.928 4.928 5.068 -0.140 17890 1276 1 2 . 1 1 95 95 PRO C C 95 176.041 176.041 176.032 0.009 17890 1277 1 2 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.299 -1.098 17890 1278 1 2 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.805 -1.080 17890 1279 1 2 . 1 1 96 96 VAL N N 96 113.564 113.564 116.480 -2.916 17890 1280 1 2 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.868 -0.133 17890 1281 1 2 . 1 1 96 96 VAL C C 96 173.656 173.656 175.053 -1.397 17890 1282 1 2 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.609 -0.756 17890 1283 1 2 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.547 1.606 17890 1284 1 2 . 1 1 96 96 VAL H H 96 8.199 8.199 8.856 -0.657 17890 1285 1 2 . 1 1 97 97 VAL N N 97 122.328 122.328 122.805 -0.477 17890 1286 1 2 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.608 0.023 17890 1287 1 2 . 1 1 97 97 VAL C C 97 174.776 174.776 175.656 -0.880 17890 1288 1 2 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.512 0.145 17890 1289 1 2 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.818 -0.690 17890 1290 1 2 . 1 1 97 97 VAL H H 97 8.957 8.957 8.111 0.846 17890 1291 1 2 . 1 1 98 98 LEU N N 98 130.258 130.258 126.545 3.713 17890 1292 1 2 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.978 0.072 17890 1293 1 2 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.539 1.284 17890 1294 1 2 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.164 0.954 17890 1295 1 2 . 1 1 98 98 LEU H H 98 9.245 9.245 9.079 0.166 17890 1296 1 2 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.769 0.010 17890 1297 1 2 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.093 0.396 17890 1298 1 2 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.095 -0.641 17890 1299 1 2 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.661 -0.676 17890 1300 1 2 . 1 1 100 100 PRO C C 100 177.309 177.309 175.814 1.495 17890 1301 1 2 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.048 0.776 17890 1302 1 2 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.264 -0.159 17890 1303 1 2 . 1 1 101 101 ASN N N 101 119.284 119.284 125.948 -6.664 17890 1304 1 2 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.649 -0.107 17890 1305 1 2 . 1 1 101 101 ASN C C 101 171.920 171.920 174.013 -2.093 17890 1306 1 2 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.856 -0.656 17890 1307 1 2 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.500 -1.875 17890 1308 1 2 . 1 1 101 101 ASN H H 101 7.273 7.273 9.403 -2.130 17890 1309 1 2 . 1 1 102 102 ASN N N 102 115.674 115.674 116.213 -0.539 17890 1310 1 2 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.729 -0.811 17890 1311 1 2 . 1 1 102 102 ASN C C 102 173.264 173.264 174.350 -1.086 17890 1312 1 2 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.804 1.235 17890 1313 1 2 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.007 -1.025 17890 1314 1 2 . 1 1 102 102 ASN H H 102 8.197 8.197 7.881 0.316 17890 1315 1 2 . 1 1 103 103 TYR N N 103 118.775 118.775 121.751 -2.976 17890 1316 1 2 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.334 0.151 17890 1317 1 2 . 1 1 103 103 TYR C C 103 175.248 175.248 174.777 0.471 17890 1318 1 2 . 1 1 103 103 TYR CA C 103 57.490 57.490 60.084 -2.595 17890 1319 1 2 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.443 -0.911 17890 1320 1 2 . 1 1 103 103 TYR H H 103 7.745 7.745 7.386 0.359 17890 1321 1 2 . 1 1 104 104 VAL N N 104 116.205 116.205 116.678 -0.473 17890 1322 1 2 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.858 0.119 17890 1323 1 2 . 1 1 104 104 VAL C C 104 174.361 174.361 173.618 0.743 17890 1324 1 2 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.849 -1.598 17890 1325 1 2 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.326 0.217 17890 1326 1 2 . 1 1 104 104 VAL H H 104 7.498 7.498 8.005 -0.507 17890 1327 1 2 . 1 1 105 105 TRP N N 105 119.557 119.557 119.387 0.170 17890 1328 1 2 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.025 -0.150 17890 1329 1 2 . 1 1 105 105 TRP C C 105 175.526 175.526 175.870 -0.344 17890 1330 1 2 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.365 -0.482 17890 1331 1 2 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.614 -0.075 17890 1332 1 2 . 1 1 105 105 TRP H H 105 8.926 8.926 9.008 -0.082 17890 1333 1 2 . 1 1 106 106 THR N N 106 120.480 120.480 119.571 0.909 17890 1334 1 2 . 1 1 106 106 THR HA H 106 4.966 4.966 4.987 -0.021 17890 1335 1 2 . 1 1 106 106 THR C C 106 174.177 174.177 173.989 0.188 17890 1336 1 2 . 1 1 106 106 THR CA C 106 62.091 62.091 63.523 -1.432 17890 1337 1 2 . 1 1 106 106 THR CB C 106 69.649 69.649 69.346 0.303 17890 1338 1 2 . 1 1 106 106 THR H H 106 9.525 9.525 9.098 0.427 17890 1339 1 2 . 1 1 107 107 LEU N N 107 127.146 127.146 128.365 -1.219 17890 1340 1 2 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.168 -0.341 17890 1341 1 2 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.395 0.314 17890 1342 1 2 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.135 -1.612 17890 1343 1 2 . 1 1 107 107 LEU H H 107 7.591 7.591 8.740 -1.149 17890 1344 1 2 . 1 1 108 108 THR N N 108 119.928 119.928 120.372 -0.444 17890 1345 1 2 . 1 1 108 108 THR HA H 108 4.411 4.411 4.595 -0.184 17890 1346 1 2 . 1 1 108 108 THR C C 108 173.319 173.319 173.212 0.107 17890 1347 1 2 . 1 1 108 108 THR CA C 108 62.243 62.243 61.447 0.796 17890 1348 1 2 . 1 1 108 108 THR CB C 108 70.138 70.138 71.692 -1.554 17890 1349 1 2 . 1 1 108 108 THR H H 108 8.141 8.141 8.849 -0.708 17890 1350 1 2 . 1 1 109 109 LEU N N 109 130.557 130.557 127.831 2.726 17890 1351 1 2 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.013 -0.468 17890 1352 1 2 . 1 1 109 109 LEU C C 109 175.217 175.217 177.432 -2.215 17890 1353 1 2 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.397 -0.111 17890 1354 1 2 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.504 -1.898 17890 1355 1 2 . 1 1 109 109 LEU H H 109 8.924 8.924 8.654 0.270 17890 1356 1 2 . 1 1 110 110 THR N N 110 120.160 120.160 112.828 7.332 17890 1357 1 2 . 1 1 110 110 THR HA H 110 4.911 4.911 4.686 0.225 17890 1358 1 2 . 1 1 110 110 THR CA C 110 60.141 60.141 60.005 0.135 17890 1359 1 2 . 1 1 110 110 THR CB C 110 72.785 72.785 70.933 1.852 17890 1360 1 2 . 1 1 110 110 THR H H 110 7.677 7.677 8.427 -0.750 17890 1361 1 2 . 1 1 111 111 SER HA H 111 4.204 4.204 4.214 -0.010 17890 1362 1 2 . 1 1 111 111 SER C C 111 174.755 174.755 174.915 -0.160 17890 1363 1 2 . 1 1 111 111 SER CA C 111 60.710 60.710 59.867 0.843 17890 1364 1 2 . 1 1 111 111 SER CB C 111 62.660 62.660 62.981 -0.321 17890 1365 1 2 . 1 1 112 112 GLY N N 112 107.313 107.313 107.635 -0.322 17890 1366 1 2 . 1 1 112 112 GLY C C 112 173.023 173.023 172.678 0.345 17890 1367 1 2 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.198 -1.048 17890 1368 1 2 . 1 1 112 112 GLY H H 112 8.249 8.249 7.506 0.743 17890 1369 1 2 . 1 1 113 113 GLY N N 113 105.618 105.618 107.928 -2.310 17890 1370 1 2 . 1 1 113 113 GLY C C 113 175.844 175.844 171.809 4.035 17890 1371 1 2 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.932 -3.173 17890 1372 1 2 . 1 1 113 113 GLY H H 113 7.444 7.444 7.374 0.070 17890 1373 1 2 . 1 1 114 114 TYR N N 114 121.548 121.548 118.219 3.329 17890 1374 1 2 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.423 -0.571 17890 1375 1 2 . 1 1 114 114 TYR C C 114 175.605 175.605 174.242 1.363 17890 1376 1 2 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.553 4.710 17890 1377 1 2 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.531 -4.598 17890 1378 1 2 . 1 1 114 114 TYR H H 114 9.677 9.677 8.992 0.685 17890 1379 1 2 . 1 1 115 115 ASN N N 115 123.274 123.274 117.461 5.813 17890 1380 1 2 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.213 -0.115 17890 1381 1 2 . 1 1 115 115 ASN C C 115 174.355 174.355 173.026 1.329 17890 1382 1 2 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.458 -1.412 17890 1383 1 2 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.791 -2.442 17890 1384 1 2 . 1 1 115 115 ASN H H 115 9.350 9.350 9.051 0.299 17890 1385 1 2 . 1 1 116 116 ILE N N 116 130.611 130.611 122.250 8.361 17890 1386 1 2 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.741 -0.502 17890 1387 1 2 . 1 1 116 116 ILE C C 116 173.998 173.998 173.877 0.121 17890 1388 1 2 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.052 2.147 17890 1389 1 2 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.351 -2.251 17890 1390 1 2 . 1 1 116 116 ILE H H 116 9.473 9.473 8.437 1.036 17890 1391 1 2 . 1 1 117 117 GLN N N 117 121.633 121.633 124.978 -3.345 17890 1392 1 2 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.025 0.910 17890 1393 1 2 . 1 1 117 117 GLN C C 117 177.902 177.902 176.042 1.860 17890 1394 1 2 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.791 -0.471 17890 1395 1 2 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.483 3.974 17890 1396 1 2 . 1 1 117 117 GLN H H 117 8.781 8.781 8.732 0.049 17890 1397 1 2 . 1 1 118 118 ASP N N 118 116.836 116.836 119.999 -3.163 17890 1398 1 2 . 1 1 118 118 ASP HA H 118 4.783 4.783 4.085 0.698 17890 1399 1 2 . 1 1 118 118 ASP C C 118 178.084 178.084 176.807 1.277 17890 1400 1 2 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.142 -1.372 17890 1401 1 2 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.185 -0.817 17890 1402 1 2 . 1 1 118 118 ASP H H 118 9.330 9.330 8.717 0.613 17890 1403 1 2 . 1 1 119 119 GLY N N 119 111.037 111.037 107.388 3.649 17890 1404 1 2 . 1 1 119 119 GLY C C 119 174.196 174.196 174.655 -0.459 17890 1405 1 2 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.887 2.089 17890 1406 1 2 . 1 1 119 119 GLY H H 119 8.986 8.986 8.341 0.645 17890 1407 1 2 . 1 1 120 120 LYS N N 120 114.809 114.809 121.528 -6.719 17890 1408 1 2 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.528 -0.179 17890 1409 1 2 . 1 1 120 120 LYS C C 120 175.174 175.174 175.725 -0.551 17890 1410 1 2 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.661 1.272 17890 1411 1 2 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.950 -0.474 17890 1412 1 2 . 1 1 120 120 LYS H H 120 7.045 7.045 8.690 -1.645 17890 1413 1 2 . 1 1 121 121 ARG N N 121 116.291 116.291 113.899 2.392 17890 1414 1 2 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.104 -0.518 17890 1415 1 2 . 1 1 121 121 ARG C C 121 175.097 175.097 177.252 -2.155 17890 1416 1 2 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.957 1.112 17890 1417 1 2 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.694 -0.071 17890 1418 1 2 . 1 1 121 121 ARG H H 121 7.683 7.683 8.390 -0.707 17890 1419 1 2 . 1 1 122 122 THR N N 122 113.730 113.730 109.176 4.554 17890 1420 1 2 . 1 1 122 122 THR HA H 122 4.540 4.540 4.163 0.377 17890 1421 1 2 . 1 1 122 122 THR C C 122 175.302 175.302 174.609 0.693 17890 1422 1 2 . 1 1 122 122 THR CA C 122 62.871 62.871 64.518 -1.647 17890 1423 1 2 . 1 1 122 122 THR CB C 122 71.552 71.552 70.011 1.541 17890 1424 1 2 . 1 1 122 122 THR H H 122 11.059 11.059 8.311 2.748 17890 1425 1 2 . 1 1 123 123 VAL N N 123 118.350 118.350 113.952 4.398 17890 1426 1 2 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.746 0.064 17890 1427 1 2 . 1 1 123 123 VAL C C 123 174.730 174.730 173.594 1.136 17890 1428 1 2 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.820 0.491 17890 1429 1 2 . 1 1 123 123 VAL CB C 123 37.082 37.082 35.107 1.975 17890 1430 1 2 . 1 1 123 123 VAL H H 123 8.181 8.181 7.981 0.200 17890 1431 1 2 . 1 1 124 124 SER N N 124 113.053 113.053 114.120 -1.067 17890 1432 1 2 . 1 1 124 124 SER HA H 124 5.820 5.820 5.176 0.644 17890 1433 1 2 . 1 1 124 124 SER C C 124 175.521 175.521 173.629 1.892 17890 1434 1 2 . 1 1 124 124 SER CA C 124 58.087 58.087 57.124 0.963 17890 1435 1 2 . 1 1 124 124 SER CB C 124 67.405 67.405 65.748 1.657 17890 1436 1 2 . 1 1 124 124 SER H H 124 9.138 9.138 8.612 0.526 17890 1437 1 2 . 1 1 125 125 TRP N N 125 124.900 124.900 124.214 0.686 17890 1438 1 2 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.988 0.622 17890 1439 1 2 . 1 1 125 125 TRP C C 125 178.114 178.114 177.412 0.702 17890 1440 1 2 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.171 -0.697 17890 1441 1 2 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.012 1.010 17890 1442 1 2 . 1 1 125 125 TRP H H 125 8.843 8.843 8.041 0.802 17890 1443 1 2 . 1 1 126 126 SER N N 126 119.243 119.243 113.534 5.709 17890 1444 1 2 . 1 1 126 126 SER HA H 126 5.443 5.443 5.337 0.106 17890 1445 1 2 . 1 1 126 126 SER C C 126 171.668 171.668 172.916 -1.248 17890 1446 1 2 . 1 1 126 126 SER CA C 126 58.696 58.696 57.247 1.449 17890 1447 1 2 . 1 1 126 126 SER CB C 126 66.176 66.176 66.236 -0.060 17890 1448 1 2 . 1 1 126 126 SER H H 126 9.835 9.835 9.234 0.601 17890 1449 1 2 . 1 1 127 127 LEU N N 127 113.708 113.708 118.620 -4.912 17890 1450 1 2 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.660 0.495 17890 1451 1 2 . 1 1 127 127 LEU C C 127 176.563 176.563 176.180 0.383 17890 1452 1 2 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.530 -0.885 17890 1453 1 2 . 1 1 127 127 LEU CB C 127 43.696 43.696 44.560 -0.864 17890 1454 1 2 . 1 1 127 127 LEU H H 127 6.559 6.559 8.265 -1.706 17890 1455 1 2 . 1 1 128 128 ASN N N 128 121.739 121.739 117.628 4.111 17890 1456 1 2 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.839 -0.150 17890 1457 1 2 . 1 1 128 128 ASN C C 128 175.452 175.452 175.584 -0.132 17890 1458 1 2 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.687 1.320 17890 1459 1 2 . 1 1 128 128 ASN CB C 128 39.291 39.291 39.974 -0.683 17890 1460 1 2 . 1 1 128 128 ASN H H 128 8.662 8.662 8.891 -0.229 17890 1461 1 2 . 1 1 129 129 ASN N N 129 119.586 119.586 116.197 3.389 17890 1462 1 2 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.942 0.055 17890 1463 1 2 . 1 1 129 129 ASN C C 129 175.900 175.900 174.790 1.110 17890 1464 1 2 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.327 0.906 17890 1465 1 2 . 1 1 129 129 ASN CB C 129 41.256 41.256 40.943 0.313 17890 1466 1 2 . 1 1 129 129 ASN H H 129 10.962 10.962 8.781 2.181 17890 1467 1 2 . 1 1 130 130 ALA N N 130 128.292 128.292 121.620 6.672 17890 1468 1 2 . 1 1 130 130 ALA HA H 130 3.570 3.570 3.965 -0.395 17890 1469 1 2 . 1 1 130 130 ALA C C 130 172.620 172.620 176.304 -3.684 17890 1470 1 2 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.300 -0.661 17890 1471 1 2 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.272 -1.172 17890 1472 1 2 . 1 1 130 130 ALA H H 130 10.629 10.629 8.257 2.372 17890 1473 1 2 . 1 1 131 131 THR N N 131 105.584 105.584 110.284 -4.700 17890 1474 1 2 . 1 1 131 131 THR HA H 131 4.462 4.462 4.290 0.172 17890 1475 1 2 . 1 1 131 131 THR C C 131 173.552 173.552 175.286 -1.734 17890 1476 1 2 . 1 1 131 131 THR CA C 131 58.338 58.338 60.591 -2.253 17890 1477 1 2 . 1 1 131 131 THR CB C 131 71.569 71.569 69.791 1.778 17890 1478 1 2 . 1 1 131 131 THR H H 131 7.092 7.092 7.327 -0.235 17890 1479 1 2 . 1 1 132 132 ALA N N 132 121.773 121.773 125.692 -3.919 17890 1480 1 2 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.016 -0.267 17890 1481 1 2 . 1 1 132 132 ALA C C 132 178.819 178.819 178.123 0.696 17890 1482 1 2 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.924 1.360 17890 1483 1 2 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.626 -0.399 17890 1484 1 2 . 1 1 132 132 ALA H H 132 8.952 8.952 8.258 0.694 17890 1485 1 2 . 1 1 133 133 GLY N N 133 113.965 113.965 112.101 1.864 17890 1486 1 2 . 1 1 133 133 GLY C C 133 173.453 173.453 174.249 -0.796 17890 1487 1 2 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.867 0.299 17890 1488 1 2 . 1 1 133 133 GLY H H 133 9.016 9.016 8.614 0.402 17890 1489 1 2 . 1 1 134 134 GLU N N 134 123.460 123.460 121.189 2.271 17890 1490 1 2 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.332 -0.374 17890 1491 1 2 . 1 1 134 134 GLU C C 134 176.120 176.120 176.032 0.088 17890 1492 1 2 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.974 1.425 17890 1493 1 2 . 1 1 134 134 GLU CB C 134 31.385 31.385 31.084 0.301 17890 1494 1 2 . 1 1 134 134 GLU H H 134 7.598 7.598 7.585 0.013 17890 1495 1 2 . 1 1 135 135 GLU N N 135 122.633 122.633 124.265 -1.632 17890 1496 1 2 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.244 0.067 17890 1497 1 2 . 1 1 135 135 GLU C C 135 176.014 176.014 176.651 -0.637 17890 1498 1 2 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.382 -0.200 17890 1499 1 2 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.132 -0.679 17890 1500 1 2 . 1 1 135 135 GLU H H 135 8.258 8.258 8.590 -0.332 17890 1501 1 2 . 1 1 136 136 VAL N N 136 123.635 123.635 126.434 -2.799 17890 1502 1 2 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.789 -0.097 17890 1503 1 2 . 1 1 136 136 VAL C C 136 173.932 173.932 174.788 -0.856 17890 1504 1 2 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.463 0.369 17890 1505 1 2 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.596 -0.733 17890 1506 1 2 . 1 1 136 136 VAL H H 136 7.267 7.267 7.795 -0.528 17890 1507 1 2 . 1 1 137 137 SER N N 137 118.950 118.950 120.813 -1.863 17890 1508 1 2 . 1 1 137 137 SER HA H 137 4.887 4.887 4.895 -0.008 17890 1509 1 2 . 1 1 137 137 SER C C 137 173.780 173.780 173.001 0.779 17890 1510 1 2 . 1 1 137 137 SER CA C 137 57.895 57.895 56.184 1.710 17890 1511 1 2 . 1 1 137 137 SER CB C 137 65.027 65.027 65.705 -0.678 17890 1512 1 2 . 1 1 137 137 SER H H 137 8.454 8.454 8.627 -0.173 17890 1513 1 2 . 1 1 138 138 ILE N N 138 123.511 123.511 120.545 2.966 17890 1514 1 2 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.009 -0.761 17890 1515 1 2 . 1 1 138 138 ILE C C 138 176.142 176.142 175.301 0.841 17890 1516 1 2 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.572 1.278 17890 1517 1 2 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.588 -2.993 17890 1518 1 2 . 1 1 138 138 ILE H H 138 7.915 7.915 8.238 -0.323 17890 1519 1 2 . 1 1 139 139 GLY N N 139 115.638 115.638 111.503 4.135 17890 1520 1 2 . 1 1 139 139 GLY C C 139 171.947 171.947 172.153 -0.206 17890 1521 1 2 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.273 1.813 17890 1522 1 2 . 1 1 139 139 GLY H H 139 8.490 8.490 8.412 0.078 17890 1523 1 2 . 1 1 140 140 ALA N N 140 128.563 128.563 121.368 7.195 17890 1524 1 2 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.272 0.123 17890 1525 1 2 . 1 1 140 140 ALA C C 140 177.956 177.956 177.011 0.945 17890 1526 1 2 . 1 1 140 140 ALA CA C 140 52.646 52.646 52.526 0.119 17890 1527 1 2 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.359 -0.155 17890 1528 1 2 . 1 1 140 140 ALA H H 140 8.531 8.531 8.143 0.388 17890 1529 1 2 . 1 1 141 141 ASP N N 141 120.886 120.886 121.229 -0.343 17890 1530 1 2 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.406 0.192 17890 1531 1 2 . 1 1 141 141 ASP C C 141 175.411 175.411 175.872 -0.461 17890 1532 1 2 . 1 1 141 141 ASP CA C 141 53.916 53.916 54.821 -0.905 17890 1533 1 2 . 1 1 141 141 ASP CB C 141 40.692 40.692 40.791 -0.099 17890 1534 1 2 . 1 1 141 141 ASP H H 141 8.507 8.507 8.484 0.023 17890 1535 1 2 . 1 1 142 142 ALA N N 142 125.604 125.604 127.633 -2.029 17890 1536 1 2 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.267 0.250 17890 1537 1 2 . 1 1 142 142 ALA C C 142 177.671 177.671 178.854 -1.183 17890 1538 1 2 . 1 1 142 142 ALA CA C 142 51.993 51.993 52.219 -0.226 17890 1539 1 2 . 1 1 142 142 ALA CB C 142 21.535 21.535 19.701 1.835 17890 1540 1 2 . 1 1 142 142 ALA H H 142 7.894 7.894 8.156 -0.262 17890 1541 1 2 . 1 1 143 143 THR N N 143 118.085 118.085 116.299 1.786 17890 1542 1 2 . 1 1 143 143 THR HA H 143 3.744 3.744 4.151 -0.407 17890 1543 1 2 . 1 1 143 143 THR C C 143 175.464 175.464 174.759 0.705 17890 1544 1 2 . 1 1 143 143 THR CA C 143 64.548 64.548 64.915 -0.367 17890 1545 1 2 . 1 1 143 143 THR CB C 143 69.305 69.305 68.838 0.467 17890 1546 1 2 . 1 1 143 143 THR H H 143 8.268 8.268 8.763 -0.495 17890 1547 1 2 . 1 1 144 144 PHE N N 144 118.635 118.635 116.342 2.293 17890 1548 1 2 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.639 -0.293 17890 1549 1 2 . 1 1 144 144 PHE C C 144 176.209 176.209 175.145 1.064 17890 1550 1 2 . 1 1 144 144 PHE CA C 144 61.462 61.462 58.256 3.206 17890 1551 1 2 . 1 1 144 144 PHE CB C 144 39.604 39.604 38.713 0.891 17890 1552 1 2 . 1 1 144 144 PHE H H 144 8.719 8.719 7.904 0.815 17890 1553 1 2 . 1 1 145 145 SER N N 145 113.446 113.446 115.554 -2.108 17890 1554 1 2 . 1 1 145 145 SER HA H 145 4.866 4.866 3.958 0.908 17890 1555 1 2 . 1 1 145 145 SER C C 145 176.605 176.605 176.077 0.528 17890 1556 1 2 . 1 1 145 145 SER CA C 145 59.432 59.432 57.310 2.122 17890 1557 1 2 . 1 1 145 145 SER CB C 145 62.167 62.167 62.458 -0.291 17890 1558 1 2 . 1 1 145 145 SER H H 145 8.657 8.657 7.274 1.383 17890 1559 1 2 . 1 1 146 146 GLY N N 146 109.277 109.277 109.725 -0.448 17890 1560 1 2 . 1 1 146 146 GLY C C 146 174.293 174.293 173.621 0.672 17890 1561 1 2 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.213 -0.273 17890 1562 1 2 . 1 1 146 146 GLY H H 146 7.467 7.467 7.530 -0.063 17890 1563 1 2 . 1 1 147 147 ARG N N 147 122.863 122.863 118.999 3.864 17890 1564 1 2 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.879 0.562 17890 1565 1 2 . 1 1 147 147 ARG C C 147 173.849 173.849 174.569 -0.720 17890 1566 1 2 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.984 -2.757 17890 1567 1 2 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.704 -1.107 17890 1568 1 2 . 1 1 147 147 ARG H H 147 7.556 7.556 6.954 0.602 17890 1569 1 2 . 1 1 148 148 TRP N N 148 118.465 118.465 121.431 -2.966 17890 1570 1 2 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.343 -0.497 17890 1571 1 2 . 1 1 148 148 TRP C C 148 174.353 174.353 174.352 0.001 17890 1572 1 2 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.705 -1.043 17890 1573 1 2 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.461 -1.462 17890 1574 1 2 . 1 1 148 148 TRP H H 148 8.709 8.709 9.255 -0.546 17890 1575 1 2 . 1 1 149 149 VAL N N 149 125.852 125.852 118.674 7.178 17890 1576 1 2 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.586 -0.443 17890 1577 1 2 . 1 1 149 149 VAL C C 149 173.613 173.613 173.222 0.391 17890 1578 1 2 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.963 1.777 17890 1579 1 2 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.374 -2.991 17890 1580 1 2 . 1 1 149 149 VAL H H 149 9.700 9.700 8.944 0.756 17890 1581 1 2 . 1 1 150 150 ILE N N 150 125.140 125.140 126.032 -0.892 17890 1582 1 2 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.058 -0.196 17890 1583 1 2 . 1 1 150 150 ILE C C 150 175.661 175.661 175.143 0.518 17890 1584 1 2 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.316 1.505 17890 1585 1 2 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.126 -0.305 17890 1586 1 2 . 1 1 150 150 ILE H H 150 7.747 7.747 8.048 -0.301 17890 1587 1 2 . 1 1 151 151 GLU N N 151 126.762 126.762 128.217 -1.455 17890 1588 1 2 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.796 0.084 17890 1589 1 2 . 1 1 151 151 GLU C C 151 174.424 174.424 174.912 -0.488 17890 1590 1 2 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.362 0.434 17890 1591 1 2 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.975 0.276 17890 1592 1 2 . 1 1 151 151 GLU H H 151 8.892 8.892 8.985 -0.093 17890 1593 1 2 . 1 1 152 152 LYS N N 152 126.299 126.299 122.505 3.794 17890 1594 1 2 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.817 0.044 17890 1595 1 2 . 1 1 152 152 LYS C C 152 176.282 176.282 176.652 -0.370 17890 1596 1 2 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.848 0.657 17890 1597 1 2 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.550 0.786 17890 1598 1 2 . 1 1 152 152 LYS H H 152 8.640 8.640 8.320 0.320 17890 1599 1 3 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.375 -2.081 17890 1600 1 3 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.781 -0.159 17890 1601 1 3 . 1 1 8 8 HIS CA C 8 55.661 55.661 55.923 -0.262 17890 1602 1 3 . 1 1 8 8 HIS CB C 8 29.880 29.880 30.464 -0.584 17890 1603 1 3 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.917 -0.271 17890 1604 1 3 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.523 0.161 17890 1605 1 3 . 1 1 9 9 HIS CB C 9 29.831 29.831 31.060 -1.229 17890 1606 1 3 . 1 1 10 10 HIS N N 10 120.811 120.811 116.169 4.642 17890 1607 1 3 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.796 -0.116 17890 1608 1 3 . 1 1 10 10 HIS C C 10 174.875 174.875 175.505 -0.630 17890 1609 1 3 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.698 0.048 17890 1610 1 3 . 1 1 10 10 HIS CB C 10 29.889 29.889 30.481 -0.592 17890 1611 1 3 . 1 1 10 10 HIS H H 10 8.583 8.583 8.734 -0.151 17890 1612 1 3 . 1 1 11 11 SER N N 11 118.009 118.009 117.481 0.528 17890 1613 1 3 . 1 1 11 11 SER HA H 11 4.424 4.424 4.138 0.286 17890 1614 1 3 . 1 1 11 11 SER C C 11 174.962 174.962 175.574 -0.612 17890 1615 1 3 . 1 1 11 11 SER CA C 11 58.660 58.660 60.011 -1.351 17890 1616 1 3 . 1 1 11 11 SER CB C 11 63.822 63.822 63.102 0.720 17890 1617 1 3 . 1 1 11 11 SER H H 11 8.438 8.438 8.517 -0.079 17890 1618 1 3 . 1 1 12 12 GLY N N 12 111.011 111.011 107.296 3.715 17890 1619 1 3 . 1 1 12 12 GLY C C 12 173.907 173.907 172.732 1.175 17890 1620 1 3 . 1 1 12 12 GLY CA C 12 45.421 45.421 44.954 0.467 17890 1621 1 3 . 1 1 12 12 GLY H H 12 8.433 8.433 8.556 -0.123 17890 1622 1 3 . 1 1 13 13 ASP N N 13 120.291 120.291 119.630 0.661 17890 1623 1 3 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.780 -0.118 17890 1624 1 3 . 1 1 13 13 ASP C C 13 176.115 176.115 175.144 0.971 17890 1625 1 3 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.183 1.120 17890 1626 1 3 . 1 1 13 13 ASP CB C 13 41.465 41.465 43.407 -1.942 17890 1627 1 3 . 1 1 13 13 ASP H H 13 8.153 8.153 7.508 0.645 17890 1628 1 3 . 1 1 14 14 SER N N 14 116.987 116.987 115.558 1.429 17890 1629 1 3 . 1 1 14 14 SER HA H 14 4.754 4.754 4.405 0.349 17890 1630 1 3 . 1 1 14 14 SER CA C 14 56.469 56.469 57.593 -1.124 17890 1631 1 3 . 1 1 14 14 SER CB C 14 63.553 63.553 62.518 1.035 17890 1632 1 3 . 1 1 14 14 SER H H 14 8.210 8.210 8.195 0.015 17890 1633 1 3 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.421 0.021 17890 1634 1 3 . 1 1 15 15 PRO C C 15 176.424 176.424 176.184 0.240 17890 1635 1 3 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.789 0.444 17890 1636 1 3 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.263 -0.115 17890 1637 1 3 . 1 1 16 16 ALA N N 16 124.219 124.219 122.817 1.402 17890 1638 1 3 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.445 -0.095 17890 1639 1 3 . 1 1 16 16 ALA C C 16 177.552 177.552 176.388 1.164 17890 1640 1 3 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.414 0.019 17890 1641 1 3 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.269 0.050 17890 1642 1 3 . 1 1 16 16 ALA H H 16 8.284 8.284 8.439 -0.155 17890 1643 1 3 . 1 1 17 17 VAL N N 17 119.504 119.504 117.933 1.571 17890 1644 1 3 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.439 -0.190 17890 1645 1 3 . 1 1 17 17 VAL C C 17 176.322 176.322 175.795 0.527 17890 1646 1 3 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.188 0.090 17890 1647 1 3 . 1 1 17 17 VAL CB C 17 32.957 32.957 33.790 -0.833 17890 1648 1 3 . 1 1 17 17 VAL H H 17 8.046 8.046 7.511 0.535 17890 1649 1 3 . 1 1 18 18 THR N N 18 118.186 118.186 117.810 0.376 17890 1650 1 3 . 1 1 18 18 THR HA H 18 4.473 4.473 4.637 -0.164 17890 1651 1 3 . 1 1 18 18 THR C C 18 174.248 174.248 174.704 -0.456 17890 1652 1 3 . 1 1 18 18 THR CA C 18 61.565 61.565 61.457 0.108 17890 1653 1 3 . 1 1 18 18 THR CB C 18 70.165 70.165 69.216 0.949 17890 1654 1 3 . 1 1 18 18 THR H H 18 8.276 8.276 8.280 -0.004 17890 1655 1 3 . 1 1 19 19 LEU N N 19 125.265 125.265 119.905 5.360 17890 1656 1 3 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.982 0.311 17890 1657 1 3 . 1 1 19 19 LEU C C 19 175.689 175.689 175.361 0.328 17890 1658 1 3 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.557 -0.130 17890 1659 1 3 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.275 2.004 17890 1660 1 3 . 1 1 19 19 LEU H H 19 8.091 8.091 8.263 -0.172 17890 1661 1 3 . 1 1 20 20 SER N N 20 114.622 114.622 114.034 0.588 17890 1662 1 3 . 1 1 20 20 SER HA H 20 4.947 4.947 4.892 0.055 17890 1663 1 3 . 1 1 20 20 SER C C 20 174.220 174.220 172.819 1.401 17890 1664 1 3 . 1 1 20 20 SER CA C 20 56.583 56.583 57.615 -1.032 17890 1665 1 3 . 1 1 20 20 SER CB C 20 65.653 65.653 64.849 0.804 17890 1666 1 3 . 1 1 20 20 SER H H 20 7.316 7.316 7.958 -0.642 17890 1667 1 3 . 1 1 21 21 ALA N N 21 125.517 125.517 123.579 1.938 17890 1668 1 3 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.959 -0.291 17890 1669 1 3 . 1 1 21 21 ALA C C 21 177.960 177.960 177.066 0.894 17890 1670 1 3 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.387 1.623 17890 1671 1 3 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.761 -0.535 17890 1672 1 3 . 1 1 21 21 ALA H H 21 8.993 8.993 8.496 0.497 17890 1673 1 3 . 1 1 22 22 GLY N N 22 109.543 109.543 110.148 -0.605 17890 1674 1 3 . 1 1 22 22 GLY C C 22 170.422 170.422 171.804 -1.382 17890 1675 1 3 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.095 0.286 17890 1676 1 3 . 1 1 22 22 GLY H H 22 8.411 8.411 8.909 -0.498 17890 1677 1 3 . 1 1 23 23 ASN N N 23 119.649 119.649 119.154 0.495 17890 1678 1 3 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.624 0.263 17890 1679 1 3 . 1 1 23 23 ASN C C 23 175.207 175.207 174.604 0.603 17890 1680 1 3 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.668 -0.847 17890 1681 1 3 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.228 -0.473 17890 1682 1 3 . 1 1 23 23 ASN H H 23 8.092 8.092 8.427 -0.335 17890 1683 1 3 . 1 1 24 24 TYR N N 24 120.889 120.889 121.875 -0.986 17890 1684 1 3 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.153 0.102 17890 1685 1 3 . 1 1 24 24 TYR C C 24 175.667 175.667 174.460 1.207 17890 1686 1 3 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.266 0.848 17890 1687 1 3 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.666 0.160 17890 1688 1 3 . 1 1 24 24 TYR H H 24 9.914 9.914 8.948 0.966 17890 1689 1 3 . 1 1 25 25 ILE N N 25 115.978 115.978 113.475 2.503 17890 1690 1 3 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.045 0.041 17890 1691 1 3 . 1 1 25 25 ILE C C 25 175.200 175.200 174.181 1.019 17890 1692 1 3 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.673 0.872 17890 1693 1 3 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.753 -0.631 17890 1694 1 3 . 1 1 25 25 ILE H H 25 9.216 9.216 9.279 -0.063 17890 1695 1 3 . 1 1 26 26 ILE N N 26 123.957 123.957 122.673 1.284 17890 1696 1 3 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.245 -0.269 17890 1697 1 3 . 1 1 26 26 ILE C C 26 174.810 174.810 175.033 -0.223 17890 1698 1 3 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.154 0.455 17890 1699 1 3 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.050 1.073 17890 1700 1 3 . 1 1 26 26 ILE H H 26 9.559 9.559 8.935 0.624 17890 1701 1 3 . 1 1 27 27 TYR N N 27 121.371 121.371 124.050 -2.679 17890 1702 1 3 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.482 0.708 17890 1703 1 3 . 1 1 27 27 TYR C C 27 173.963 173.963 173.644 0.319 17890 1704 1 3 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.759 -0.090 17890 1705 1 3 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.769 0.929 17890 1706 1 3 . 1 1 27 27 TYR H H 27 9.378 9.378 9.072 0.306 17890 1707 1 3 . 1 1 28 28 ASN N N 28 121.991 121.991 120.296 1.695 17890 1708 1 3 . 1 1 28 28 ASN HA H 28 3.768 3.768 3.870 -0.102 17890 1709 1 3 . 1 1 28 28 ASN C C 28 174.352 174.352 175.803 -1.451 17890 1710 1 3 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.989 1.131 17890 1711 1 3 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.907 1.540 17890 1712 1 3 . 1 1 28 28 ASN H H 28 8.466 8.466 8.582 -0.116 17890 1713 1 3 . 1 1 29 29 ARG N N 29 121.103 121.103 123.666 -2.563 17890 1714 1 3 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.058 -0.197 17890 1715 1 3 . 1 1 29 29 ARG C C 29 173.635 173.635 176.921 -3.286 17890 1716 1 3 . 1 1 29 29 ARG CA C 29 59.293 59.293 56.947 2.346 17890 1717 1 3 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.247 0.152 17890 1718 1 3 . 1 1 29 29 ARG H H 29 7.756 7.756 7.995 -0.239 17890 1719 1 3 . 1 1 30 30 VAL N N 30 118.412 118.412 120.762 -2.350 17890 1720 1 3 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.963 -0.019 17890 1721 1 3 . 1 1 30 30 VAL C C 30 176.199 176.199 175.580 0.619 17890 1722 1 3 . 1 1 30 30 VAL CA C 30 62.577 62.577 62.658 -0.082 17890 1723 1 3 . 1 1 30 30 VAL CB C 30 30.222 30.222 31.783 -1.561 17890 1724 1 3 . 1 1 30 30 VAL H H 30 8.976 8.976 7.867 1.109 17890 1725 1 3 . 1 1 31 31 LEU N N 31 125.418 125.418 128.754 -3.336 17890 1726 1 3 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.284 0.201 17890 1727 1 3 . 1 1 31 31 LEU C C 31 179.123 179.123 177.238 1.885 17890 1728 1 3 . 1 1 31 31 LEU CA C 31 54.025 54.025 54.800 -0.774 17890 1729 1 3 . 1 1 31 31 LEU CB C 31 45.581 45.581 43.091 2.490 17890 1730 1 3 . 1 1 31 31 LEU H H 31 8.856 8.856 8.316 0.540 17890 1731 1 3 . 1 1 32 32 SER N N 32 116.890 116.890 116.268 0.622 17890 1732 1 3 . 1 1 32 32 SER HA H 32 5.365 5.365 4.647 0.718 17890 1733 1 3 . 1 1 32 32 SER CA C 32 57.269 57.269 57.017 0.252 17890 1734 1 3 . 1 1 32 32 SER CB C 32 62.213 62.213 63.283 -1.070 17890 1735 1 3 . 1 1 32 32 SER H H 32 9.307 9.307 8.613 0.694 17890 1736 1 3 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.351 -0.471 17890 1737 1 3 . 1 1 33 33 PRO C C 33 175.137 175.137 177.664 -2.527 17890 1738 1 3 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.966 0.320 17890 1739 1 3 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.568 0.463 17890 1740 1 3 . 1 1 34 34 ARG N N 34 110.279 110.279 117.442 -7.163 17890 1741 1 3 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.309 0.183 17890 1742 1 3 . 1 1 34 34 ARG C C 34 176.844 176.844 176.752 0.092 17890 1743 1 3 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.633 -1.197 17890 1744 1 3 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.190 0.394 17890 1745 1 3 . 1 1 34 34 ARG H H 34 7.257 7.257 7.865 -0.608 17890 1746 1 3 . 1 1 35 35 GLY N N 35 110.288 110.288 106.374 3.914 17890 1747 1 3 . 1 1 35 35 GLY C C 35 173.336 173.336 173.908 -0.572 17890 1748 1 3 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.812 2.218 17890 1749 1 3 . 1 1 35 35 GLY H H 35 8.589 8.589 7.688 0.901 17890 1750 1 3 . 1 1 36 36 GLU N N 36 116.838 116.838 120.010 -3.172 17890 1751 1 3 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.731 -0.383 17890 1752 1 3 . 1 1 36 36 GLU C C 36 176.915 176.915 175.116 1.799 17890 1753 1 3 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.397 1.510 17890 1754 1 3 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.821 -2.406 17890 1755 1 3 . 1 1 36 36 GLU H H 36 7.769 7.769 8.040 -0.271 17890 1756 1 3 . 1 1 37 37 LYS N N 37 123.775 123.775 122.784 0.991 17890 1757 1 3 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.118 0.305 17890 1758 1 3 . 1 1 37 37 LYS C C 37 176.067 176.067 175.547 0.520 17890 1759 1 3 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.831 -0.930 17890 1760 1 3 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.457 1.217 17890 1761 1 3 . 1 1 37 37 LYS H H 37 8.667 8.667 8.738 -0.071 17890 1762 1 3 . 1 1 38 38 LEU N N 38 126.658 126.658 127.606 -0.948 17890 1763 1 3 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.923 -0.696 17890 1764 1 3 . 1 1 38 38 LEU C C 38 174.332 174.332 175.141 -0.809 17890 1765 1 3 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.378 -0.035 17890 1766 1 3 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.423 -0.772 17890 1767 1 3 . 1 1 38 38 LEU H H 38 10.455 10.455 8.997 1.458 17890 1768 1 3 . 1 1 39 39 ALA N N 39 127.018 127.018 126.952 0.066 17890 1769 1 3 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.135 0.094 17890 1770 1 3 . 1 1 39 39 ALA C C 39 178.694 178.694 176.111 2.583 17890 1771 1 3 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.401 -0.176 17890 1772 1 3 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.639 0.710 17890 1773 1 3 . 1 1 39 39 ALA H H 39 8.773 8.773 8.532 0.241 17890 1774 1 3 . 1 1 40 40 LEU N N 40 126.771 126.771 123.169 3.602 17890 1775 1 3 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.595 -0.241 17890 1776 1 3 . 1 1 40 40 LEU C C 40 178.309 178.309 176.604 1.705 17890 1777 1 3 . 1 1 40 40 LEU CA C 40 56.845 56.845 55.882 0.963 17890 1778 1 3 . 1 1 40 40 LEU CB C 40 43.323 43.323 43.097 0.226 17890 1779 1 3 . 1 1 40 40 LEU H H 40 9.665 9.665 8.660 1.005 17890 1780 1 3 . 1 1 41 41 THR N N 41 126.578 126.578 124.543 2.035 17890 1781 1 3 . 1 1 41 41 THR HA H 41 4.916 4.916 5.147 -0.231 17890 1782 1 3 . 1 1 41 41 THR C C 41 172.547 172.547 173.446 -0.899 17890 1783 1 3 . 1 1 41 41 THR CA C 41 63.253 63.253 61.403 1.850 17890 1784 1 3 . 1 1 41 41 THR CB C 41 71.832 71.832 70.361 1.471 17890 1785 1 3 . 1 1 41 41 THR H H 41 9.802 9.802 9.062 0.740 17890 1786 1 3 . 1 1 42 42 TYR N N 42 130.506 130.506 129.456 1.050 17890 1787 1 3 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.677 0.425 17890 1788 1 3 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.972 -3.986 17890 1789 1 3 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.804 0.351 17890 1790 1 3 . 1 1 42 42 TYR H H 42 9.428 9.428 9.094 0.334 17890 1791 1 3 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.416 0.074 17890 1792 1 3 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.203 0.370 17890 1793 1 3 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.880 -0.236 17890 1794 1 3 . 1 1 44 44 GLY N N 44 113.736 113.736 107.080 6.656 17890 1795 1 3 . 1 1 44 44 GLY C C 44 171.790 171.790 173.279 -1.489 17890 1796 1 3 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.216 0.500 17890 1797 1 3 . 1 1 44 44 GLY H H 44 8.337 8.337 7.690 0.647 17890 1798 1 3 . 1 1 45 45 ARG N N 45 113.899 113.899 116.268 -2.369 17890 1799 1 3 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.508 0.068 17890 1800 1 3 . 1 1 45 45 ARG C C 45 175.151 175.151 173.494 1.657 17890 1801 1 3 . 1 1 45 45 ARG CA C 45 54.165 54.165 53.988 0.177 17890 1802 1 3 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.740 1.479 17890 1803 1 3 . 1 1 45 45 ARG H H 45 6.463 6.463 7.349 -0.886 17890 1804 1 3 . 1 1 46 46 GLN N N 46 119.000 119.000 118.092 0.908 17890 1805 1 3 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.465 -0.016 17890 1806 1 3 . 1 1 46 46 GLN C C 46 177.282 177.282 176.634 0.648 17890 1807 1 3 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.282 1.331 17890 1808 1 3 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.827 0.669 17890 1809 1 3 . 1 1 46 46 GLN H H 46 8.683 8.683 8.567 0.116 17890 1810 1 3 . 1 1 47 47 ARG N N 47 113.526 113.526 118.492 -4.966 17890 1811 1 3 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.064 -0.534 17890 1812 1 3 . 1 1 47 47 ARG C C 47 174.130 174.130 175.275 -1.145 17890 1813 1 3 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.246 1.570 17890 1814 1 3 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.223 1.847 17890 1815 1 3 . 1 1 47 47 ARG H H 47 9.677 9.677 8.610 1.067 17890 1816 1 3 . 1 1 48 48 THR N N 48 114.672 114.672 114.908 -0.236 17890 1817 1 3 . 1 1 48 48 THR HA H 48 4.938 4.938 4.732 0.206 17890 1818 1 3 . 1 1 48 48 THR CA C 48 59.987 59.987 59.759 0.228 17890 1819 1 3 . 1 1 48 48 THR CB C 48 71.947 71.947 71.016 0.931 17890 1820 1 3 . 1 1 48 48 THR H H 48 8.104 8.104 7.571 0.533 17890 1821 1 3 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.669 -0.301 17890 1822 1 3 . 1 1 49 49 PRO C C 49 175.651 175.651 176.518 -0.867 17890 1823 1 3 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.780 1.401 17890 1824 1 3 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.227 0.470 17890 1825 1 3 . 1 1 50 50 VAL N N 50 122.562 122.562 118.806 3.756 17890 1826 1 3 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.268 -0.321 17890 1827 1 3 . 1 1 50 50 VAL C C 50 174.493 174.493 175.582 -1.089 17890 1828 1 3 . 1 1 50 50 VAL CA C 50 63.811 63.811 60.854 2.957 17890 1829 1 3 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.668 -2.500 17890 1830 1 3 . 1 1 50 50 VAL H H 50 8.123 8.123 8.150 -0.027 17890 1831 1 3 . 1 1 51 51 THR N N 51 113.549 113.549 119.366 -5.817 17890 1832 1 3 . 1 1 51 51 THR HA H 51 5.372 5.372 4.984 0.388 17890 1833 1 3 . 1 1 51 51 THR C C 51 174.841 174.841 172.683 2.158 17890 1834 1 3 . 1 1 51 51 THR CA C 51 59.196 59.196 60.540 -1.344 17890 1835 1 3 . 1 1 51 51 THR CB C 51 72.703 72.703 71.747 0.956 17890 1836 1 3 . 1 1 51 51 THR H H 51 7.057 7.057 8.220 -1.163 17890 1837 1 3 . 1 1 52 52 VAL N N 52 107.374 107.374 120.604 -13.230 17890 1838 1 3 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.102 0.412 17890 1839 1 3 . 1 1 52 52 VAL C C 52 175.697 175.697 174.068 1.629 17890 1840 1 3 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.432 -0.960 17890 1841 1 3 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.260 -0.486 17890 1842 1 3 . 1 1 52 52 VAL H H 52 8.062 8.062 8.460 -0.398 17890 1843 1 3 . 1 1 53 53 SER N N 53 114.662 114.662 121.367 -6.705 17890 1844 1 3 . 1 1 53 53 SER HA H 53 4.690 4.690 5.030 -0.340 17890 1845 1 3 . 1 1 53 53 SER CA C 53 56.828 56.828 56.197 0.631 17890 1846 1 3 . 1 1 53 53 SER CB C 53 64.789 64.789 65.370 -0.581 17890 1847 1 3 . 1 1 53 53 SER H H 53 8.681 8.681 9.093 -0.412 17890 1848 1 3 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.570 0.206 17890 1849 1 3 . 1 1 54 54 PRO C C 54 177.724 177.724 176.833 0.891 17890 1850 1 3 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.556 0.869 17890 1851 1 3 . 1 1 54 54 PRO CB C 54 32.097 32.097 31.749 0.348 17890 1852 1 3 . 1 1 55 55 LEU N N 55 128.655 128.655 125.461 3.194 17890 1853 1 3 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.329 0.198 17890 1854 1 3 . 1 1 55 55 LEU C C 55 178.696 178.696 176.822 1.874 17890 1855 1 3 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.203 0.043 17890 1856 1 3 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.517 1.089 17890 1857 1 3 . 1 1 55 55 LEU H H 55 8.675 8.675 8.596 0.079 17890 1858 1 3 . 1 1 56 56 ASP N N 56 126.651 126.651 124.507 2.144 17890 1859 1 3 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.711 -0.002 17890 1860 1 3 . 1 1 56 56 ASP C C 56 177.729 177.729 176.641 1.088 17890 1861 1 3 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.474 0.149 17890 1862 1 3 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.992 -0.360 17890 1863 1 3 . 1 1 56 56 ASP H H 56 9.683 9.683 8.684 0.999 17890 1864 1 3 . 1 1 57 57 GLY N N 57 109.299 109.299 108.648 0.651 17890 1865 1 3 . 1 1 57 57 GLY C C 57 174.558 174.558 174.455 0.103 17890 1866 1 3 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.613 0.342 17890 1867 1 3 . 1 1 57 57 GLY H H 57 8.157 8.157 8.281 -0.124 17890 1868 1 3 . 1 1 58 58 SER N N 58 116.740 116.740 114.284 2.456 17890 1869 1 3 . 1 1 58 58 SER HA H 58 4.288 4.288 4.419 -0.131 17890 1870 1 3 . 1 1 58 58 SER C C 58 177.252 177.252 175.888 1.364 17890 1871 1 3 . 1 1 58 58 SER CA C 58 58.737 58.737 57.212 1.525 17890 1872 1 3 . 1 1 58 58 SER CB C 58 64.576 64.576 64.507 0.069 17890 1873 1 3 . 1 1 58 58 SER H H 58 8.328 8.328 7.927 0.401 17890 1874 1 3 . 1 1 59 59 SER N N 59 119.768 119.768 118.750 1.018 17890 1875 1 3 . 1 1 59 59 SER HA H 59 4.046 4.046 4.060 -0.014 17890 1876 1 3 . 1 1 59 59 SER C C 59 176.671 176.671 175.621 1.050 17890 1877 1 3 . 1 1 59 59 SER CA C 59 61.691 61.691 60.864 0.827 17890 1878 1 3 . 1 1 59 59 SER CB C 59 63.154 63.154 63.032 0.121 17890 1879 1 3 . 1 1 59 59 SER H H 59 9.020 9.020 8.746 0.274 17890 1880 1 3 . 1 1 60 60 GLU N N 60 119.133 119.133 119.434 -0.301 17890 1881 1 3 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.016 0.170 17890 1882 1 3 . 1 1 60 60 GLU C C 60 177.435 177.435 177.631 -0.196 17890 1883 1 3 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.400 1.633 17890 1884 1 3 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.434 -1.208 17890 1885 1 3 . 1 1 60 60 GLU H H 60 8.832 8.832 8.564 0.268 17890 1886 1 3 . 1 1 61 61 GLN N N 61 118.818 118.818 115.689 3.129 17890 1887 1 3 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.113 0.064 17890 1888 1 3 . 1 1 61 61 GLN C C 61 173.254 173.254 175.200 -1.946 17890 1889 1 3 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.789 -0.416 17890 1890 1 3 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.550 -2.628 17890 1891 1 3 . 1 1 61 61 GLN H H 61 7.648 7.648 7.706 -0.058 17890 1892 1 3 . 1 1 62 62 ALA N N 62 122.562 122.562 122.587 -0.025 17890 1893 1 3 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.564 0.500 17890 1894 1 3 . 1 1 62 62 ALA C C 62 176.637 176.637 175.219 1.418 17890 1895 1 3 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.276 -0.097 17890 1896 1 3 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.014 -0.419 17890 1897 1 3 . 1 1 62 62 ALA H H 62 7.315 7.315 7.062 0.253 17890 1898 1 3 . 1 1 63 63 TRP N N 63 124.787 124.787 120.889 3.898 17890 1899 1 3 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.346 -0.382 17890 1900 1 3 . 1 1 63 63 TRP C C 63 174.351 174.351 175.421 -1.070 17890 1901 1 3 . 1 1 63 63 TRP CA C 63 55.902 55.902 55.981 -0.079 17890 1902 1 3 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.821 -1.704 17890 1903 1 3 . 1 1 63 63 TRP H H 63 9.544 9.544 9.041 0.503 17890 1904 1 3 . 1 1 64 64 ILE N N 64 122.482 122.482 119.166 3.316 17890 1905 1 3 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.972 -0.278 17890 1906 1 3 . 1 1 64 64 ILE C C 64 177.078 177.078 174.211 2.867 17890 1907 1 3 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.582 0.449 17890 1908 1 3 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.498 -1.129 17890 1909 1 3 . 1 1 64 64 ILE H H 64 10.235 10.235 9.420 0.815 17890 1910 1 3 . 1 1 65 65 LEU N N 65 132.183 132.183 128.663 3.520 17890 1911 1 3 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.510 -0.045 17890 1912 1 3 . 1 1 65 65 LEU C C 65 177.048 177.048 174.473 2.575 17890 1913 1 3 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.809 0.539 17890 1914 1 3 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.207 -3.863 17890 1915 1 3 . 1 1 65 65 LEU H H 65 9.432 9.432 9.283 0.149 17890 1916 1 3 . 1 1 66 66 ARG N N 66 120.807 120.807 125.720 -4.913 17890 1917 1 3 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.931 -0.043 17890 1918 1 3 . 1 1 66 66 ARG C C 66 175.275 175.275 174.450 0.825 17890 1919 1 3 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.487 0.568 17890 1920 1 3 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.416 -1.425 17890 1921 1 3 . 1 1 66 66 ARG H H 66 8.491 8.491 8.564 -0.073 17890 1922 1 3 . 1 1 67 67 SER N N 67 119.709 119.709 117.700 2.009 17890 1923 1 3 . 1 1 67 67 SER HA H 67 3.186 3.186 3.446 -0.260 17890 1924 1 3 . 1 1 67 67 SER C C 67 174.508 174.508 173.598 0.910 17890 1925 1 3 . 1 1 67 67 SER CA C 67 58.521 58.521 58.907 -0.386 17890 1926 1 3 . 1 1 67 67 SER CB C 67 62.590 62.590 63.255 -0.665 17890 1927 1 3 . 1 1 67 67 SER H H 67 8.557 8.557 8.676 -0.119 17890 1928 1 3 . 1 1 68 68 TYR N N 68 131.011 131.011 127.396 3.615 17890 1929 1 3 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.637 -0.189 17890 1930 1 3 . 1 1 68 68 TYR C C 68 174.687 174.687 174.775 -0.088 17890 1931 1 3 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.841 0.924 17890 1932 1 3 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.892 -1.904 17890 1933 1 3 . 1 1 68 68 TYR H H 68 8.531 8.531 8.654 -0.123 17890 1934 1 3 . 1 1 69 69 ASP N N 69 117.066 117.066 119.844 -2.778 17890 1935 1 3 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.811 -0.186 17890 1936 1 3 . 1 1 69 69 ASP C C 69 176.455 176.455 176.533 -0.078 17890 1937 1 3 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.795 -0.704 17890 1938 1 3 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.859 -0.712 17890 1939 1 3 . 1 1 69 69 ASP H H 69 7.122 7.122 7.549 -0.427 17890 1940 1 3 . 1 1 70 70 SER N N 70 122.869 122.869 119.257 3.612 17890 1941 1 3 . 1 1 70 70 SER HA H 70 4.270 4.270 4.069 0.201 17890 1942 1 3 . 1 1 70 70 SER C C 70 177.010 177.010 176.147 0.863 17890 1943 1 3 . 1 1 70 70 SER CA C 70 60.837 60.837 61.925 -1.088 17890 1944 1 3 . 1 1 70 70 SER CB C 70 62.722 62.722 63.118 -0.396 17890 1945 1 3 . 1 1 70 70 SER H H 70 8.757 8.757 8.780 -0.023 17890 1946 1 3 . 1 1 71 71 ASN N N 71 119.873 119.873 119.664 0.209 17890 1947 1 3 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.605 -0.034 17890 1948 1 3 . 1 1 71 71 ASN C C 71 176.226 176.226 176.032 0.194 17890 1949 1 3 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.326 0.388 17890 1950 1 3 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.429 0.211 17890 1951 1 3 . 1 1 71 71 ASN H H 71 8.342 8.342 8.625 -0.283 17890 1952 1 3 . 1 1 72 72 SER N N 72 112.202 112.202 113.072 -0.870 17890 1953 1 3 . 1 1 72 72 SER HA H 72 4.567 4.567 4.696 -0.129 17890 1954 1 3 . 1 1 72 72 SER C C 72 173.789 173.789 173.145 0.644 17890 1955 1 3 . 1 1 72 72 SER CA C 72 57.816 57.816 57.543 0.273 17890 1956 1 3 . 1 1 72 72 SER CB C 72 63.935 63.935 64.624 -0.689 17890 1957 1 3 . 1 1 72 72 SER H H 72 7.560 7.560 7.626 -0.066 17890 1958 1 3 . 1 1 73 73 ASN N N 73 117.437 117.437 118.580 -1.143 17890 1959 1 3 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.442 0.092 17890 1960 1 3 . 1 1 73 73 ASN C C 73 173.647 173.647 174.539 -0.892 17890 1961 1 3 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.474 0.049 17890 1962 1 3 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.410 -0.197 17890 1963 1 3 . 1 1 73 73 ASN H H 73 7.940 7.940 7.834 0.106 17890 1964 1 3 . 1 1 74 74 THR N N 74 104.227 104.227 109.609 -5.382 17890 1965 1 3 . 1 1 74 74 THR HA H 74 5.477 5.477 4.989 0.488 17890 1966 1 3 . 1 1 74 74 THR C C 74 176.824 176.824 173.966 2.858 17890 1967 1 3 . 1 1 74 74 THR CA C 74 59.768 59.768 61.663 -1.895 17890 1968 1 3 . 1 1 74 74 THR CB C 74 71.985 71.985 70.037 1.948 17890 1969 1 3 . 1 1 74 74 THR H H 74 7.737 7.737 7.750 -0.013 17890 1970 1 3 . 1 1 75 75 TRP N N 75 124.636 124.636 123.416 1.220 17890 1971 1 3 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.409 -0.202 17890 1972 1 3 . 1 1 75 75 TRP C C 75 175.876 175.876 176.098 -0.222 17890 1973 1 3 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.210 1.396 17890 1974 1 3 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.705 -0.189 17890 1975 1 3 . 1 1 75 75 TRP H H 75 9.442 9.442 9.070 0.372 17890 1976 1 3 . 1 1 76 76 THR N N 76 110.544 110.544 115.449 -4.905 17890 1977 1 3 . 1 1 76 76 THR HA H 76 5.129 5.129 5.117 0.012 17890 1978 1 3 . 1 1 76 76 THR C C 76 174.506 174.506 174.640 -0.134 17890 1979 1 3 . 1 1 76 76 THR CA C 76 60.561 60.561 61.525 -0.964 17890 1980 1 3 . 1 1 76 76 THR CB C 76 71.688 71.688 69.836 1.852 17890 1981 1 3 . 1 1 76 76 THR H H 76 9.415 9.415 9.338 0.077 17890 1982 1 3 . 1 1 77 77 ILE N N 77 121.567 121.567 125.268 -3.701 17890 1983 1 3 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.201 -0.062 17890 1984 1 3 . 1 1 77 77 ILE C C 77 176.148 176.148 175.264 0.884 17890 1985 1 3 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.577 2.131 17890 1986 1 3 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.038 1.949 17890 1987 1 3 . 1 1 77 77 ILE H H 77 9.255 9.255 8.089 1.166 17890 1988 1 3 . 1 1 78 78 SER N N 78 122.269 122.269 121.946 0.323 17890 1989 1 3 . 1 1 78 78 SER HA H 78 5.601 5.601 5.405 0.196 17890 1990 1 3 . 1 1 78 78 SER CA C 78 55.835 55.835 55.797 0.038 17890 1991 1 3 . 1 1 78 78 SER CB C 78 65.858 65.858 66.282 -0.424 17890 1992 1 3 . 1 1 78 78 SER H H 78 9.226 9.226 8.711 0.515 17890 1993 1 3 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.176 -0.312 17890 1994 1 3 . 1 1 79 79 PRO C C 79 178.175 178.175 177.327 0.848 17890 1995 1 3 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.173 0.711 17890 1996 1 3 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.732 -1.460 17890 1997 1 3 . 1 1 80 80 VAL N N 80 121.906 121.906 121.784 0.122 17890 1998 1 3 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.734 -0.153 17890 1999 1 3 . 1 1 80 80 VAL C C 80 177.751 177.751 177.277 0.474 17890 2000 1 3 . 1 1 80 80 VAL CA C 80 66.067 66.067 65.122 0.945 17890 2001 1 3 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.447 0.038 17890 2002 1 3 . 1 1 80 80 VAL H H 80 7.328 7.328 8.293 -0.965 17890 2003 1 3 . 1 1 81 81 GLY N N 81 104.643 104.643 106.246 -1.603 17890 2004 1 3 . 1 1 81 81 GLY C C 81 174.979 174.979 174.392 0.587 17890 2005 1 3 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.609 -0.521 17890 2006 1 3 . 1 1 81 81 GLY H H 81 8.949 8.949 8.114 0.835 17890 2007 1 3 . 1 1 82 82 SER N N 82 111.865 111.865 114.847 -2.982 17890 2008 1 3 . 1 1 82 82 SER HA H 82 4.646 4.646 4.849 -0.203 17890 2009 1 3 . 1 1 82 82 SER CA C 82 55.441 55.441 56.099 -0.658 17890 2010 1 3 . 1 1 82 82 SER CB C 82 62.277 62.277 63.608 -1.331 17890 2011 1 3 . 1 1 82 82 SER H H 82 6.968 6.968 7.187 -0.219 17890 2012 1 3 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.603 -0.256 17890 2013 1 3 . 1 1 83 83 PRO C C 83 176.660 176.660 176.997 -0.337 17890 2014 1 3 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.515 0.688 17890 2015 1 3 . 1 1 83 83 PRO CB C 83 32.819 32.819 32.101 0.718 17890 2016 1 3 . 1 1 84 84 ASN N N 84 116.542 116.542 113.620 2.922 17890 2017 1 3 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.522 0.479 17890 2018 1 3 . 1 1 84 84 ASN C C 84 175.825 175.825 175.038 0.787 17890 2019 1 3 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.951 -1.060 17890 2020 1 3 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.049 0.695 17890 2021 1 3 . 1 1 84 84 ASN H H 84 8.502 8.502 8.375 0.127 17890 2022 1 3 . 1 1 85 85 SER N N 85 114.633 114.633 113.573 1.060 17890 2023 1 3 . 1 1 85 85 SER HA H 85 4.624 4.624 5.089 -0.465 17890 2024 1 3 . 1 1 85 85 SER C C 85 172.963 172.963 172.888 0.075 17890 2025 1 3 . 1 1 85 85 SER CA C 85 59.210 59.210 57.623 1.587 17890 2026 1 3 . 1 1 85 85 SER CB C 85 64.697 64.697 66.913 -2.216 17890 2027 1 3 . 1 1 85 85 SER H H 85 7.980 7.980 7.698 0.282 17890 2028 1 3 . 1 1 86 86 GLN N N 86 119.016 119.016 118.284 0.732 17890 2029 1 3 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.273 0.173 17890 2030 1 3 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.519 -0.067 17890 2031 1 3 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.415 -0.017 17890 2032 1 3 . 1 1 86 86 GLN H H 86 9.399 9.399 9.205 0.194 17890 2033 1 3 . 1 1 87 87 ILE N N 87 119.691 119.691 119.432 0.259 17890 2034 1 3 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.123 -0.548 17890 2035 1 3 . 1 1 87 87 ILE C C 87 176.505 176.505 176.140 0.365 17890 2036 1 3 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.947 4.547 17890 2037 1 3 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.412 -0.215 17890 2038 1 3 . 1 1 87 87 ILE H H 87 8.970 8.970 8.285 0.685 17890 2039 1 3 . 1 1 88 88 GLY N N 88 118.378 118.378 114.955 3.423 17890 2040 1 3 . 1 1 88 88 GLY C C 88 171.397 171.397 171.688 -0.291 17890 2041 1 3 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.103 -1.499 17890 2042 1 3 . 1 1 88 88 GLY H H 88 9.752 9.752 9.114 0.638 17890 2043 1 3 . 1 1 89 89 TRP N N 89 122.749 122.749 122.242 0.507 17890 2044 1 3 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.477 -0.879 17890 2045 1 3 . 1 1 89 89 TRP C C 89 175.924 175.924 174.929 0.995 17890 2046 1 3 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.666 0.618 17890 2047 1 3 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.285 -2.199 17890 2048 1 3 . 1 1 89 89 TRP H H 89 8.215 8.215 8.267 -0.052 17890 2049 1 3 . 1 1 90 90 GLY N N 90 116.305 116.305 111.566 4.739 17890 2050 1 3 . 1 1 90 90 GLY C C 90 173.725 173.725 172.488 1.237 17890 2051 1 3 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.582 0.473 17890 2052 1 3 . 1 1 90 90 GLY H H 90 8.922 8.922 8.293 0.629 17890 2053 1 3 . 1 1 91 91 ALA N N 91 123.795 123.795 122.104 1.691 17890 2054 1 3 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.155 0.088 17890 2055 1 3 . 1 1 91 91 ALA C C 91 178.510 178.510 178.956 -0.446 17890 2056 1 3 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.453 0.037 17890 2057 1 3 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.797 -0.388 17890 2058 1 3 . 1 1 91 91 ALA H H 91 8.367 8.367 8.188 0.179 17890 2059 1 3 . 1 1 92 92 GLY N N 92 108.871 108.871 112.823 -3.952 17890 2060 1 3 . 1 1 92 92 GLY C C 92 174.528 174.528 174.819 -0.291 17890 2061 1 3 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.730 0.528 17890 2062 1 3 . 1 1 92 92 GLY H H 92 8.776 8.776 8.618 0.158 17890 2063 1 3 . 1 1 93 93 ASN N N 93 114.921 114.921 117.174 -2.253 17890 2064 1 3 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.778 -0.329 17890 2065 1 3 . 1 1 93 93 ASN C C 93 172.774 172.774 174.065 -1.291 17890 2066 1 3 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.390 0.583 17890 2067 1 3 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.966 -0.637 17890 2068 1 3 . 1 1 93 93 ASN H H 93 8.647 8.647 8.280 0.367 17890 2069 1 3 . 1 1 94 94 VAL N N 94 112.437 112.437 112.733 -0.296 17890 2070 1 3 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.638 0.427 17890 2071 1 3 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.335 -1.420 17890 2072 1 3 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.332 -0.177 17890 2073 1 3 . 1 1 94 94 VAL H H 94 6.989 6.989 7.447 -0.458 17890 2074 1 3 . 1 1 95 95 PRO HA H 95 4.928 4.928 5.009 -0.081 17890 2075 1 3 . 1 1 95 95 PRO C C 95 176.041 176.041 176.083 -0.042 17890 2076 1 3 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.421 -1.220 17890 2077 1 3 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.506 -0.781 17890 2078 1 3 . 1 1 96 96 VAL N N 96 113.564 113.564 117.164 -3.600 17890 2079 1 3 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.895 -0.160 17890 2080 1 3 . 1 1 96 96 VAL C C 96 173.656 173.656 174.936 -1.280 17890 2081 1 3 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.429 -0.576 17890 2082 1 3 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.676 1.477 17890 2083 1 3 . 1 1 96 96 VAL H H 96 8.199 8.199 8.808 -0.609 17890 2084 1 3 . 1 1 97 97 VAL N N 97 122.328 122.328 122.475 -0.147 17890 2085 1 3 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.780 -0.149 17890 2086 1 3 . 1 1 97 97 VAL C C 97 174.776 174.776 175.760 -0.984 17890 2087 1 3 . 1 1 97 97 VAL CA C 97 63.657 63.657 62.834 0.823 17890 2088 1 3 . 1 1 97 97 VAL CB C 97 31.128 31.128 32.106 -0.978 17890 2089 1 3 . 1 1 97 97 VAL H H 97 8.957 8.957 8.389 0.568 17890 2090 1 3 . 1 1 98 98 LEU N N 98 130.258 130.258 125.696 4.562 17890 2091 1 3 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.887 0.163 17890 2092 1 3 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.609 1.214 17890 2093 1 3 . 1 1 98 98 LEU CB C 98 46.118 46.118 44.348 1.770 17890 2094 1 3 . 1 1 98 98 LEU H H 98 9.245 9.245 9.017 0.228 17890 2095 1 3 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.786 -0.007 17890 2096 1 3 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.952 -0.463 17890 2097 1 3 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.033 -0.579 17890 2098 1 3 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.746 -0.761 17890 2099 1 3 . 1 1 100 100 PRO C C 100 177.309 177.309 175.965 1.344 17890 2100 1 3 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.201 0.623 17890 2101 1 3 . 1 1 100 100 PRO CB C 100 32.105 32.105 30.034 2.071 17890 2102 1 3 . 1 1 101 101 ASN N N 101 119.284 119.284 119.712 -0.428 17890 2103 1 3 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.521 0.021 17890 2104 1 3 . 1 1 101 101 ASN C C 101 171.920 171.920 174.710 -2.790 17890 2105 1 3 . 1 1 101 101 ASN CA C 101 53.200 53.200 52.801 0.399 17890 2106 1 3 . 1 1 101 101 ASN CB C 101 37.625 37.625 38.572 -0.947 17890 2107 1 3 . 1 1 101 101 ASN H H 101 7.273 7.273 8.014 -0.741 17890 2108 1 3 . 1 1 102 102 ASN N N 102 115.674 115.674 114.311 1.363 17890 2109 1 3 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.396 -0.478 17890 2110 1 3 . 1 1 102 102 ASN C C 102 173.264 173.264 173.868 -0.604 17890 2111 1 3 . 1 1 102 102 ASN CA C 102 54.039 54.039 54.091 -0.052 17890 2112 1 3 . 1 1 102 102 ASN CB C 102 36.982 36.982 35.726 1.256 17890 2113 1 3 . 1 1 102 102 ASN H H 102 8.197 8.197 8.271 -0.074 17890 2114 1 3 . 1 1 103 103 TYR N N 103 118.775 118.775 117.569 1.206 17890 2115 1 3 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.244 0.241 17890 2116 1 3 . 1 1 103 103 TYR C C 103 175.248 175.248 175.331 -0.083 17890 2117 1 3 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.896 -2.406 17890 2118 1 3 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.983 -1.451 17890 2119 1 3 . 1 1 103 103 TYR H H 103 7.745 7.745 8.136 -0.391 17890 2120 1 3 . 1 1 104 104 VAL N N 104 116.205 116.205 114.935 1.270 17890 2121 1 3 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.963 0.014 17890 2122 1 3 . 1 1 104 104 VAL C C 104 174.361 174.361 173.867 0.494 17890 2123 1 3 . 1 1 104 104 VAL CA C 104 58.251 58.251 60.133 -1.882 17890 2124 1 3 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.532 0.011 17890 2125 1 3 . 1 1 104 104 VAL H H 104 7.498 7.498 8.054 -0.556 17890 2126 1 3 . 1 1 105 105 TRP N N 105 119.557 119.557 120.861 -1.304 17890 2127 1 3 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.065 -0.190 17890 2128 1 3 . 1 1 105 105 TRP C C 105 175.526 175.526 176.193 -0.667 17890 2129 1 3 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.335 -0.451 17890 2130 1 3 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.535 0.004 17890 2131 1 3 . 1 1 105 105 TRP H H 105 8.926 8.926 9.066 -0.140 17890 2132 1 3 . 1 1 106 106 THR N N 106 120.480 120.480 119.853 0.627 17890 2133 1 3 . 1 1 106 106 THR HA H 106 4.966 4.966 4.886 0.080 17890 2134 1 3 . 1 1 106 106 THR C C 106 174.177 174.177 174.178 -0.001 17890 2135 1 3 . 1 1 106 106 THR CA C 106 62.091 62.091 63.841 -1.750 17890 2136 1 3 . 1 1 106 106 THR CB C 106 69.649 69.649 68.874 0.776 17890 2137 1 3 . 1 1 106 106 THR H H 106 9.525 9.525 9.259 0.266 17890 2138 1 3 . 1 1 107 107 LEU N N 107 127.146 127.146 129.480 -2.334 17890 2139 1 3 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.158 -0.331 17890 2140 1 3 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.586 0.124 17890 2141 1 3 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.854 -2.331 17890 2142 1 3 . 1 1 107 107 LEU H H 107 7.591 7.591 8.704 -1.113 17890 2143 1 3 . 1 1 108 108 THR N N 108 119.928 119.928 120.562 -0.634 17890 2144 1 3 . 1 1 108 108 THR HA H 108 4.411 4.411 4.656 -0.245 17890 2145 1 3 . 1 1 108 108 THR C C 108 173.319 173.319 173.048 0.271 17890 2146 1 3 . 1 1 108 108 THR CA C 108 62.243 62.243 61.687 0.556 17890 2147 1 3 . 1 1 108 108 THR CB C 108 70.138 70.138 70.960 -0.822 17890 2148 1 3 . 1 1 108 108 THR H H 108 8.141 8.141 8.923 -0.782 17890 2149 1 3 . 1 1 109 109 LEU N N 109 130.557 130.557 130.500 0.057 17890 2150 1 3 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.035 -0.490 17890 2151 1 3 . 1 1 109 109 LEU C C 109 175.217 175.217 176.369 -1.152 17890 2152 1 3 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.278 0.008 17890 2153 1 3 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.988 -2.382 17890 2154 1 3 . 1 1 109 109 LEU H H 109 8.924 8.924 8.729 0.195 17890 2155 1 3 . 1 1 110 110 THR N N 110 120.160 120.160 116.461 3.699 17890 2156 1 3 . 1 1 110 110 THR HA H 110 4.911 4.911 4.763 0.148 17890 2157 1 3 . 1 1 110 110 THR CA C 110 60.141 60.141 60.415 -0.274 17890 2158 1 3 . 1 1 110 110 THR CB C 110 72.785 72.785 71.274 1.511 17890 2159 1 3 . 1 1 110 110 THR H H 110 7.677 7.677 8.701 -1.024 17890 2160 1 3 . 1 1 111 111 SER HA H 111 4.204 4.204 4.015 0.189 17890 2161 1 3 . 1 1 111 111 SER C C 111 174.755 174.755 175.057 -0.302 17890 2162 1 3 . 1 1 111 111 SER CA C 111 60.710 60.710 60.032 0.678 17890 2163 1 3 . 1 1 111 111 SER CB C 111 62.660 62.660 62.979 -0.319 17890 2164 1 3 . 1 1 112 112 GLY N N 112 107.313 107.313 107.486 -0.173 17890 2165 1 3 . 1 1 112 112 GLY C C 112 173.023 173.023 172.934 0.089 17890 2166 1 3 . 1 1 112 112 GLY CA C 112 44.150 44.150 44.942 -0.792 17890 2167 1 3 . 1 1 112 112 GLY H H 112 8.249 8.249 7.519 0.730 17890 2168 1 3 . 1 1 113 113 GLY N N 113 105.618 105.618 107.797 -2.179 17890 2169 1 3 . 1 1 113 113 GLY C C 113 175.844 175.844 171.812 4.032 17890 2170 1 3 . 1 1 113 113 GLY CA C 113 42.759 42.759 46.009 -3.250 17890 2171 1 3 . 1 1 113 113 GLY H H 113 7.444 7.444 7.507 -0.063 17890 2172 1 3 . 1 1 114 114 TYR N N 114 121.548 121.548 118.117 3.431 17890 2173 1 3 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.480 -0.628 17890 2174 1 3 . 1 1 114 114 TYR C C 114 175.605 175.605 174.245 1.360 17890 2175 1 3 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.526 4.737 17890 2176 1 3 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.493 -4.560 17890 2177 1 3 . 1 1 114 114 TYR H H 114 9.677 9.677 9.002 0.675 17890 2178 1 3 . 1 1 115 115 ASN N N 115 123.274 123.274 117.465 5.809 17890 2179 1 3 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.236 -0.138 17890 2180 1 3 . 1 1 115 115 ASN C C 115 174.355 174.355 173.008 1.347 17890 2181 1 3 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.513 -1.467 17890 2182 1 3 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.663 -2.314 17890 2183 1 3 . 1 1 115 115 ASN H H 115 9.350 9.350 8.974 0.376 17890 2184 1 3 . 1 1 116 116 ILE N N 116 130.611 130.611 122.231 8.380 17890 2185 1 3 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.741 -0.502 17890 2186 1 3 . 1 1 116 116 ILE C C 116 173.998 173.998 173.897 0.101 17890 2187 1 3 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.180 2.019 17890 2188 1 3 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.684 -2.583 17890 2189 1 3 . 1 1 116 116 ILE H H 116 9.473 9.473 8.613 0.860 17890 2190 1 3 . 1 1 117 117 GLN N N 117 121.633 121.633 124.794 -3.161 17890 2191 1 3 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.021 0.914 17890 2192 1 3 . 1 1 117 117 GLN C C 117 177.902 177.902 175.732 2.170 17890 2193 1 3 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.858 -0.538 17890 2194 1 3 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.459 3.998 17890 2195 1 3 . 1 1 117 117 GLN H H 117 8.781 8.781 8.893 -0.112 17890 2196 1 3 . 1 1 118 118 ASP N N 118 116.836 116.836 120.568 -3.732 17890 2197 1 3 . 1 1 118 118 ASP HA H 118 4.783 4.783 4.065 0.718 17890 2198 1 3 . 1 1 118 118 ASP C C 118 178.084 178.084 177.055 1.029 17890 2199 1 3 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.200 -1.430 17890 2200 1 3 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.223 -0.855 17890 2201 1 3 . 1 1 118 118 ASP H H 118 9.330 9.330 9.075 0.255 17890 2202 1 3 . 1 1 119 119 GLY N N 119 111.037 111.037 107.697 3.340 17890 2203 1 3 . 1 1 119 119 GLY C C 119 174.196 174.196 174.987 -0.791 17890 2204 1 3 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.956 2.020 17890 2205 1 3 . 1 1 119 119 GLY H H 119 8.986 8.986 8.452 0.534 17890 2206 1 3 . 1 1 120 120 LYS N N 120 114.809 114.809 121.011 -6.202 17890 2207 1 3 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.561 -0.212 17890 2208 1 3 . 1 1 120 120 LYS C C 120 175.174 175.174 176.706 -1.532 17890 2209 1 3 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.498 1.435 17890 2210 1 3 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.741 -0.265 17890 2211 1 3 . 1 1 120 120 LYS H H 120 7.045 7.045 8.547 -1.502 17890 2212 1 3 . 1 1 121 121 ARG N N 121 116.291 116.291 114.550 1.741 17890 2213 1 3 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.013 -0.427 17890 2214 1 3 . 1 1 121 121 ARG C C 121 175.097 175.097 176.984 -1.887 17890 2215 1 3 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.425 0.644 17890 2216 1 3 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.578 0.045 17890 2217 1 3 . 1 1 121 121 ARG H H 121 7.683 7.683 8.282 -0.599 17890 2218 1 3 . 1 1 122 122 THR N N 122 113.730 113.730 109.362 4.368 17890 2219 1 3 . 1 1 122 122 THR HA H 122 4.540 4.540 4.265 0.275 17890 2220 1 3 . 1 1 122 122 THR C C 122 175.302 175.302 174.609 0.693 17890 2221 1 3 . 1 1 122 122 THR CA C 122 62.871 62.871 63.927 -1.056 17890 2222 1 3 . 1 1 122 122 THR CB C 122 71.552 71.552 69.911 1.641 17890 2223 1 3 . 1 1 122 122 THR H H 122 11.059 11.059 8.060 2.999 17890 2224 1 3 . 1 1 123 123 VAL N N 123 118.350 118.350 113.846 4.504 17890 2225 1 3 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.833 -0.023 17890 2226 1 3 . 1 1 123 123 VAL C C 123 174.730 174.730 173.439 1.291 17890 2227 1 3 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.865 0.446 17890 2228 1 3 . 1 1 123 123 VAL CB C 123 37.082 37.082 35.161 1.921 17890 2229 1 3 . 1 1 123 123 VAL H H 123 8.181 8.181 7.235 0.946 17890 2230 1 3 . 1 1 124 124 SER N N 124 113.053 113.053 114.016 -0.963 17890 2231 1 3 . 1 1 124 124 SER HA H 124 5.820 5.820 5.189 0.631 17890 2232 1 3 . 1 1 124 124 SER C C 124 175.521 175.521 173.654 1.867 17890 2233 1 3 . 1 1 124 124 SER CA C 124 58.087 58.087 56.998 1.089 17890 2234 1 3 . 1 1 124 124 SER CB C 124 67.405 67.405 65.833 1.572 17890 2235 1 3 . 1 1 124 124 SER H H 124 9.138 9.138 8.694 0.444 17890 2236 1 3 . 1 1 125 125 TRP N N 125 124.900 124.900 124.239 0.661 17890 2237 1 3 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.941 0.669 17890 2238 1 3 . 1 1 125 125 TRP C C 125 178.114 178.114 177.441 0.673 17890 2239 1 3 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.289 -0.816 17890 2240 1 3 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.055 0.968 17890 2241 1 3 . 1 1 125 125 TRP H H 125 8.843 8.843 7.968 0.875 17890 2242 1 3 . 1 1 126 126 SER N N 126 119.243 119.243 113.734 5.509 17890 2243 1 3 . 1 1 126 126 SER HA H 126 5.443 5.443 5.360 0.083 17890 2244 1 3 . 1 1 126 126 SER C C 126 171.668 171.668 172.907 -1.239 17890 2245 1 3 . 1 1 126 126 SER CA C 126 58.696 58.696 57.035 1.661 17890 2246 1 3 . 1 1 126 126 SER CB C 126 66.176 66.176 66.399 -0.223 17890 2247 1 3 . 1 1 126 126 SER H H 126 9.835 9.835 9.218 0.617 17890 2248 1 3 . 1 1 127 127 LEU N N 127 113.708 113.708 117.971 -4.263 17890 2249 1 3 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.720 0.435 17890 2250 1 3 . 1 1 127 127 LEU C C 127 176.563 176.563 176.810 -0.247 17890 2251 1 3 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.258 -0.613 17890 2252 1 3 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.681 -1.985 17890 2253 1 3 . 1 1 127 127 LEU H H 127 6.559 6.559 7.916 -1.357 17890 2254 1 3 . 1 1 128 128 ASN N N 128 121.739 121.739 119.278 2.461 17890 2255 1 3 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.931 -0.242 17890 2256 1 3 . 1 1 128 128 ASN C C 128 175.452 175.452 175.401 0.051 17890 2257 1 3 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.991 1.016 17890 2258 1 3 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.200 -0.909 17890 2259 1 3 . 1 1 128 128 ASN H H 128 8.662 8.662 9.320 -0.658 17890 2260 1 3 . 1 1 129 129 ASN N N 129 119.586 119.586 116.330 3.256 17890 2261 1 3 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.948 0.049 17890 2262 1 3 . 1 1 129 129 ASN C C 129 175.900 175.900 174.787 1.113 17890 2263 1 3 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.438 0.795 17890 2264 1 3 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.080 0.176 17890 2265 1 3 . 1 1 129 129 ASN H H 129 10.962 10.962 8.799 2.163 17890 2266 1 3 . 1 1 130 130 ALA N N 130 128.292 128.292 122.182 6.110 17890 2267 1 3 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.003 -0.433 17890 2268 1 3 . 1 1 130 130 ALA C C 130 172.620 172.620 176.355 -3.735 17890 2269 1 3 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.355 -0.716 17890 2270 1 3 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.269 -1.169 17890 2271 1 3 . 1 1 130 130 ALA H H 130 10.629 10.629 8.548 2.081 17890 2272 1 3 . 1 1 131 131 THR N N 131 105.584 105.584 110.573 -4.989 17890 2273 1 3 . 1 1 131 131 THR HA H 131 4.462 4.462 4.410 0.052 17890 2274 1 3 . 1 1 131 131 THR C C 131 173.552 173.552 174.533 -0.981 17890 2275 1 3 . 1 1 131 131 THR CA C 131 58.338 58.338 60.844 -2.506 17890 2276 1 3 . 1 1 131 131 THR CB C 131 71.569 71.569 70.006 1.563 17890 2277 1 3 . 1 1 131 131 THR H H 131 7.092 7.092 7.778 -0.686 17890 2278 1 3 . 1 1 132 132 ALA N N 132 121.773 121.773 122.598 -0.825 17890 2279 1 3 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.052 -0.303 17890 2280 1 3 . 1 1 132 132 ALA C C 132 178.819 178.819 178.501 0.318 17890 2281 1 3 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.965 1.319 17890 2282 1 3 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.639 -0.412 17890 2283 1 3 . 1 1 132 132 ALA H H 132 8.952 8.952 8.350 0.602 17890 2284 1 3 . 1 1 133 133 GLY N N 133 113.965 113.965 111.903 2.062 17890 2285 1 3 . 1 1 133 133 GLY C C 133 173.453 173.453 174.154 -0.701 17890 2286 1 3 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.904 0.262 17890 2287 1 3 . 1 1 133 133 GLY H H 133 9.016 9.016 8.695 0.321 17890 2288 1 3 . 1 1 134 134 GLU N N 134 123.460 123.460 121.188 2.272 17890 2289 1 3 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.332 -0.374 17890 2290 1 3 . 1 1 134 134 GLU C C 134 176.120 176.120 176.059 0.061 17890 2291 1 3 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.906 1.493 17890 2292 1 3 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.938 0.447 17890 2293 1 3 . 1 1 134 134 GLU H H 134 7.598 7.598 7.606 -0.008 17890 2294 1 3 . 1 1 135 135 GLU N N 135 122.633 122.633 125.707 -3.074 17890 2295 1 3 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.237 0.074 17890 2296 1 3 . 1 1 135 135 GLU C C 135 176.014 176.014 176.583 -0.569 17890 2297 1 3 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.589 -0.407 17890 2298 1 3 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.234 -0.781 17890 2299 1 3 . 1 1 135 135 GLU H H 135 8.258 8.258 8.640 -0.382 17890 2300 1 3 . 1 1 136 136 VAL N N 136 123.635 123.635 125.362 -1.727 17890 2301 1 3 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.858 -0.166 17890 2302 1 3 . 1 1 136 136 VAL C C 136 173.932 173.932 175.558 -1.626 17890 2303 1 3 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.563 0.269 17890 2304 1 3 . 1 1 136 136 VAL CB C 136 31.864 31.864 31.695 0.169 17890 2305 1 3 . 1 1 136 136 VAL H H 136 7.267 7.267 7.712 -0.445 17890 2306 1 3 . 1 1 137 137 SER N N 137 118.950 118.950 118.030 0.920 17890 2307 1 3 . 1 1 137 137 SER HA H 137 4.887 4.887 4.875 0.011 17890 2308 1 3 . 1 1 137 137 SER C C 137 173.780 173.780 172.932 0.848 17890 2309 1 3 . 1 1 137 137 SER CA C 137 57.895 57.895 56.197 1.698 17890 2310 1 3 . 1 1 137 137 SER CB C 137 65.027 65.027 65.630 -0.604 17890 2311 1 3 . 1 1 137 137 SER H H 137 8.454 8.454 8.521 -0.067 17890 2312 1 3 . 1 1 138 138 ILE N N 138 123.511 123.511 121.033 2.478 17890 2313 1 3 . 1 1 138 138 ILE HA H 138 4.248 4.248 4.998 -0.750 17890 2314 1 3 . 1 1 138 138 ILE C C 138 176.142 176.142 175.364 0.778 17890 2315 1 3 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.525 1.325 17890 2316 1 3 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.596 -3.001 17890 2317 1 3 . 1 1 138 138 ILE H H 138 7.915 7.915 8.219 -0.304 17890 2318 1 3 . 1 1 139 139 GLY N N 139 115.638 115.638 111.294 4.344 17890 2319 1 3 . 1 1 139 139 GLY C C 139 171.947 171.947 172.242 -0.295 17890 2320 1 3 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.234 1.852 17890 2321 1 3 . 1 1 139 139 GLY H H 139 8.490 8.490 8.143 0.347 17890 2322 1 3 . 1 1 140 140 ALA N N 140 128.563 128.563 122.750 5.813 17890 2323 1 3 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.401 -0.005 17890 2324 1 3 . 1 1 140 140 ALA C C 140 177.956 177.956 176.996 0.960 17890 2325 1 3 . 1 1 140 140 ALA CA C 140 52.646 52.646 52.083 0.563 17890 2326 1 3 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.549 -0.345 17890 2327 1 3 . 1 1 140 140 ALA H H 140 8.531 8.531 8.262 0.269 17890 2328 1 3 . 1 1 141 141 ASP N N 141 120.886 120.886 119.100 1.786 17890 2329 1 3 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.435 0.163 17890 2330 1 3 . 1 1 141 141 ASP C C 141 175.411 175.411 174.683 0.728 17890 2331 1 3 . 1 1 141 141 ASP CA C 141 53.916 53.916 54.784 -0.868 17890 2332 1 3 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.061 -0.369 17890 2333 1 3 . 1 1 141 141 ASP H H 141 8.507 8.507 8.378 0.129 17890 2334 1 3 . 1 1 142 142 ALA N N 142 125.604 125.604 124.065 1.539 17890 2335 1 3 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.561 -0.044 17890 2336 1 3 . 1 1 142 142 ALA C C 142 177.671 177.671 178.436 -0.765 17890 2337 1 3 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.100 0.893 17890 2338 1 3 . 1 1 142 142 ALA CB C 142 21.535 21.535 22.006 -0.471 17890 2339 1 3 . 1 1 142 142 ALA H H 142 7.894 7.894 8.295 -0.401 17890 2340 1 3 . 1 1 143 143 THR N N 143 118.085 118.085 118.259 -0.174 17890 2341 1 3 . 1 1 143 143 THR HA H 143 3.744 3.744 4.100 -0.356 17890 2342 1 3 . 1 1 143 143 THR C C 143 175.464 175.464 174.996 0.468 17890 2343 1 3 . 1 1 143 143 THR CA C 143 64.548 64.548 65.068 -0.520 17890 2344 1 3 . 1 1 143 143 THR CB C 143 69.305 69.305 68.920 0.385 17890 2345 1 3 . 1 1 143 143 THR H H 143 8.268 8.268 8.913 -0.645 17890 2346 1 3 . 1 1 144 144 PHE N N 144 118.635 118.635 115.977 2.658 17890 2347 1 3 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.618 -0.272 17890 2348 1 3 . 1 1 144 144 PHE C C 144 176.209 176.209 175.346 0.863 17890 2349 1 3 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.914 3.548 17890 2350 1 3 . 1 1 144 144 PHE CB C 144 39.604 39.604 38.927 0.677 17890 2351 1 3 . 1 1 144 144 PHE H H 144 8.719 8.719 8.052 0.667 17890 2352 1 3 . 1 1 145 145 SER N N 145 113.446 113.446 115.531 -2.085 17890 2353 1 3 . 1 1 145 145 SER HA H 145 4.866 4.866 4.219 0.647 17890 2354 1 3 . 1 1 145 145 SER C C 145 176.605 176.605 176.014 0.591 17890 2355 1 3 . 1 1 145 145 SER CA C 145 59.432 59.432 57.208 2.224 17890 2356 1 3 . 1 1 145 145 SER CB C 145 62.167 62.167 62.583 -0.416 17890 2357 1 3 . 1 1 145 145 SER H H 145 8.657 8.657 7.420 1.237 17890 2358 1 3 . 1 1 146 146 GLY N N 146 109.277 109.277 111.773 -2.496 17890 2359 1 3 . 1 1 146 146 GLY C C 146 174.293 174.293 173.244 1.049 17890 2360 1 3 . 1 1 146 146 GLY CA C 146 44.940 44.940 44.841 0.099 17890 2361 1 3 . 1 1 146 146 GLY H H 146 7.467 7.467 7.725 -0.258 17890 2362 1 3 . 1 1 147 147 ARG N N 147 122.863 122.863 116.365 6.498 17890 2363 1 3 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.996 0.445 17890 2364 1 3 . 1 1 147 147 ARG C C 147 173.849 173.849 174.115 -0.266 17890 2365 1 3 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.440 -2.213 17890 2366 1 3 . 1 1 147 147 ARG CB C 147 32.597 32.597 32.544 0.053 17890 2367 1 3 . 1 1 147 147 ARG H H 147 7.556 7.556 7.267 0.289 17890 2368 1 3 . 1 1 148 148 TRP N N 148 118.465 118.465 121.003 -2.538 17890 2369 1 3 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.324 -0.478 17890 2370 1 3 . 1 1 148 148 TRP C C 148 174.353 174.353 174.153 0.200 17890 2371 1 3 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.932 -1.270 17890 2372 1 3 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.538 -1.539 17890 2373 1 3 . 1 1 148 148 TRP H H 148 8.709 8.709 9.232 -0.523 17890 2374 1 3 . 1 1 149 149 VAL N N 149 125.852 125.852 117.910 7.942 17890 2375 1 3 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.516 -0.373 17890 2376 1 3 . 1 1 149 149 VAL C C 149 173.613 173.613 173.299 0.314 17890 2377 1 3 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.879 1.861 17890 2378 1 3 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.272 -2.889 17890 2379 1 3 . 1 1 149 149 VAL H H 149 9.700 9.700 8.852 0.848 17890 2380 1 3 . 1 1 150 150 ILE N N 150 125.140 125.140 127.435 -2.295 17890 2381 1 3 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.104 -0.242 17890 2382 1 3 . 1 1 150 150 ILE C C 150 175.661 175.661 174.277 1.384 17890 2383 1 3 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.480 1.341 17890 2384 1 3 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.459 -0.639 17890 2385 1 3 . 1 1 150 150 ILE H H 150 7.747 7.747 7.738 0.009 17890 2386 1 3 . 1 1 151 151 GLU N N 151 126.762 126.762 126.947 -0.185 17890 2387 1 3 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.863 0.017 17890 2388 1 3 . 1 1 151 151 GLU C C 151 174.424 174.424 174.806 -0.382 17890 2389 1 3 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.981 0.815 17890 2390 1 3 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.813 0.438 17890 2391 1 3 . 1 1 151 151 GLU H H 151 8.892 8.892 8.738 0.154 17890 2392 1 3 . 1 1 152 152 LYS N N 152 126.299 126.299 122.454 3.845 17890 2393 1 3 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.763 0.098 17890 2394 1 3 . 1 1 152 152 LYS C C 152 176.282 176.282 176.623 -0.341 17890 2395 1 3 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.892 0.613 17890 2396 1 3 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.553 0.783 17890 2397 1 3 . 1 1 152 152 LYS H H 152 8.640 8.640 8.293 0.347 17890 2398 1 4 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.289 -1.995 17890 2399 1 4 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.722 -0.100 17890 2400 1 4 . 1 1 8 8 HIS CA C 8 55.661 55.661 54.974 0.687 17890 2401 1 4 . 1 1 8 8 HIS CB C 8 29.880 29.880 32.931 -3.051 17890 2402 1 4 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.817 -0.171 17890 2403 1 4 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.059 -0.375 17890 2404 1 4 . 1 1 9 9 HIS CB C 9 29.831 29.831 32.491 -2.660 17890 2405 1 4 . 1 1 10 10 HIS N N 10 120.811 120.811 117.938 2.873 17890 2406 1 4 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.147 0.533 17890 2407 1 4 . 1 1 10 10 HIS C C 10 174.875 174.875 173.775 1.100 17890 2408 1 4 . 1 1 10 10 HIS CA C 10 55.746 55.746 57.148 -1.402 17890 2409 1 4 . 1 1 10 10 HIS CB C 10 29.889 29.889 28.276 1.613 17890 2410 1 4 . 1 1 10 10 HIS H H 10 8.583 8.583 7.684 0.899 17890 2411 1 4 . 1 1 11 11 SER N N 11 118.009 118.009 112.009 6.000 17890 2412 1 4 . 1 1 11 11 SER HA H 11 4.424 4.424 4.558 -0.134 17890 2413 1 4 . 1 1 11 11 SER C C 11 174.962 174.962 173.546 1.416 17890 2414 1 4 . 1 1 11 11 SER CA C 11 58.660 58.660 58.325 0.335 17890 2415 1 4 . 1 1 11 11 SER CB C 11 63.822 63.822 64.843 -1.021 17890 2416 1 4 . 1 1 11 11 SER H H 11 8.438 8.438 8.079 0.359 17890 2417 1 4 . 1 1 12 12 GLY N N 12 111.011 111.011 107.271 3.740 17890 2418 1 4 . 1 1 12 12 GLY C C 12 173.907 173.907 173.595 0.312 17890 2419 1 4 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.503 -0.082 17890 2420 1 4 . 1 1 12 12 GLY H H 12 8.433 8.433 7.969 0.464 17890 2421 1 4 . 1 1 13 13 ASP N N 13 120.291 120.291 119.201 1.090 17890 2422 1 4 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.772 -0.110 17890 2423 1 4 . 1 1 13 13 ASP C C 13 176.115 176.115 173.861 2.254 17890 2424 1 4 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.077 1.226 17890 2425 1 4 . 1 1 13 13 ASP CB C 13 41.465 41.465 43.021 -1.556 17890 2426 1 4 . 1 1 13 13 ASP H H 13 8.153 8.153 7.886 0.267 17890 2427 1 4 . 1 1 14 14 SER N N 14 116.987 116.987 114.959 2.028 17890 2428 1 4 . 1 1 14 14 SER HA H 14 4.754 4.754 4.778 -0.024 17890 2429 1 4 . 1 1 14 14 SER CA C 14 56.469 56.469 55.710 0.759 17890 2430 1 4 . 1 1 14 14 SER CB C 14 63.553 63.553 64.907 -1.354 17890 2431 1 4 . 1 1 14 14 SER H H 14 8.210 8.210 8.090 0.120 17890 2432 1 4 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.436 0.006 17890 2433 1 4 . 1 1 15 15 PRO C C 15 176.424 176.424 175.994 0.430 17890 2434 1 4 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.617 -0.383 17890 2435 1 4 . 1 1 15 15 PRO CB C 15 32.148 32.148 31.823 0.324 17890 2436 1 4 . 1 1 16 16 ALA N N 16 124.219 124.219 126.109 -1.890 17890 2437 1 4 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.527 -0.177 17890 2438 1 4 . 1 1 16 16 ALA C C 16 177.552 177.552 176.582 0.970 17890 2439 1 4 . 1 1 16 16 ALA CA C 16 52.433 52.433 51.922 0.511 17890 2440 1 4 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.327 -0.008 17890 2441 1 4 . 1 1 16 16 ALA H H 16 8.284 8.284 8.269 0.015 17890 2442 1 4 . 1 1 17 17 VAL N N 17 119.504 119.504 119.258 0.246 17890 2443 1 4 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.165 0.084 17890 2444 1 4 . 1 1 17 17 VAL C C 17 176.322 176.322 176.482 -0.160 17890 2445 1 4 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.857 -0.579 17890 2446 1 4 . 1 1 17 17 VAL CB C 17 32.957 32.957 31.955 1.002 17890 2447 1 4 . 1 1 17 17 VAL H H 17 8.046 8.046 7.894 0.152 17890 2448 1 4 . 1 1 18 18 THR N N 18 118.186 118.186 116.540 1.646 17890 2449 1 4 . 1 1 18 18 THR HA H 18 4.473 4.473 4.527 -0.054 17890 2450 1 4 . 1 1 18 18 THR C C 18 174.248 174.248 174.241 0.007 17890 2451 1 4 . 1 1 18 18 THR CA C 18 61.565 61.565 61.384 0.181 17890 2452 1 4 . 1 1 18 18 THR CB C 18 70.165 70.165 69.805 0.360 17890 2453 1 4 . 1 1 18 18 THR H H 18 8.276 8.276 8.293 -0.017 17890 2454 1 4 . 1 1 19 19 LEU N N 19 125.265 125.265 119.632 5.633 17890 2455 1 4 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.955 0.338 17890 2456 1 4 . 1 1 19 19 LEU C C 19 175.689 175.689 175.741 -0.052 17890 2457 1 4 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.501 -0.074 17890 2458 1 4 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.251 2.028 17890 2459 1 4 . 1 1 19 19 LEU H H 19 8.091 8.091 7.882 0.209 17890 2460 1 4 . 1 1 20 20 SER N N 20 114.622 114.622 114.425 0.197 17890 2461 1 4 . 1 1 20 20 SER HA H 20 4.947 4.947 4.863 0.084 17890 2462 1 4 . 1 1 20 20 SER C C 20 174.220 174.220 173.365 0.855 17890 2463 1 4 . 1 1 20 20 SER CA C 20 56.583 56.583 57.742 -1.159 17890 2464 1 4 . 1 1 20 20 SER CB C 20 65.653 65.653 64.758 0.895 17890 2465 1 4 . 1 1 20 20 SER H H 20 7.316 7.316 7.946 -0.630 17890 2466 1 4 . 1 1 21 21 ALA N N 21 125.517 125.517 123.926 1.591 17890 2467 1 4 . 1 1 21 21 ALA HA H 21 4.668 4.668 5.091 -0.423 17890 2468 1 4 . 1 1 21 21 ALA C C 21 177.960 177.960 177.117 0.843 17890 2469 1 4 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.567 1.443 17890 2470 1 4 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.549 -0.324 17890 2471 1 4 . 1 1 21 21 ALA H H 21 8.993 8.993 8.524 0.469 17890 2472 1 4 . 1 1 22 22 GLY N N 22 109.543 109.543 110.522 -0.979 17890 2473 1 4 . 1 1 22 22 GLY C C 22 170.422 170.422 171.774 -1.352 17890 2474 1 4 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.109 0.272 17890 2475 1 4 . 1 1 22 22 GLY H H 22 8.411 8.411 8.924 -0.513 17890 2476 1 4 . 1 1 23 23 ASN N N 23 119.649 119.649 119.073 0.576 17890 2477 1 4 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.656 0.231 17890 2478 1 4 . 1 1 23 23 ASN C C 23 175.207 175.207 174.570 0.637 17890 2479 1 4 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.632 -0.811 17890 2480 1 4 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.373 -0.618 17890 2481 1 4 . 1 1 23 23 ASN H H 23 8.092 8.092 8.421 -0.329 17890 2482 1 4 . 1 1 24 24 TYR N N 24 120.889 120.889 121.721 -0.832 17890 2483 1 4 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.162 0.093 17890 2484 1 4 . 1 1 24 24 TYR C C 24 175.667 175.667 174.464 1.203 17890 2485 1 4 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.233 0.880 17890 2486 1 4 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.680 0.146 17890 2487 1 4 . 1 1 24 24 TYR H H 24 9.914 9.914 9.025 0.889 17890 2488 1 4 . 1 1 25 25 ILE N N 25 115.978 115.978 113.508 2.470 17890 2489 1 4 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.067 0.019 17890 2490 1 4 . 1 1 25 25 ILE C C 25 175.200 175.200 174.264 0.936 17890 2491 1 4 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.676 0.869 17890 2492 1 4 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.840 -0.718 17890 2493 1 4 . 1 1 25 25 ILE H H 25 9.216 9.216 9.317 -0.101 17890 2494 1 4 . 1 1 26 26 ILE N N 26 123.957 123.957 122.917 1.040 17890 2495 1 4 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.207 -0.231 17890 2496 1 4 . 1 1 26 26 ILE C C 26 174.810 174.810 174.971 -0.161 17890 2497 1 4 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.251 0.358 17890 2498 1 4 . 1 1 26 26 ILE CB C 26 41.122 41.122 39.885 1.237 17890 2499 1 4 . 1 1 26 26 ILE H H 26 9.559 9.559 9.044 0.515 17890 2500 1 4 . 1 1 27 27 TYR N N 27 121.371 121.371 124.316 -2.945 17890 2501 1 4 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.530 0.660 17890 2502 1 4 . 1 1 27 27 TYR C C 27 173.963 173.963 173.551 0.412 17890 2503 1 4 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.901 -0.232 17890 2504 1 4 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.900 0.798 17890 2505 1 4 . 1 1 27 27 TYR H H 27 9.378 9.378 9.001 0.377 17890 2506 1 4 . 1 1 28 28 ASN N N 28 121.991 121.991 120.134 1.857 17890 2507 1 4 . 1 1 28 28 ASN HA H 28 3.768 3.768 3.977 -0.209 17890 2508 1 4 . 1 1 28 28 ASN C C 28 174.352 174.352 175.846 -1.494 17890 2509 1 4 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.463 1.657 17890 2510 1 4 . 1 1 28 28 ASN CB C 28 41.446 41.446 40.084 1.362 17890 2511 1 4 . 1 1 28 28 ASN H H 28 8.466 8.466 8.545 -0.079 17890 2512 1 4 . 1 1 29 29 ARG N N 29 121.103 121.103 123.200 -2.097 17890 2513 1 4 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.008 -0.147 17890 2514 1 4 . 1 1 29 29 ARG C C 29 173.635 173.635 177.026 -3.391 17890 2515 1 4 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.867 1.426 17890 2516 1 4 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.534 -0.135 17890 2517 1 4 . 1 1 29 29 ARG H H 29 7.756 7.756 7.909 -0.153 17890 2518 1 4 . 1 1 30 30 VAL N N 30 118.412 118.412 121.386 -2.974 17890 2519 1 4 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.887 0.057 17890 2520 1 4 . 1 1 30 30 VAL C C 30 176.199 176.199 174.914 1.285 17890 2521 1 4 . 1 1 30 30 VAL CA C 30 62.577 62.577 62.776 -0.199 17890 2522 1 4 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.217 -1.995 17890 2523 1 4 . 1 1 30 30 VAL H H 30 8.976 8.976 7.953 1.023 17890 2524 1 4 . 1 1 31 31 LEU N N 31 125.418 125.418 127.096 -1.678 17890 2525 1 4 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.402 0.083 17890 2526 1 4 . 1 1 31 31 LEU C C 31 179.123 179.123 177.004 2.119 17890 2527 1 4 . 1 1 31 31 LEU CA C 31 54.025 54.025 54.290 -0.265 17890 2528 1 4 . 1 1 31 31 LEU CB C 31 45.581 45.581 43.149 2.432 17890 2529 1 4 . 1 1 31 31 LEU H H 31 8.856 8.856 8.263 0.593 17890 2530 1 4 . 1 1 32 32 SER N N 32 116.890 116.890 116.168 0.722 17890 2531 1 4 . 1 1 32 32 SER HA H 32 5.365 5.365 4.700 0.665 17890 2532 1 4 . 1 1 32 32 SER CA C 32 57.269 57.269 56.888 0.381 17890 2533 1 4 . 1 1 32 32 SER CB C 32 62.213 62.213 63.631 -1.418 17890 2534 1 4 . 1 1 32 32 SER H H 32 9.307 9.307 8.644 0.663 17890 2535 1 4 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.451 -0.571 17890 2536 1 4 . 1 1 33 33 PRO C C 33 175.137 175.137 177.571 -2.434 17890 2537 1 4 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.646 0.639 17890 2538 1 4 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.627 0.404 17890 2539 1 4 . 1 1 34 34 ARG N N 34 110.279 110.279 118.716 -8.437 17890 2540 1 4 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.268 0.224 17890 2541 1 4 . 1 1 34 34 ARG C C 34 176.844 176.844 176.887 -0.043 17890 2542 1 4 . 1 1 34 34 ARG CA C 34 54.436 54.436 56.019 -1.583 17890 2543 1 4 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.394 0.190 17890 2544 1 4 . 1 1 34 34 ARG H H 34 7.257 7.257 7.848 -0.591 17890 2545 1 4 . 1 1 35 35 GLY N N 35 110.288 110.288 105.932 4.356 17890 2546 1 4 . 1 1 35 35 GLY C C 35 173.336 173.336 174.069 -0.733 17890 2547 1 4 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.719 2.311 17890 2548 1 4 . 1 1 35 35 GLY H H 35 8.589 8.589 7.609 0.980 17890 2549 1 4 . 1 1 36 36 GLU N N 36 116.838 116.838 119.078 -2.240 17890 2550 1 4 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.661 -0.313 17890 2551 1 4 . 1 1 36 36 GLU C C 36 176.915 176.915 175.724 1.191 17890 2552 1 4 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.840 1.067 17890 2553 1 4 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.360 -2.945 17890 2554 1 4 . 1 1 36 36 GLU H H 36 7.769 7.769 8.287 -0.518 17890 2555 1 4 . 1 1 37 37 LYS N N 37 123.775 123.775 120.852 2.923 17890 2556 1 4 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.103 0.320 17890 2557 1 4 . 1 1 37 37 LYS C C 37 176.067 176.067 175.530 0.537 17890 2558 1 4 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.777 -0.876 17890 2559 1 4 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.786 0.888 17890 2560 1 4 . 1 1 37 37 LYS H H 37 8.667 8.667 8.567 0.100 17890 2561 1 4 . 1 1 38 38 LEU N N 38 126.658 126.658 125.627 1.031 17890 2562 1 4 . 1 1 38 38 LEU HA H 38 4.227 4.227 5.065 -0.838 17890 2563 1 4 . 1 1 38 38 LEU C C 38 174.332 174.332 174.886 -0.554 17890 2564 1 4 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.633 -0.290 17890 2565 1 4 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.254 -0.603 17890 2566 1 4 . 1 1 38 38 LEU H H 38 10.455 10.455 9.040 1.415 17890 2567 1 4 . 1 1 39 39 ALA N N 39 127.018 127.018 127.836 -0.818 17890 2568 1 4 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.274 -0.045 17890 2569 1 4 . 1 1 39 39 ALA C C 39 178.694 178.694 175.930 2.764 17890 2570 1 4 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.118 0.107 17890 2571 1 4 . 1 1 39 39 ALA CB C 39 21.349 21.349 21.787 -0.438 17890 2572 1 4 . 1 1 39 39 ALA H H 39 8.773 8.773 8.694 0.079 17890 2573 1 4 . 1 1 40 40 LEU N N 40 126.771 126.771 122.803 3.968 17890 2574 1 4 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.579 -0.225 17890 2575 1 4 . 1 1 40 40 LEU C C 40 178.309 178.309 176.684 1.625 17890 2576 1 4 . 1 1 40 40 LEU CA C 40 56.845 56.845 55.987 0.858 17890 2577 1 4 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.974 0.349 17890 2578 1 4 . 1 1 40 40 LEU H H 40 9.665 9.665 8.537 1.128 17890 2579 1 4 . 1 1 41 41 THR N N 41 126.578 126.578 124.853 1.725 17890 2580 1 4 . 1 1 41 41 THR HA H 41 4.916 4.916 5.142 -0.226 17890 2581 1 4 . 1 1 41 41 THR C C 41 172.547 172.547 173.579 -1.032 17890 2582 1 4 . 1 1 41 41 THR CA C 41 63.253 63.253 61.550 1.703 17890 2583 1 4 . 1 1 41 41 THR CB C 41 71.832 71.832 70.384 1.448 17890 2584 1 4 . 1 1 41 41 THR H H 41 9.802 9.802 9.064 0.738 17890 2585 1 4 . 1 1 42 42 TYR N N 42 130.506 130.506 129.449 1.057 17890 2586 1 4 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.642 0.460 17890 2587 1 4 . 1 1 42 42 TYR CA C 42 53.986 53.986 58.202 -4.216 17890 2588 1 4 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.998 0.157 17890 2589 1 4 . 1 1 42 42 TYR H H 42 9.428 9.428 9.094 0.334 17890 2590 1 4 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.430 0.060 17890 2591 1 4 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.203 0.371 17890 2592 1 4 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.891 -0.247 17890 2593 1 4 . 1 1 44 44 GLY N N 44 113.736 113.736 107.110 6.626 17890 2594 1 4 . 1 1 44 44 GLY C C 44 171.790 171.790 173.314 -1.524 17890 2595 1 4 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.236 0.480 17890 2596 1 4 . 1 1 44 44 GLY H H 44 8.337 8.337 7.799 0.538 17890 2597 1 4 . 1 1 45 45 ARG N N 45 113.899 113.899 116.362 -2.463 17890 2598 1 4 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.519 0.057 17890 2599 1 4 . 1 1 45 45 ARG C C 45 175.151 175.151 173.466 1.685 17890 2600 1 4 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.030 0.135 17890 2601 1 4 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.739 1.480 17890 2602 1 4 . 1 1 45 45 ARG H H 45 6.463 6.463 7.372 -0.909 17890 2603 1 4 . 1 1 46 46 GLN N N 46 119.000 119.000 117.817 1.183 17890 2604 1 4 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.510 -0.061 17890 2605 1 4 . 1 1 46 46 GLN C C 46 177.282 177.282 176.257 1.025 17890 2606 1 4 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.100 1.513 17890 2607 1 4 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.811 0.685 17890 2608 1 4 . 1 1 46 46 GLN H H 46 8.683 8.683 8.510 0.173 17890 2609 1 4 . 1 1 47 47 ARG N N 47 113.526 113.526 120.365 -6.839 17890 2610 1 4 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.023 -0.493 17890 2611 1 4 . 1 1 47 47 ARG C C 47 174.130 174.130 174.924 -0.794 17890 2612 1 4 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.077 1.739 17890 2613 1 4 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.297 0.772 17890 2614 1 4 . 1 1 47 47 ARG H H 47 9.677 9.677 8.581 1.096 17890 2615 1 4 . 1 1 48 48 THR N N 48 114.672 114.672 115.030 -0.358 17890 2616 1 4 . 1 1 48 48 THR HA H 48 4.938 4.938 4.689 0.249 17890 2617 1 4 . 1 1 48 48 THR CA C 48 59.987 59.987 59.949 0.038 17890 2618 1 4 . 1 1 48 48 THR CB C 48 71.947 71.947 70.795 1.152 17890 2619 1 4 . 1 1 48 48 THR H H 48 8.104 8.104 7.582 0.522 17890 2620 1 4 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.680 -0.312 17890 2621 1 4 . 1 1 49 49 PRO C C 49 175.651 175.651 176.345 -0.694 17890 2622 1 4 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.017 1.164 17890 2623 1 4 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.234 0.463 17890 2624 1 4 . 1 1 50 50 VAL N N 50 122.562 122.562 120.742 1.820 17890 2625 1 4 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.255 -0.308 17890 2626 1 4 . 1 1 50 50 VAL C C 50 174.493 174.493 175.790 -1.297 17890 2627 1 4 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.204 2.607 17890 2628 1 4 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.069 -1.901 17890 2629 1 4 . 1 1 50 50 VAL H H 50 8.123 8.123 8.558 -0.435 17890 2630 1 4 . 1 1 51 51 THR N N 51 113.549 113.549 119.090 -5.541 17890 2631 1 4 . 1 1 51 51 THR HA H 51 5.372 5.372 4.916 0.456 17890 2632 1 4 . 1 1 51 51 THR C C 51 174.841 174.841 172.685 2.156 17890 2633 1 4 . 1 1 51 51 THR CA C 51 59.196 59.196 60.540 -1.344 17890 2634 1 4 . 1 1 51 51 THR CB C 51 72.703 72.703 71.814 0.889 17890 2635 1 4 . 1 1 51 51 THR H H 51 7.057 7.057 8.293 -1.236 17890 2636 1 4 . 1 1 52 52 VAL N N 52 107.374 107.374 120.059 -12.685 17890 2637 1 4 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.045 0.469 17890 2638 1 4 . 1 1 52 52 VAL C C 52 175.697 175.697 174.051 1.646 17890 2639 1 4 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.774 -1.302 17890 2640 1 4 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.498 -0.724 17890 2641 1 4 . 1 1 52 52 VAL H H 52 8.062 8.062 8.434 -0.372 17890 2642 1 4 . 1 1 53 53 SER N N 53 114.662 114.662 121.354 -6.692 17890 2643 1 4 . 1 1 53 53 SER HA H 53 4.690 4.690 4.972 -0.282 17890 2644 1 4 . 1 1 53 53 SER CA C 53 56.828 56.828 55.843 0.986 17890 2645 1 4 . 1 1 53 53 SER CB C 53 64.789 64.789 65.788 -0.999 17890 2646 1 4 . 1 1 53 53 SER H H 53 8.681 8.681 8.948 -0.267 17890 2647 1 4 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.591 0.185 17890 2648 1 4 . 1 1 54 54 PRO C C 54 177.724 177.724 176.604 1.120 17890 2649 1 4 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.833 0.592 17890 2650 1 4 . 1 1 54 54 PRO CB C 54 32.097 32.097 31.794 0.303 17890 2651 1 4 . 1 1 55 55 LEU N N 55 128.655 128.655 125.687 2.968 17890 2652 1 4 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.321 0.206 17890 2653 1 4 . 1 1 55 55 LEU C C 55 178.696 178.696 176.840 1.856 17890 2654 1 4 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.014 0.232 17890 2655 1 4 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.662 0.944 17890 2656 1 4 . 1 1 55 55 LEU H H 55 8.675 8.675 8.389 0.286 17890 2657 1 4 . 1 1 56 56 ASP N N 56 126.651 126.651 125.520 1.131 17890 2658 1 4 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.729 -0.020 17890 2659 1 4 . 1 1 56 56 ASP C C 56 177.729 177.729 176.538 1.191 17890 2660 1 4 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.678 -0.055 17890 2661 1 4 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.860 -0.228 17890 2662 1 4 . 1 1 56 56 ASP H H 56 9.683 9.683 8.609 1.074 17890 2663 1 4 . 1 1 57 57 GLY N N 57 109.299 109.299 108.594 0.705 17890 2664 1 4 . 1 1 57 57 GLY C C 57 174.558 174.558 174.315 0.243 17890 2665 1 4 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.751 0.204 17890 2666 1 4 . 1 1 57 57 GLY H H 57 8.157 8.157 8.435 -0.278 17890 2667 1 4 . 1 1 58 58 SER N N 58 116.740 116.740 115.413 1.327 17890 2668 1 4 . 1 1 58 58 SER HA H 58 4.288 4.288 4.456 -0.168 17890 2669 1 4 . 1 1 58 58 SER C C 58 177.252 177.252 175.980 1.272 17890 2670 1 4 . 1 1 58 58 SER CA C 58 58.737 58.737 57.242 1.495 17890 2671 1 4 . 1 1 58 58 SER CB C 58 64.576 64.576 64.409 0.167 17890 2672 1 4 . 1 1 58 58 SER H H 58 8.328 8.328 7.750 0.578 17890 2673 1 4 . 1 1 59 59 SER N N 59 119.768 119.768 117.468 2.300 17890 2674 1 4 . 1 1 59 59 SER HA H 59 4.046 4.046 4.075 -0.029 17890 2675 1 4 . 1 1 59 59 SER C C 59 176.671 176.671 175.968 0.703 17890 2676 1 4 . 1 1 59 59 SER CA C 59 61.691 61.691 60.355 1.336 17890 2677 1 4 . 1 1 59 59 SER CB C 59 63.154 63.154 62.840 0.314 17890 2678 1 4 . 1 1 59 59 SER H H 59 9.020 9.020 8.831 0.189 17890 2679 1 4 . 1 1 60 60 GLU N N 60 119.133 119.133 119.779 -0.646 17890 2680 1 4 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.017 0.169 17890 2681 1 4 . 1 1 60 60 GLU C C 60 177.435 177.435 177.905 -0.470 17890 2682 1 4 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.339 1.694 17890 2683 1 4 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.425 -1.199 17890 2684 1 4 . 1 1 60 60 GLU H H 60 8.832 8.832 8.546 0.286 17890 2685 1 4 . 1 1 61 61 GLN N N 61 118.818 118.818 115.718 3.100 17890 2686 1 4 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.093 0.084 17890 2687 1 4 . 1 1 61 61 GLN C C 61 173.254 173.254 175.234 -1.980 17890 2688 1 4 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.781 -0.408 17890 2689 1 4 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.609 -2.687 17890 2690 1 4 . 1 1 61 61 GLN H H 61 7.648 7.648 7.647 0.001 17890 2691 1 4 . 1 1 62 62 ALA N N 62 122.562 122.562 122.586 -0.024 17890 2692 1 4 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.544 0.520 17890 2693 1 4 . 1 1 62 62 ALA C C 62 176.637 176.637 175.266 1.371 17890 2694 1 4 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.319 -0.140 17890 2695 1 4 . 1 1 62 62 ALA CB C 62 20.595 20.595 20.956 -0.361 17890 2696 1 4 . 1 1 62 62 ALA H H 62 7.315 7.315 7.073 0.242 17890 2697 1 4 . 1 1 63 63 TRP N N 63 124.787 124.787 120.912 3.875 17890 2698 1 4 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.356 -0.392 17890 2699 1 4 . 1 1 63 63 TRP C C 63 174.351 174.351 175.393 -1.042 17890 2700 1 4 . 1 1 63 63 TRP CA C 63 55.902 55.902 55.985 -0.083 17890 2701 1 4 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.878 -1.761 17890 2702 1 4 . 1 1 63 63 TRP H H 63 9.544 9.544 9.133 0.411 17890 2703 1 4 . 1 1 64 64 ILE N N 64 122.482 122.482 119.088 3.394 17890 2704 1 4 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.985 -0.291 17890 2705 1 4 . 1 1 64 64 ILE C C 64 177.078 177.078 174.229 2.849 17890 2706 1 4 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.546 0.485 17890 2707 1 4 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.553 -1.183 17890 2708 1 4 . 1 1 64 64 ILE H H 64 10.235 10.235 9.399 0.836 17890 2709 1 4 . 1 1 65 65 LEU N N 65 132.183 132.183 128.641 3.542 17890 2710 1 4 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.483 -0.018 17890 2711 1 4 . 1 1 65 65 LEU C C 65 177.048 177.048 174.440 2.608 17890 2712 1 4 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.885 0.464 17890 2713 1 4 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.132 -3.788 17890 2714 1 4 . 1 1 65 65 LEU H H 65 9.432 9.432 9.288 0.144 17890 2715 1 4 . 1 1 66 66 ARG N N 66 120.807 120.807 125.358 -4.551 17890 2716 1 4 . 1 1 66 66 ARG HA H 66 4.888 4.888 5.010 -0.122 17890 2717 1 4 . 1 1 66 66 ARG C C 66 175.275 175.275 174.757 0.518 17890 2718 1 4 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.712 0.343 17890 2719 1 4 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.432 -1.441 17890 2720 1 4 . 1 1 66 66 ARG H H 66 8.491 8.491 8.417 0.074 17890 2721 1 4 . 1 1 67 67 SER N N 67 119.709 119.709 118.657 1.052 17890 2722 1 4 . 1 1 67 67 SER HA H 67 3.186 3.186 3.397 -0.211 17890 2723 1 4 . 1 1 67 67 SER C C 67 174.508 174.508 173.672 0.836 17890 2724 1 4 . 1 1 67 67 SER CA C 67 58.521 58.521 58.976 -0.455 17890 2725 1 4 . 1 1 67 67 SER CB C 67 62.590 62.590 63.199 -0.609 17890 2726 1 4 . 1 1 67 67 SER H H 67 8.557 8.557 8.751 -0.194 17890 2727 1 4 . 1 1 68 68 TYR N N 68 131.011 131.011 127.882 3.129 17890 2728 1 4 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.652 -0.204 17890 2729 1 4 . 1 1 68 68 TYR C C 68 174.687 174.687 174.793 -0.106 17890 2730 1 4 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.691 1.074 17890 2731 1 4 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.848 -1.860 17890 2732 1 4 . 1 1 68 68 TYR H H 68 8.531 8.531 8.687 -0.156 17890 2733 1 4 . 1 1 69 69 ASP N N 69 117.066 117.066 120.116 -3.050 17890 2734 1 4 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.862 -0.237 17890 2735 1 4 . 1 1 69 69 ASP C C 69 176.455 176.455 175.875 0.580 17890 2736 1 4 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.993 -0.902 17890 2737 1 4 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.908 -0.761 17890 2738 1 4 . 1 1 69 69 ASP H H 69 7.122 7.122 7.662 -0.540 17890 2739 1 4 . 1 1 70 70 SER N N 70 122.869 122.869 119.554 3.315 17890 2740 1 4 . 1 1 70 70 SER HA H 70 4.270 4.270 4.091 0.179 17890 2741 1 4 . 1 1 70 70 SER C C 70 177.010 177.010 175.973 1.037 17890 2742 1 4 . 1 1 70 70 SER CA C 70 60.837 60.837 61.028 -0.191 17890 2743 1 4 . 1 1 70 70 SER CB C 70 62.722 62.722 63.269 -0.547 17890 2744 1 4 . 1 1 70 70 SER H H 70 8.757 8.757 8.710 0.047 17890 2745 1 4 . 1 1 71 71 ASN N N 71 119.873 119.873 119.600 0.273 17890 2746 1 4 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.589 -0.018 17890 2747 1 4 . 1 1 71 71 ASN C C 71 176.226 176.226 175.937 0.289 17890 2748 1 4 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.377 0.337 17890 2749 1 4 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.486 0.155 17890 2750 1 4 . 1 1 71 71 ASN H H 71 8.342 8.342 8.635 -0.293 17890 2751 1 4 . 1 1 72 72 SER N N 72 112.202 112.202 113.462 -1.260 17890 2752 1 4 . 1 1 72 72 SER HA H 72 4.567 4.567 4.740 -0.173 17890 2753 1 4 . 1 1 72 72 SER C C 72 173.789 173.789 173.289 0.500 17890 2754 1 4 . 1 1 72 72 SER CA C 72 57.816 57.816 57.550 0.266 17890 2755 1 4 . 1 1 72 72 SER CB C 72 63.935 63.935 64.423 -0.488 17890 2756 1 4 . 1 1 72 72 SER H H 72 7.560 7.560 7.691 -0.131 17890 2757 1 4 . 1 1 73 73 ASN N N 73 117.437 117.437 118.408 -0.971 17890 2758 1 4 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.396 0.138 17890 2759 1 4 . 1 1 73 73 ASN C C 73 173.647 173.647 174.195 -0.548 17890 2760 1 4 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.453 0.070 17890 2761 1 4 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.199 0.014 17890 2762 1 4 . 1 1 73 73 ASN H H 73 7.940 7.940 7.944 -0.004 17890 2763 1 4 . 1 1 74 74 THR N N 74 104.227 104.227 109.791 -5.564 17890 2764 1 4 . 1 1 74 74 THR HA H 74 5.477 5.477 4.941 0.536 17890 2765 1 4 . 1 1 74 74 THR C C 74 176.824 176.824 173.987 2.837 17890 2766 1 4 . 1 1 74 74 THR CA C 74 59.768 59.768 61.862 -2.094 17890 2767 1 4 . 1 1 74 74 THR CB C 74 71.985 71.985 69.899 2.086 17890 2768 1 4 . 1 1 74 74 THR H H 74 7.737 7.737 7.773 -0.036 17890 2769 1 4 . 1 1 75 75 TRP N N 75 124.636 124.636 124.186 0.450 17890 2770 1 4 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.398 -0.191 17890 2771 1 4 . 1 1 75 75 TRP C C 75 175.876 175.876 176.372 -0.496 17890 2772 1 4 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.102 1.504 17890 2773 1 4 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.493 0.022 17890 2774 1 4 . 1 1 75 75 TRP H H 75 9.442 9.442 9.128 0.314 17890 2775 1 4 . 1 1 76 76 THR N N 76 110.544 110.544 114.693 -4.149 17890 2776 1 4 . 1 1 76 76 THR HA H 76 5.129 5.129 5.113 0.016 17890 2777 1 4 . 1 1 76 76 THR C C 76 174.506 174.506 174.501 0.005 17890 2778 1 4 . 1 1 76 76 THR CA C 76 60.561 60.561 61.733 -1.172 17890 2779 1 4 . 1 1 76 76 THR CB C 76 71.688 71.688 70.104 1.584 17890 2780 1 4 . 1 1 76 76 THR H H 76 9.415 9.415 9.403 0.012 17890 2781 1 4 . 1 1 77 77 ILE N N 77 121.567 121.567 124.191 -2.624 17890 2782 1 4 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.287 -0.148 17890 2783 1 4 . 1 1 77 77 ILE C C 77 176.148 176.148 175.028 1.120 17890 2784 1 4 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.411 2.297 17890 2785 1 4 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.704 1.283 17890 2786 1 4 . 1 1 77 77 ILE H H 77 9.255 9.255 8.321 0.934 17890 2787 1 4 . 1 1 78 78 SER N N 78 122.269 122.269 121.593 0.676 17890 2788 1 4 . 1 1 78 78 SER HA H 78 5.601 5.601 5.386 0.215 17890 2789 1 4 . 1 1 78 78 SER CA C 78 55.835 55.835 55.825 0.010 17890 2790 1 4 . 1 1 78 78 SER CB C 78 65.858 65.858 66.306 -0.448 17890 2791 1 4 . 1 1 78 78 SER H H 78 9.226 9.226 8.614 0.612 17890 2792 1 4 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.243 -0.379 17890 2793 1 4 . 1 1 79 79 PRO C C 79 178.175 178.175 176.453 1.722 17890 2794 1 4 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.253 0.631 17890 2795 1 4 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.020 -1.748 17890 2796 1 4 . 1 1 80 80 VAL N N 80 121.906 121.906 120.217 1.689 17890 2797 1 4 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.750 -0.169 17890 2798 1 4 . 1 1 80 80 VAL C C 80 177.751 177.751 177.409 0.342 17890 2799 1 4 . 1 1 80 80 VAL CA C 80 66.067 66.067 65.032 1.035 17890 2800 1 4 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.494 -0.008 17890 2801 1 4 . 1 1 80 80 VAL H H 80 7.328 7.328 8.160 -0.832 17890 2802 1 4 . 1 1 81 81 GLY N N 81 104.643 104.643 106.551 -1.908 17890 2803 1 4 . 1 1 81 81 GLY C C 81 174.979 174.979 174.422 0.557 17890 2804 1 4 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.677 -0.589 17890 2805 1 4 . 1 1 81 81 GLY H H 81 8.949 8.949 7.941 1.008 17890 2806 1 4 . 1 1 82 82 SER N N 82 111.865 111.865 114.828 -2.963 17890 2807 1 4 . 1 1 82 82 SER HA H 82 4.646 4.646 4.850 -0.204 17890 2808 1 4 . 1 1 82 82 SER CA C 82 55.441 55.441 55.952 -0.511 17890 2809 1 4 . 1 1 82 82 SER CB C 82 62.277 62.277 63.640 -1.363 17890 2810 1 4 . 1 1 82 82 SER H H 82 6.968 6.968 7.159 -0.191 17890 2811 1 4 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.589 -0.242 17890 2812 1 4 . 1 1 83 83 PRO C C 83 176.660 176.660 176.786 -0.126 17890 2813 1 4 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.296 0.907 17890 2814 1 4 . 1 1 83 83 PRO CB C 83 32.819 32.819 32.082 0.737 17890 2815 1 4 . 1 1 84 84 ASN N N 84 116.542 116.542 115.310 1.232 17890 2816 1 4 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.593 0.408 17890 2817 1 4 . 1 1 84 84 ASN C C 84 175.825 175.825 174.934 0.891 17890 2818 1 4 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.816 -0.925 17890 2819 1 4 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.405 0.339 17890 2820 1 4 . 1 1 84 84 ASN H H 84 8.502 8.502 8.469 0.033 17890 2821 1 4 . 1 1 85 85 SER N N 85 114.633 114.633 112.722 1.911 17890 2822 1 4 . 1 1 85 85 SER HA H 85 4.624 4.624 4.893 -0.269 17890 2823 1 4 . 1 1 85 85 SER C C 85 172.963 172.963 172.371 0.592 17890 2824 1 4 . 1 1 85 85 SER CA C 85 59.210 59.210 57.753 1.457 17890 2825 1 4 . 1 1 85 85 SER CB C 85 64.697 64.697 66.966 -2.269 17890 2826 1 4 . 1 1 85 85 SER H H 85 7.980 7.980 7.774 0.206 17890 2827 1 4 . 1 1 86 86 GLN N N 86 119.016 119.016 118.663 0.353 17890 2828 1 4 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.365 0.081 17890 2829 1 4 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.290 0.162 17890 2830 1 4 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.217 0.181 17890 2831 1 4 . 1 1 86 86 GLN H H 86 9.399 9.399 9.088 0.311 17890 2832 1 4 . 1 1 87 87 ILE N N 87 119.691 119.691 118.929 0.762 17890 2833 1 4 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.176 -0.601 17890 2834 1 4 . 1 1 87 87 ILE C C 87 176.505 176.505 176.054 0.451 17890 2835 1 4 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.986 4.508 17890 2836 1 4 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.203 -1.006 17890 2837 1 4 . 1 1 87 87 ILE H H 87 8.970 8.970 8.267 0.703 17890 2838 1 4 . 1 1 88 88 GLY N N 88 118.378 118.378 114.570 3.808 17890 2839 1 4 . 1 1 88 88 GLY C C 88 171.397 171.397 171.682 -0.285 17890 2840 1 4 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.191 -1.587 17890 2841 1 4 . 1 1 88 88 GLY H H 88 9.752 9.752 9.193 0.559 17890 2842 1 4 . 1 1 89 89 TRP N N 89 122.749 122.749 122.197 0.552 17890 2843 1 4 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.462 -0.864 17890 2844 1 4 . 1 1 89 89 TRP C C 89 175.924 175.924 174.830 1.094 17890 2845 1 4 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.867 0.416 17890 2846 1 4 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.360 -2.274 17890 2847 1 4 . 1 1 89 89 TRP H H 89 8.215 8.215 8.235 -0.020 17890 2848 1 4 . 1 1 90 90 GLY N N 90 116.305 116.305 111.129 5.176 17890 2849 1 4 . 1 1 90 90 GLY C C 90 173.725 173.725 172.453 1.272 17890 2850 1 4 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.536 0.519 17890 2851 1 4 . 1 1 90 90 GLY H H 90 8.922 8.922 8.266 0.656 17890 2852 1 4 . 1 1 91 91 ALA N N 91 123.795 123.795 122.043 1.752 17890 2853 1 4 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.151 0.092 17890 2854 1 4 . 1 1 91 91 ALA C C 91 178.510 178.510 178.968 -0.458 17890 2855 1 4 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.429 0.061 17890 2856 1 4 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.809 -0.400 17890 2857 1 4 . 1 1 91 91 ALA H H 91 8.367 8.367 8.171 0.196 17890 2858 1 4 . 1 1 92 92 GLY N N 92 108.871 108.871 112.695 -3.824 17890 2859 1 4 . 1 1 92 92 GLY C C 92 174.528 174.528 174.842 -0.314 17890 2860 1 4 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.750 0.508 17890 2861 1 4 . 1 1 92 92 GLY H H 92 8.776 8.776 8.623 0.153 17890 2862 1 4 . 1 1 93 93 ASN N N 93 114.921 114.921 117.098 -2.177 17890 2863 1 4 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.781 -0.332 17890 2864 1 4 . 1 1 93 93 ASN C C 93 172.774 172.774 174.121 -1.347 17890 2865 1 4 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.376 0.597 17890 2866 1 4 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.954 -0.625 17890 2867 1 4 . 1 1 93 93 ASN H H 93 8.647 8.647 8.279 0.368 17890 2868 1 4 . 1 1 94 94 VAL N N 94 112.437 112.437 113.042 -0.605 17890 2869 1 4 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.648 0.417 17890 2870 1 4 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.414 -1.499 17890 2871 1 4 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.354 -0.199 17890 2872 1 4 . 1 1 94 94 VAL H H 94 6.989 6.989 7.458 -0.469 17890 2873 1 4 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.957 -0.029 17890 2874 1 4 . 1 1 95 95 PRO C C 95 176.041 176.041 176.064 -0.023 17890 2875 1 4 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.402 -1.201 17890 2876 1 4 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.484 -0.759 17890 2877 1 4 . 1 1 96 96 VAL N N 96 113.564 113.564 117.685 -4.121 17890 2878 1 4 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.794 -0.059 17890 2879 1 4 . 1 1 96 96 VAL C C 96 173.656 173.656 175.139 -1.483 17890 2880 1 4 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.565 -0.711 17890 2881 1 4 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.546 1.607 17890 2882 1 4 . 1 1 96 96 VAL H H 96 8.199 8.199 8.823 -0.624 17890 2883 1 4 . 1 1 97 97 VAL N N 97 122.328 122.328 122.786 -0.458 17890 2884 1 4 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.714 -0.083 17890 2885 1 4 . 1 1 97 97 VAL C C 97 174.776 174.776 175.835 -1.059 17890 2886 1 4 . 1 1 97 97 VAL CA C 97 63.657 63.657 62.685 0.972 17890 2887 1 4 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.486 -0.358 17890 2888 1 4 . 1 1 97 97 VAL H H 97 8.957 8.957 8.585 0.372 17890 2889 1 4 . 1 1 98 98 LEU N N 98 130.258 130.258 126.131 4.127 17890 2890 1 4 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.898 0.152 17890 2891 1 4 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.651 1.172 17890 2892 1 4 . 1 1 98 98 LEU CB C 98 46.118 46.118 44.936 1.182 17890 2893 1 4 . 1 1 98 98 LEU H H 98 9.245 9.245 9.103 0.142 17890 2894 1 4 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.776 0.003 17890 2895 1 4 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.143 0.346 17890 2896 1 4 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.113 -0.659 17890 2897 1 4 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.557 -0.572 17890 2898 1 4 . 1 1 100 100 PRO C C 100 177.309 177.309 175.823 1.486 17890 2899 1 4 . 1 1 100 100 PRO CA C 100 63.824 63.824 62.988 0.836 17890 2900 1 4 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.197 -0.092 17890 2901 1 4 . 1 1 101 101 ASN N N 101 119.284 119.284 126.121 -6.837 17890 2902 1 4 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.664 -0.122 17890 2903 1 4 . 1 1 101 101 ASN C C 101 171.920 171.920 173.998 -2.078 17890 2904 1 4 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.837 -0.637 17890 2905 1 4 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.568 -1.942 17890 2906 1 4 . 1 1 101 101 ASN H H 101 7.273 7.273 9.414 -2.141 17890 2907 1 4 . 1 1 102 102 ASN N N 102 115.674 115.674 116.170 -0.496 17890 2908 1 4 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.726 -0.808 17890 2909 1 4 . 1 1 102 102 ASN C C 102 173.264 173.264 174.312 -1.048 17890 2910 1 4 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.800 1.239 17890 2911 1 4 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.014 -1.032 17890 2912 1 4 . 1 1 102 102 ASN H H 102 8.197 8.197 7.882 0.315 17890 2913 1 4 . 1 1 103 103 TYR N N 103 118.775 118.775 121.612 -2.837 17890 2914 1 4 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.279 0.206 17890 2915 1 4 . 1 1 103 103 TYR C C 103 175.248 175.248 174.997 0.251 17890 2916 1 4 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.632 -2.142 17890 2917 1 4 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.683 -1.151 17890 2918 1 4 . 1 1 103 103 TYR H H 103 7.745 7.745 7.574 0.171 17890 2919 1 4 . 1 1 104 104 VAL N N 104 116.205 116.205 114.611 1.594 17890 2920 1 4 . 1 1 104 104 VAL HA H 104 4.977 4.977 5.009 -0.032 17890 2921 1 4 . 1 1 104 104 VAL C C 104 174.361 174.361 173.759 0.602 17890 2922 1 4 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.687 -1.436 17890 2923 1 4 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.714 -0.171 17890 2924 1 4 . 1 1 104 104 VAL H H 104 7.498 7.498 7.954 -0.456 17890 2925 1 4 . 1 1 105 105 TRP N N 105 119.557 119.557 120.203 -0.646 17890 2926 1 4 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.121 -0.246 17890 2927 1 4 . 1 1 105 105 TRP C C 105 175.526 175.526 176.268 -0.742 17890 2928 1 4 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.512 -0.628 17890 2929 1 4 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.621 -0.082 17890 2930 1 4 . 1 1 105 105 TRP H H 105 8.926 8.926 8.935 -0.009 17890 2931 1 4 . 1 1 106 106 THR N N 106 120.480 120.480 120.238 0.242 17890 2932 1 4 . 1 1 106 106 THR HA H 106 4.966 4.966 4.800 0.166 17890 2933 1 4 . 1 1 106 106 THR C C 106 174.177 174.177 174.016 0.161 17890 2934 1 4 . 1 1 106 106 THR CA C 106 62.091 62.091 63.850 -1.760 17890 2935 1 4 . 1 1 106 106 THR CB C 106 69.649 69.649 69.215 0.434 17890 2936 1 4 . 1 1 106 106 THR H H 106 9.525 9.525 9.202 0.323 17890 2937 1 4 . 1 1 107 107 LEU N N 107 127.146 127.146 129.603 -2.457 17890 2938 1 4 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.273 -0.446 17890 2939 1 4 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.440 0.269 17890 2940 1 4 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.913 -2.389 17890 2941 1 4 . 1 1 107 107 LEU H H 107 7.591 7.591 8.712 -1.121 17890 2942 1 4 . 1 1 108 108 THR N N 108 119.928 119.928 120.833 -0.905 17890 2943 1 4 . 1 1 108 108 THR HA H 108 4.411 4.411 4.616 -0.205 17890 2944 1 4 . 1 1 108 108 THR C C 108 173.319 173.319 172.851 0.468 17890 2945 1 4 . 1 1 108 108 THR CA C 108 62.243 62.243 61.629 0.614 17890 2946 1 4 . 1 1 108 108 THR CB C 108 70.138 70.138 70.929 -0.791 17890 2947 1 4 . 1 1 108 108 THR H H 108 8.141 8.141 8.977 -0.836 17890 2948 1 4 . 1 1 109 109 LEU N N 109 130.557 130.557 129.860 0.697 17890 2949 1 4 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.425 0.120 17890 2950 1 4 . 1 1 109 109 LEU C C 109 175.217 175.217 175.979 -0.762 17890 2951 1 4 . 1 1 109 109 LEU CA C 109 55.286 55.286 54.740 0.546 17890 2952 1 4 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.907 -2.301 17890 2953 1 4 . 1 1 109 109 LEU H H 109 8.924 8.924 8.583 0.341 17890 2954 1 4 . 1 1 110 110 THR N N 110 120.160 120.160 115.674 4.486 17890 2955 1 4 . 1 1 110 110 THR HA H 110 4.911 4.911 4.656 0.255 17890 2956 1 4 . 1 1 110 110 THR CA C 110 60.141 60.141 60.307 -0.166 17890 2957 1 4 . 1 1 110 110 THR CB C 110 72.785 72.785 70.901 1.884 17890 2958 1 4 . 1 1 110 110 THR H H 110 7.677 7.677 8.667 -0.990 17890 2959 1 4 . 1 1 111 111 SER HA H 111 4.204 4.204 4.254 -0.050 17890 2960 1 4 . 1 1 111 111 SER C C 111 174.755 174.755 174.376 0.379 17890 2961 1 4 . 1 1 111 111 SER CA C 111 60.710 60.710 60.252 0.458 17890 2962 1 4 . 1 1 111 111 SER CB C 111 62.660 62.660 63.058 -0.398 17890 2963 1 4 . 1 1 112 112 GLY N N 112 107.313 107.313 105.361 1.952 17890 2964 1 4 . 1 1 112 112 GLY C C 112 173.023 173.023 172.712 0.311 17890 2965 1 4 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.259 -1.109 17890 2966 1 4 . 1 1 112 112 GLY H H 112 8.249 8.249 7.447 0.802 17890 2967 1 4 . 1 1 113 113 GLY N N 113 105.618 105.618 108.119 -2.501 17890 2968 1 4 . 1 1 113 113 GLY C C 113 175.844 175.844 172.289 3.555 17890 2969 1 4 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.784 -3.025 17890 2970 1 4 . 1 1 113 113 GLY H H 113 7.444 7.444 7.472 -0.028 17890 2971 1 4 . 1 1 114 114 TYR N N 114 121.548 121.548 119.907 1.641 17890 2972 1 4 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.201 -0.349 17890 2973 1 4 . 1 1 114 114 TYR C C 114 175.605 175.605 174.078 1.527 17890 2974 1 4 . 1 1 114 114 TYR CA C 114 61.263 61.263 57.067 4.196 17890 2975 1 4 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.664 -4.731 17890 2976 1 4 . 1 1 114 114 TYR H H 114 9.677 9.677 9.026 0.651 17890 2977 1 4 . 1 1 115 115 ASN N N 115 123.274 123.274 117.705 5.569 17890 2978 1 4 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.178 -0.080 17890 2979 1 4 . 1 1 115 115 ASN C C 115 174.355 174.355 173.007 1.348 17890 2980 1 4 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.429 -1.383 17890 2981 1 4 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.746 -2.397 17890 2982 1 4 . 1 1 115 115 ASN H H 115 9.350 9.350 8.944 0.406 17890 2983 1 4 . 1 1 116 116 ILE N N 116 130.611 130.611 122.640 7.971 17890 2984 1 4 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.675 -0.436 17890 2985 1 4 . 1 1 116 116 ILE C C 116 173.998 173.998 173.839 0.159 17890 2986 1 4 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.203 1.996 17890 2987 1 4 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.258 -2.158 17890 2988 1 4 . 1 1 116 116 ILE H H 116 9.473 9.473 8.649 0.824 17890 2989 1 4 . 1 1 117 117 GLN N N 117 121.633 121.633 125.063 -3.430 17890 2990 1 4 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.051 0.884 17890 2991 1 4 . 1 1 117 117 GLN C C 117 177.902 177.902 175.747 2.155 17890 2992 1 4 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.836 -0.516 17890 2993 1 4 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.511 3.946 17890 2994 1 4 . 1 1 117 117 GLN H H 117 8.781 8.781 8.931 -0.150 17890 2995 1 4 . 1 1 118 118 ASP N N 118 116.836 116.836 120.529 -3.693 17890 2996 1 4 . 1 1 118 118 ASP HA H 118 4.783 4.783 4.046 0.737 17890 2997 1 4 . 1 1 118 118 ASP C C 118 178.084 178.084 177.048 1.036 17890 2998 1 4 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.172 -1.402 17890 2999 1 4 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.179 -0.811 17890 3000 1 4 . 1 1 118 118 ASP H H 118 9.330 9.330 8.990 0.340 17890 3001 1 4 . 1 1 119 119 GLY N N 119 111.037 111.037 107.290 3.747 17890 3002 1 4 . 1 1 119 119 GLY C C 119 174.196 174.196 174.693 -0.497 17890 3003 1 4 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.936 2.040 17890 3004 1 4 . 1 1 119 119 GLY H H 119 8.986 8.986 8.484 0.502 17890 3005 1 4 . 1 1 120 120 LYS N N 120 114.809 114.809 120.643 -5.834 17890 3006 1 4 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.563 -0.214 17890 3007 1 4 . 1 1 120 120 LYS C C 120 175.174 175.174 176.502 -1.328 17890 3008 1 4 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.551 1.382 17890 3009 1 4 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.976 -0.500 17890 3010 1 4 . 1 1 120 120 LYS H H 120 7.045 7.045 8.455 -1.410 17890 3011 1 4 . 1 1 121 121 ARG N N 121 116.291 116.291 114.712 1.579 17890 3012 1 4 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.073 -0.487 17890 3013 1 4 . 1 1 121 121 ARG C C 121 175.097 175.097 177.182 -2.085 17890 3014 1 4 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.993 1.076 17890 3015 1 4 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.845 -0.222 17890 3016 1 4 . 1 1 121 121 ARG H H 121 7.683 7.683 8.173 -0.490 17890 3017 1 4 . 1 1 122 122 THR N N 122 113.730 113.730 109.625 4.105 17890 3018 1 4 . 1 1 122 122 THR HA H 122 4.540 4.540 4.232 0.308 17890 3019 1 4 . 1 1 122 122 THR C C 122 175.302 175.302 174.463 0.839 17890 3020 1 4 . 1 1 122 122 THR CA C 122 62.871 62.871 64.066 -1.195 17890 3021 1 4 . 1 1 122 122 THR CB C 122 71.552 71.552 69.904 1.648 17890 3022 1 4 . 1 1 122 122 THR H H 122 11.059 11.059 8.069 2.990 17890 3023 1 4 . 1 1 123 123 VAL N N 123 118.350 118.350 114.799 3.551 17890 3024 1 4 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.582 0.228 17890 3025 1 4 . 1 1 123 123 VAL C C 123 174.730 174.730 173.612 1.118 17890 3026 1 4 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.107 0.204 17890 3027 1 4 . 1 1 123 123 VAL CB C 123 37.082 37.082 35.035 2.047 17890 3028 1 4 . 1 1 123 123 VAL H H 123 8.181 8.181 7.249 0.932 17890 3029 1 4 . 1 1 124 124 SER N N 124 113.053 113.053 113.978 -0.925 17890 3030 1 4 . 1 1 124 124 SER HA H 124 5.820 5.820 5.182 0.638 17890 3031 1 4 . 1 1 124 124 SER C C 124 175.521 175.521 173.566 1.955 17890 3032 1 4 . 1 1 124 124 SER CA C 124 58.087 58.087 57.166 0.921 17890 3033 1 4 . 1 1 124 124 SER CB C 124 67.405 67.405 65.748 1.657 17890 3034 1 4 . 1 1 124 124 SER H H 124 9.138 9.138 8.550 0.588 17890 3035 1 4 . 1 1 125 125 TRP N N 125 124.900 124.900 124.803 0.097 17890 3036 1 4 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.936 0.674 17890 3037 1 4 . 1 1 125 125 TRP C C 125 178.114 178.114 177.436 0.678 17890 3038 1 4 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.311 -0.837 17890 3039 1 4 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.092 0.931 17890 3040 1 4 . 1 1 125 125 TRP H H 125 8.843 8.843 8.005 0.838 17890 3041 1 4 . 1 1 126 126 SER N N 126 119.243 119.243 113.209 6.034 17890 3042 1 4 . 1 1 126 126 SER HA H 126 5.443 5.443 5.200 0.243 17890 3043 1 4 . 1 1 126 126 SER C C 126 171.668 171.668 172.785 -1.117 17890 3044 1 4 . 1 1 126 126 SER CA C 126 58.696 58.696 57.336 1.360 17890 3045 1 4 . 1 1 126 126 SER CB C 126 66.176 66.176 66.000 0.176 17890 3046 1 4 . 1 1 126 126 SER H H 126 9.835 9.835 9.282 0.553 17890 3047 1 4 . 1 1 127 127 LEU N N 127 113.708 113.708 118.161 -4.453 17890 3048 1 4 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.702 0.453 17890 3049 1 4 . 1 1 127 127 LEU C C 127 176.563 176.563 177.006 -0.443 17890 3050 1 4 . 1 1 127 127 LEU CA C 127 52.645 52.645 52.747 -0.102 17890 3051 1 4 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.344 -1.648 17890 3052 1 4 . 1 1 127 127 LEU H H 127 6.559 6.559 8.275 -1.716 17890 3053 1 4 . 1 1 128 128 ASN N N 128 121.739 121.739 118.954 2.785 17890 3054 1 4 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.909 -0.220 17890 3055 1 4 . 1 1 128 128 ASN C C 128 175.452 175.452 175.375 0.077 17890 3056 1 4 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.839 1.168 17890 3057 1 4 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.492 -1.201 17890 3058 1 4 . 1 1 128 128 ASN H H 128 8.662 8.662 9.373 -0.711 17890 3059 1 4 . 1 1 129 129 ASN N N 129 119.586 119.586 116.265 3.321 17890 3060 1 4 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.840 0.157 17890 3061 1 4 . 1 1 129 129 ASN C C 129 175.900 175.900 174.767 1.133 17890 3062 1 4 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.492 0.741 17890 3063 1 4 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.208 0.049 17890 3064 1 4 . 1 1 129 129 ASN H H 129 10.962 10.962 8.847 2.115 17890 3065 1 4 . 1 1 130 130 ALA N N 130 128.292 128.292 122.655 5.637 17890 3066 1 4 . 1 1 130 130 ALA HA H 130 3.570 3.570 3.992 -0.422 17890 3067 1 4 . 1 1 130 130 ALA C C 130 172.620 172.620 176.401 -3.781 17890 3068 1 4 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.508 -0.869 17890 3069 1 4 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.253 -1.153 17890 3070 1 4 . 1 1 130 130 ALA H H 130 10.629 10.629 8.753 1.876 17890 3071 1 4 . 1 1 131 131 THR N N 131 105.584 105.584 111.297 -5.713 17890 3072 1 4 . 1 1 131 131 THR HA H 131 4.462 4.462 4.250 0.212 17890 3073 1 4 . 1 1 131 131 THR C C 131 173.552 173.552 174.831 -1.279 17890 3074 1 4 . 1 1 131 131 THR CA C 131 58.338 58.338 61.209 -2.870 17890 3075 1 4 . 1 1 131 131 THR CB C 131 71.569 71.569 70.080 1.489 17890 3076 1 4 . 1 1 131 131 THR H H 131 7.092 7.092 7.569 -0.477 17890 3077 1 4 . 1 1 132 132 ALA N N 132 121.773 121.773 122.758 -0.985 17890 3078 1 4 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.027 -0.278 17890 3079 1 4 . 1 1 132 132 ALA C C 132 178.819 178.819 178.528 0.291 17890 3080 1 4 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.020 1.264 17890 3081 1 4 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.564 -0.337 17890 3082 1 4 . 1 1 132 132 ALA H H 132 8.952 8.952 8.360 0.592 17890 3083 1 4 . 1 1 133 133 GLY N N 133 113.965 113.965 112.493 1.472 17890 3084 1 4 . 1 1 133 133 GLY C C 133 173.453 173.453 174.229 -0.776 17890 3085 1 4 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.822 0.344 17890 3086 1 4 . 1 1 133 133 GLY H H 133 9.016 9.016 8.785 0.231 17890 3087 1 4 . 1 1 134 134 GLU N N 134 123.460 123.460 121.392 2.068 17890 3088 1 4 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.312 -0.354 17890 3089 1 4 . 1 1 134 134 GLU C C 134 176.120 176.120 176.095 0.025 17890 3090 1 4 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.065 1.334 17890 3091 1 4 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.922 0.463 17890 3092 1 4 . 1 1 134 134 GLU H H 134 7.598 7.598 7.609 -0.011 17890 3093 1 4 . 1 1 135 135 GLU N N 135 122.633 122.633 124.737 -2.104 17890 3094 1 4 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.203 0.108 17890 3095 1 4 . 1 1 135 135 GLU C C 135 176.014 176.014 176.457 -0.443 17890 3096 1 4 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.769 -0.587 17890 3097 1 4 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.343 -0.890 17890 3098 1 4 . 1 1 135 135 GLU H H 135 8.258 8.258 8.624 -0.366 17890 3099 1 4 . 1 1 136 136 VAL N N 136 123.635 123.635 126.443 -2.808 17890 3100 1 4 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.845 -0.153 17890 3101 1 4 . 1 1 136 136 VAL C C 136 173.932 173.932 175.897 -1.965 17890 3102 1 4 . 1 1 136 136 VAL CA C 136 63.832 63.832 64.468 -0.636 17890 3103 1 4 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.010 -0.146 17890 3104 1 4 . 1 1 136 136 VAL H H 136 7.267 7.267 7.767 -0.500 17890 3105 1 4 . 1 1 137 137 SER N N 137 118.950 118.950 117.910 1.040 17890 3106 1 4 . 1 1 137 137 SER HA H 137 4.887 4.887 5.009 -0.122 17890 3107 1 4 . 1 1 137 137 SER C C 137 173.780 173.780 173.052 0.728 17890 3108 1 4 . 1 1 137 137 SER CA C 137 57.895 57.895 56.749 1.146 17890 3109 1 4 . 1 1 137 137 SER CB C 137 65.027 65.027 66.871 -1.844 17890 3110 1 4 . 1 1 137 137 SER H H 137 8.454 8.454 8.565 -0.111 17890 3111 1 4 . 1 1 138 138 ILE N N 138 123.511 123.511 120.444 3.067 17890 3112 1 4 . 1 1 138 138 ILE HA H 138 4.248 4.248 4.965 -0.717 17890 3113 1 4 . 1 1 138 138 ILE C C 138 176.142 176.142 175.682 0.460 17890 3114 1 4 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.512 1.338 17890 3115 1 4 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.581 -2.986 17890 3116 1 4 . 1 1 138 138 ILE H H 138 7.915 7.915 8.577 -0.662 17890 3117 1 4 . 1 1 139 139 GLY N N 139 115.638 115.638 111.057 4.581 17890 3118 1 4 . 1 1 139 139 GLY C C 139 171.947 171.947 173.245 -1.298 17890 3119 1 4 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.413 1.673 17890 3120 1 4 . 1 1 139 139 GLY H H 139 8.490 8.490 8.331 0.159 17890 3121 1 4 . 1 1 140 140 ALA N N 140 128.563 128.563 121.403 7.160 17890 3122 1 4 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.389 0.007 17890 3123 1 4 . 1 1 140 140 ALA C C 140 177.956 177.956 177.011 0.945 17890 3124 1 4 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.598 -1.952 17890 3125 1 4 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.858 0.346 17890 3126 1 4 . 1 1 140 140 ALA H H 140 8.531 8.531 8.493 0.038 17890 3127 1 4 . 1 1 141 141 ASP N N 141 120.886 120.886 113.847 7.039 17890 3128 1 4 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.577 0.021 17890 3129 1 4 . 1 1 141 141 ASP C C 141 175.411 175.411 174.416 0.995 17890 3130 1 4 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.260 0.656 17890 3131 1 4 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.149 -1.457 17890 3132 1 4 . 1 1 141 141 ASP H H 141 8.507 8.507 7.786 0.721 17890 3133 1 4 . 1 1 142 142 ALA N N 142 125.604 125.604 121.329 4.275 17890 3134 1 4 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.675 -0.158 17890 3135 1 4 . 1 1 142 142 ALA C C 142 177.671 177.671 177.626 0.045 17890 3136 1 4 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.705 0.288 17890 3137 1 4 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.413 0.121 17890 3138 1 4 . 1 1 142 142 ALA H H 142 7.894 7.894 8.151 -0.257 17890 3139 1 4 . 1 1 143 143 THR N N 143 118.085 118.085 116.049 2.036 17890 3140 1 4 . 1 1 143 143 THR HA H 143 3.744 3.744 4.199 -0.455 17890 3141 1 4 . 1 1 143 143 THR C C 143 175.464 175.464 175.016 0.448 17890 3142 1 4 . 1 1 143 143 THR CA C 143 64.548 64.548 63.944 0.604 17890 3143 1 4 . 1 1 143 143 THR CB C 143 69.305 69.305 68.797 0.508 17890 3144 1 4 . 1 1 143 143 THR H H 143 8.268 8.268 8.763 -0.495 17890 3145 1 4 . 1 1 144 144 PHE N N 144 118.635 118.635 117.283 1.352 17890 3146 1 4 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.729 -0.383 17890 3147 1 4 . 1 1 144 144 PHE C C 144 176.209 176.209 175.061 1.148 17890 3148 1 4 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.237 4.225 17890 3149 1 4 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.510 0.094 17890 3150 1 4 . 1 1 144 144 PHE H H 144 8.719 8.719 7.664 1.055 17890 3151 1 4 . 1 1 145 145 SER N N 145 113.446 113.446 115.663 -2.217 17890 3152 1 4 . 1 1 145 145 SER HA H 145 4.866 4.866 4.245 0.621 17890 3153 1 4 . 1 1 145 145 SER C C 145 176.605 176.605 176.070 0.535 17890 3154 1 4 . 1 1 145 145 SER CA C 145 59.432 59.432 57.737 1.695 17890 3155 1 4 . 1 1 145 145 SER CB C 145 62.167 62.167 62.896 -0.729 17890 3156 1 4 . 1 1 145 145 SER H H 145 8.657 8.657 7.124 1.533 17890 3157 1 4 . 1 1 146 146 GLY N N 146 109.277 109.277 110.370 -1.093 17890 3158 1 4 . 1 1 146 146 GLY C C 146 174.293 174.293 173.334 0.959 17890 3159 1 4 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.094 -0.154 17890 3160 1 4 . 1 1 146 146 GLY H H 146 7.467 7.467 8.172 -0.705 17890 3161 1 4 . 1 1 147 147 ARG N N 147 122.863 122.863 119.864 2.999 17890 3162 1 4 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.919 0.522 17890 3163 1 4 . 1 1 147 147 ARG C C 147 173.849 173.849 173.903 -0.054 17890 3164 1 4 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.965 -2.738 17890 3165 1 4 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.385 -0.788 17890 3166 1 4 . 1 1 147 147 ARG H H 147 7.556 7.556 7.251 0.305 17890 3167 1 4 . 1 1 148 148 TRP N N 148 118.465 118.465 123.317 -4.852 17890 3168 1 4 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.191 -0.345 17890 3169 1 4 . 1 1 148 148 TRP C C 148 174.353 174.353 174.128 0.225 17890 3170 1 4 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.808 -1.146 17890 3171 1 4 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.813 -1.814 17890 3172 1 4 . 1 1 148 148 TRP H H 148 8.709 8.709 9.291 -0.582 17890 3173 1 4 . 1 1 149 149 VAL N N 149 125.852 125.852 118.115 7.737 17890 3174 1 4 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.489 -0.346 17890 3175 1 4 . 1 1 149 149 VAL C C 149 173.613 173.613 173.388 0.225 17890 3176 1 4 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.979 1.761 17890 3177 1 4 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.188 -2.805 17890 3178 1 4 . 1 1 149 149 VAL H H 149 9.700 9.700 8.842 0.858 17890 3179 1 4 . 1 1 150 150 ILE N N 150 125.140 125.140 128.292 -3.152 17890 3180 1 4 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.169 -0.307 17890 3181 1 4 . 1 1 150 150 ILE C C 150 175.661 175.661 175.109 0.552 17890 3182 1 4 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.626 1.195 17890 3183 1 4 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.757 -0.937 17890 3184 1 4 . 1 1 150 150 ILE H H 150 7.747 7.747 8.223 -0.476 17890 3185 1 4 . 1 1 151 151 GLU N N 151 126.762 126.762 129.062 -2.300 17890 3186 1 4 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.843 0.037 17890 3187 1 4 . 1 1 151 151 GLU C C 151 174.424 174.424 174.550 -0.126 17890 3188 1 4 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.937 0.859 17890 3189 1 4 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.927 0.324 17890 3190 1 4 . 1 1 151 151 GLU H H 151 8.892 8.892 8.773 0.119 17890 3191 1 4 . 1 1 152 152 LYS N N 152 126.299 126.299 122.507 3.792 17890 3192 1 4 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.766 0.095 17890 3193 1 4 . 1 1 152 152 LYS C C 152 176.282 176.282 176.551 -0.269 17890 3194 1 4 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.895 0.610 17890 3195 1 4 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.597 0.739 17890 3196 1 4 . 1 1 152 152 LYS H H 152 8.640 8.640 8.296 0.344 17890 3197 1 5 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.032 -1.738 17890 3198 1 5 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.321 0.301 17890 3199 1 5 . 1 1 8 8 HIS CA C 8 55.661 55.661 58.386 -2.725 17890 3200 1 5 . 1 1 8 8 HIS CB C 8 29.880 29.880 28.885 0.995 17890 3201 1 5 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.527 0.119 17890 3202 1 5 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.286 -0.602 17890 3203 1 5 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.429 -0.598 17890 3204 1 5 . 1 1 10 10 HIS N N 10 120.811 120.811 113.850 6.961 17890 3205 1 5 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.786 -0.106 17890 3206 1 5 . 1 1 10 10 HIS C C 10 174.875 174.875 174.762 0.113 17890 3207 1 5 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.494 0.252 17890 3208 1 5 . 1 1 10 10 HIS CB C 10 29.889 29.889 31.410 -1.522 17890 3209 1 5 . 1 1 10 10 HIS H H 10 8.583 8.583 7.738 0.845 17890 3210 1 5 . 1 1 11 11 SER N N 11 118.009 118.009 114.878 3.131 17890 3211 1 5 . 1 1 11 11 SER HA H 11 4.424 4.424 4.759 -0.335 17890 3212 1 5 . 1 1 11 11 SER C C 11 174.962 174.962 172.927 2.035 17890 3213 1 5 . 1 1 11 11 SER CA C 11 58.660 58.660 56.689 1.971 17890 3214 1 5 . 1 1 11 11 SER CB C 11 63.822 63.822 64.219 -0.397 17890 3215 1 5 . 1 1 11 11 SER H H 11 8.438 8.438 7.724 0.714 17890 3216 1 5 . 1 1 12 12 GLY N N 12 111.011 111.011 111.061 -0.050 17890 3217 1 5 . 1 1 12 12 GLY C C 12 173.907 173.907 174.352 -0.445 17890 3218 1 5 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.799 -0.378 17890 3219 1 5 . 1 1 12 12 GLY H H 12 8.433 8.433 8.733 -0.300 17890 3220 1 5 . 1 1 13 13 ASP N N 13 120.291 120.291 120.962 -0.671 17890 3221 1 5 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.849 -0.187 17890 3222 1 5 . 1 1 13 13 ASP C C 13 176.115 176.115 175.489 0.626 17890 3223 1 5 . 1 1 13 13 ASP CA C 13 54.303 54.303 54.510 -0.207 17890 3224 1 5 . 1 1 13 13 ASP CB C 13 41.465 41.465 42.599 -1.134 17890 3225 1 5 . 1 1 13 13 ASP H H 13 8.153 8.153 8.400 -0.247 17890 3226 1 5 . 1 1 14 14 SER N N 14 116.987 116.987 115.887 1.100 17890 3227 1 5 . 1 1 14 14 SER HA H 14 4.754 4.754 4.858 -0.104 17890 3228 1 5 . 1 1 14 14 SER CA C 14 56.469 56.469 56.427 0.042 17890 3229 1 5 . 1 1 14 14 SER CB C 14 63.553 63.553 65.542 -1.989 17890 3230 1 5 . 1 1 14 14 SER H H 14 8.210 8.210 8.005 0.205 17890 3231 1 5 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.587 -0.145 17890 3232 1 5 . 1 1 15 15 PRO C C 15 176.424 176.424 176.158 0.266 17890 3233 1 5 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.759 0.474 17890 3234 1 5 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.456 -0.308 17890 3235 1 5 . 1 1 16 16 ALA N N 16 124.219 124.219 123.240 0.979 17890 3236 1 5 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.525 -0.175 17890 3237 1 5 . 1 1 16 16 ALA C C 16 177.552 177.552 176.374 1.178 17890 3238 1 5 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.429 0.003 17890 3239 1 5 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.206 0.113 17890 3240 1 5 . 1 1 16 16 ALA H H 16 8.284 8.284 8.497 -0.213 17890 3241 1 5 . 1 1 17 17 VAL N N 17 119.504 119.504 117.886 1.618 17890 3242 1 5 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.643 -0.394 17890 3243 1 5 . 1 1 17 17 VAL C C 17 176.322 176.322 175.674 0.648 17890 3244 1 5 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.375 -0.097 17890 3245 1 5 . 1 1 17 17 VAL CB C 17 32.957 32.957 35.172 -2.215 17890 3246 1 5 . 1 1 17 17 VAL H H 17 8.046 8.046 8.050 -0.004 17890 3247 1 5 . 1 1 18 18 THR N N 18 118.186 118.186 116.801 1.385 17890 3248 1 5 . 1 1 18 18 THR HA H 18 4.473 4.473 4.641 -0.168 17890 3249 1 5 . 1 1 18 18 THR C C 18 174.248 174.248 173.685 0.563 17890 3250 1 5 . 1 1 18 18 THR CA C 18 61.565 61.565 61.489 0.076 17890 3251 1 5 . 1 1 18 18 THR CB C 18 70.165 70.165 68.956 1.210 17890 3252 1 5 . 1 1 18 18 THR H H 18 8.276 8.276 8.394 -0.118 17890 3253 1 5 . 1 1 19 19 LEU N N 19 125.265 125.265 119.607 5.658 17890 3254 1 5 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.998 0.295 17890 3255 1 5 . 1 1 19 19 LEU C C 19 175.689 175.689 175.230 0.459 17890 3256 1 5 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.379 0.048 17890 3257 1 5 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.132 2.147 17890 3258 1 5 . 1 1 19 19 LEU H H 19 8.091 8.091 8.258 -0.167 17890 3259 1 5 . 1 1 20 20 SER N N 20 114.622 114.622 114.740 -0.118 17890 3260 1 5 . 1 1 20 20 SER HA H 20 4.947 4.947 4.929 0.018 17890 3261 1 5 . 1 1 20 20 SER C C 20 174.220 174.220 172.809 1.411 17890 3262 1 5 . 1 1 20 20 SER CA C 20 56.583 56.583 57.295 -0.712 17890 3263 1 5 . 1 1 20 20 SER CB C 20 65.653 65.653 64.785 0.868 17890 3264 1 5 . 1 1 20 20 SER H H 20 7.316 7.316 8.048 -0.732 17890 3265 1 5 . 1 1 21 21 ALA N N 21 125.517 125.517 123.646 1.871 17890 3266 1 5 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.967 -0.299 17890 3267 1 5 . 1 1 21 21 ALA C C 21 177.960 177.960 177.222 0.738 17890 3268 1 5 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.567 1.443 17890 3269 1 5 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.484 -0.259 17890 3270 1 5 . 1 1 21 21 ALA H H 21 8.993 8.993 8.462 0.531 17890 3271 1 5 . 1 1 22 22 GLY N N 22 109.543 109.543 112.448 -2.905 17890 3272 1 5 . 1 1 22 22 GLY C C 22 170.422 170.422 172.063 -1.641 17890 3273 1 5 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.104 0.277 17890 3274 1 5 . 1 1 22 22 GLY H H 22 8.411 8.411 9.000 -0.589 17890 3275 1 5 . 1 1 23 23 ASN N N 23 119.649 119.649 119.978 -0.329 17890 3276 1 5 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.762 0.125 17890 3277 1 5 . 1 1 23 23 ASN C C 23 175.207 175.207 174.550 0.657 17890 3278 1 5 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.591 -0.770 17890 3279 1 5 . 1 1 23 23 ASN CB C 23 38.755 38.755 40.016 -1.260 17890 3280 1 5 . 1 1 23 23 ASN H H 23 8.092 8.092 8.378 -0.286 17890 3281 1 5 . 1 1 24 24 TYR N N 24 120.889 120.889 121.574 -0.685 17890 3282 1 5 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.170 0.085 17890 3283 1 5 . 1 1 24 24 TYR C C 24 175.667 175.667 174.451 1.216 17890 3284 1 5 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.245 0.868 17890 3285 1 5 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.669 0.157 17890 3286 1 5 . 1 1 24 24 TYR H H 24 9.914 9.914 9.084 0.830 17890 3287 1 5 . 1 1 25 25 ILE N N 25 115.978 115.978 113.373 2.605 17890 3288 1 5 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.052 0.034 17890 3289 1 5 . 1 1 25 25 ILE C C 25 175.200 175.200 174.227 0.973 17890 3290 1 5 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.560 0.985 17890 3291 1 5 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.874 -0.752 17890 3292 1 5 . 1 1 25 25 ILE H H 25 9.216 9.216 9.294 -0.078 17890 3293 1 5 . 1 1 26 26 ILE N N 26 123.957 123.957 122.449 1.508 17890 3294 1 5 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.255 -0.279 17890 3295 1 5 . 1 1 26 26 ILE C C 26 174.810 174.810 174.860 -0.050 17890 3296 1 5 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.313 0.296 17890 3297 1 5 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.083 1.039 17890 3298 1 5 . 1 1 26 26 ILE H H 26 9.559 9.559 8.984 0.575 17890 3299 1 5 . 1 1 27 27 TYR N N 27 121.371 121.371 123.945 -2.574 17890 3300 1 5 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.589 0.601 17890 3301 1 5 . 1 1 27 27 TYR C C 27 173.963 173.963 173.316 0.647 17890 3302 1 5 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.896 -0.227 17890 3303 1 5 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.062 0.636 17890 3304 1 5 . 1 1 27 27 TYR H H 27 9.378 9.378 9.134 0.244 17890 3305 1 5 . 1 1 28 28 ASN N N 28 121.991 121.991 119.458 2.533 17890 3306 1 5 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.155 -0.387 17890 3307 1 5 . 1 1 28 28 ASN C C 28 174.352 174.352 176.532 -2.180 17890 3308 1 5 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.472 2.648 17890 3309 1 5 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.728 1.718 17890 3310 1 5 . 1 1 28 28 ASN H H 28 8.466 8.466 8.268 0.198 17890 3311 1 5 . 1 1 29 29 ARG N N 29 121.103 121.103 125.660 -4.557 17890 3312 1 5 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.115 -0.254 17890 3313 1 5 . 1 1 29 29 ARG C C 29 173.635 173.635 177.580 -3.945 17890 3314 1 5 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.049 2.244 17890 3315 1 5 . 1 1 29 29 ARG CB C 29 30.399 30.399 29.780 0.619 17890 3316 1 5 . 1 1 29 29 ARG H H 29 7.756 7.756 8.276 -0.520 17890 3317 1 5 . 1 1 30 30 VAL N N 30 118.412 118.412 117.273 1.139 17890 3318 1 5 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.761 0.183 17890 3319 1 5 . 1 1 30 30 VAL C C 30 176.199 176.199 175.790 0.409 17890 3320 1 5 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.818 -1.241 17890 3321 1 5 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.257 -2.034 17890 3322 1 5 . 1 1 30 30 VAL H H 30 8.976 8.976 7.769 1.207 17890 3323 1 5 . 1 1 31 31 LEU N N 31 125.418 125.418 114.878 10.540 17890 3324 1 5 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.022 0.463 17890 3325 1 5 . 1 1 31 31 LEU C C 31 179.123 179.123 176.497 2.626 17890 3326 1 5 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.496 -1.471 17890 3327 1 5 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.468 4.112 17890 3328 1 5 . 1 1 31 31 LEU H H 31 8.856 8.856 7.446 1.410 17890 3329 1 5 . 1 1 32 32 SER N N 32 116.890 116.890 115.406 1.484 17890 3330 1 5 . 1 1 32 32 SER HA H 32 5.365 5.365 4.832 0.533 17890 3331 1 5 . 1 1 32 32 SER CA C 32 57.269 57.269 55.695 1.574 17890 3332 1 5 . 1 1 32 32 SER CB C 32 62.213 62.213 64.388 -2.175 17890 3333 1 5 . 1 1 32 32 SER H H 32 9.307 9.307 8.357 0.950 17890 3334 1 5 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.473 -0.593 17890 3335 1 5 . 1 1 33 33 PRO C C 33 175.137 175.137 177.592 -2.455 17890 3336 1 5 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.272 1.013 17890 3337 1 5 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.631 0.400 17890 3338 1 5 . 1 1 34 34 ARG N N 34 110.279 110.279 119.713 -9.434 17890 3339 1 5 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.246 0.246 17890 3340 1 5 . 1 1 34 34 ARG C C 34 176.844 176.844 177.154 -0.310 17890 3341 1 5 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.787 -1.351 17890 3342 1 5 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.340 0.244 17890 3343 1 5 . 1 1 34 34 ARG H H 34 7.257 7.257 7.800 -0.543 17890 3344 1 5 . 1 1 35 35 GLY N N 35 110.288 110.288 105.954 4.334 17890 3345 1 5 . 1 1 35 35 GLY C C 35 173.336 173.336 173.937 -0.601 17890 3346 1 5 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.871 2.159 17890 3347 1 5 . 1 1 35 35 GLY H H 35 8.589 8.589 7.873 0.716 17890 3348 1 5 . 1 1 36 36 GLU N N 36 116.838 116.838 118.347 -1.509 17890 3349 1 5 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.595 -0.247 17890 3350 1 5 . 1 1 36 36 GLU C C 36 176.915 176.915 175.667 1.248 17890 3351 1 5 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.938 0.969 17890 3352 1 5 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.073 -2.658 17890 3353 1 5 . 1 1 36 36 GLU H H 36 7.769 7.769 7.632 0.137 17890 3354 1 5 . 1 1 37 37 LYS N N 37 123.775 123.775 119.751 4.024 17890 3355 1 5 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.143 0.280 17890 3356 1 5 . 1 1 37 37 LYS C C 37 176.067 176.067 175.643 0.424 17890 3357 1 5 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.713 -0.812 17890 3358 1 5 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.880 0.794 17890 3359 1 5 . 1 1 37 37 LYS H H 37 8.667 8.667 8.622 0.045 17890 3360 1 5 . 1 1 38 38 LEU N N 38 126.658 126.658 122.865 3.793 17890 3361 1 5 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.842 -0.615 17890 3362 1 5 . 1 1 38 38 LEU C C 38 174.332 174.332 175.168 -0.836 17890 3363 1 5 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.903 -0.560 17890 3364 1 5 . 1 1 38 38 LEU CB C 38 41.651 41.651 43.107 -1.456 17890 3365 1 5 . 1 1 38 38 LEU H H 38 10.455 10.455 8.768 1.687 17890 3366 1 5 . 1 1 39 39 ALA N N 39 127.018 127.018 125.409 1.609 17890 3367 1 5 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.283 -0.054 17890 3368 1 5 . 1 1 39 39 ALA C C 39 178.694 178.694 176.130 2.564 17890 3369 1 5 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.518 -0.293 17890 3370 1 5 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.657 0.692 17890 3371 1 5 . 1 1 39 39 ALA H H 39 8.773 8.773 8.528 0.245 17890 3372 1 5 . 1 1 40 40 LEU N N 40 126.771 126.771 122.766 4.005 17890 3373 1 5 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.537 -0.183 17890 3374 1 5 . 1 1 40 40 LEU C C 40 178.309 178.309 176.649 1.660 17890 3375 1 5 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.017 0.828 17890 3376 1 5 . 1 1 40 40 LEU CB C 40 43.323 43.323 43.101 0.222 17890 3377 1 5 . 1 1 40 40 LEU H H 40 9.665 9.665 8.626 1.039 17890 3378 1 5 . 1 1 41 41 THR N N 41 126.578 126.578 124.217 2.361 17890 3379 1 5 . 1 1 41 41 THR HA H 41 4.916 4.916 5.218 -0.302 17890 3380 1 5 . 1 1 41 41 THR C C 41 172.547 172.547 173.438 -0.891 17890 3381 1 5 . 1 1 41 41 THR CA C 41 63.253 63.253 61.377 1.876 17890 3382 1 5 . 1 1 41 41 THR CB C 41 71.832 71.832 70.584 1.248 17890 3383 1 5 . 1 1 41 41 THR H H 41 9.802 9.802 9.086 0.716 17890 3384 1 5 . 1 1 42 42 TYR N N 42 130.506 130.506 129.803 0.703 17890 3385 1 5 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.570 0.532 17890 3386 1 5 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.818 -3.832 17890 3387 1 5 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.460 -0.305 17890 3388 1 5 . 1 1 42 42 TYR H H 42 9.428 9.428 8.655 0.773 17890 3389 1 5 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.407 0.083 17890 3390 1 5 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.041 0.532 17890 3391 1 5 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.650 -0.006 17890 3392 1 5 . 1 1 44 44 GLY N N 44 113.736 113.736 107.209 6.527 17890 3393 1 5 . 1 1 44 44 GLY C C 44 171.790 171.790 173.308 -1.518 17890 3394 1 5 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.237 0.479 17890 3395 1 5 . 1 1 44 44 GLY H H 44 8.337 8.337 7.800 0.537 17890 3396 1 5 . 1 1 45 45 ARG N N 45 113.899 113.899 116.579 -2.680 17890 3397 1 5 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.551 0.025 17890 3398 1 5 . 1 1 45 45 ARG C C 45 175.151 175.151 173.692 1.459 17890 3399 1 5 . 1 1 45 45 ARG CA C 45 54.165 54.165 53.980 0.185 17890 3400 1 5 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.799 1.420 17890 3401 1 5 . 1 1 45 45 ARG H H 45 6.463 6.463 7.345 -0.882 17890 3402 1 5 . 1 1 46 46 GLN N N 46 119.000 119.000 118.698 0.302 17890 3403 1 5 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.461 -0.012 17890 3404 1 5 . 1 1 46 46 GLN C C 46 177.282 177.282 176.606 0.676 17890 3405 1 5 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.100 1.513 17890 3406 1 5 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.440 1.056 17890 3407 1 5 . 1 1 46 46 GLN H H 46 8.683 8.683 8.519 0.164 17890 3408 1 5 . 1 1 47 47 ARG N N 47 113.526 113.526 117.061 -3.535 17890 3409 1 5 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.075 -0.545 17890 3410 1 5 . 1 1 47 47 ARG C C 47 174.130 174.130 175.222 -1.092 17890 3411 1 5 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.052 1.764 17890 3412 1 5 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.152 1.918 17890 3413 1 5 . 1 1 47 47 ARG H H 47 9.677 9.677 8.667 1.010 17890 3414 1 5 . 1 1 48 48 THR N N 48 114.672 114.672 114.858 -0.186 17890 3415 1 5 . 1 1 48 48 THR HA H 48 4.938 4.938 4.731 0.207 17890 3416 1 5 . 1 1 48 48 THR CA C 48 59.987 59.987 59.633 0.354 17890 3417 1 5 . 1 1 48 48 THR CB C 48 71.947 71.947 70.869 1.078 17890 3418 1 5 . 1 1 48 48 THR H H 48 8.104 8.104 7.548 0.556 17890 3419 1 5 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.538 -0.170 17890 3420 1 5 . 1 1 49 49 PRO C C 49 175.651 175.651 176.291 -0.640 17890 3421 1 5 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.334 0.847 17890 3422 1 5 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.215 0.482 17890 3423 1 5 . 1 1 50 50 VAL N N 50 122.562 122.562 120.845 1.717 17890 3424 1 5 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.244 -0.297 17890 3425 1 5 . 1 1 50 50 VAL C C 50 174.493 174.493 175.610 -1.117 17890 3426 1 5 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.064 2.747 17890 3427 1 5 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.683 -2.515 17890 3428 1 5 . 1 1 50 50 VAL H H 50 8.123 8.123 8.280 -0.157 17890 3429 1 5 . 1 1 51 51 THR N N 51 113.549 113.549 118.611 -5.062 17890 3430 1 5 . 1 1 51 51 THR HA H 51 5.372 5.372 4.903 0.469 17890 3431 1 5 . 1 1 51 51 THR C C 51 174.841 174.841 173.014 1.827 17890 3432 1 5 . 1 1 51 51 THR CA C 51 59.196 59.196 60.731 -1.535 17890 3433 1 5 . 1 1 51 51 THR CB C 51 72.703 72.703 72.089 0.614 17890 3434 1 5 . 1 1 51 51 THR H H 51 7.057 7.057 8.107 -1.050 17890 3435 1 5 . 1 1 52 52 VAL N N 52 107.374 107.374 116.025 -8.651 17890 3436 1 5 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.264 0.250 17890 3437 1 5 . 1 1 52 52 VAL C C 52 175.697 175.697 173.902 1.795 17890 3438 1 5 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.522 -1.050 17890 3439 1 5 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.978 -0.204 17890 3440 1 5 . 1 1 52 52 VAL H H 52 8.062 8.062 8.534 -0.472 17890 3441 1 5 . 1 1 53 53 SER N N 53 114.662 114.662 118.082 -3.420 17890 3442 1 5 . 1 1 53 53 SER HA H 53 4.690 4.690 5.061 -0.371 17890 3443 1 5 . 1 1 53 53 SER CA C 53 56.828 56.828 56.210 0.618 17890 3444 1 5 . 1 1 53 53 SER CB C 53 64.789 64.789 65.796 -1.007 17890 3445 1 5 . 1 1 53 53 SER H H 53 8.681 8.681 9.240 -0.559 17890 3446 1 5 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.810 -0.034 17890 3447 1 5 . 1 1 54 54 PRO C C 54 177.724 177.724 176.471 1.253 17890 3448 1 5 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.670 0.755 17890 3449 1 5 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.072 0.025 17890 3450 1 5 . 1 1 55 55 LEU N N 55 128.655 128.655 123.642 5.013 17890 3451 1 5 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.270 0.257 17890 3452 1 5 . 1 1 55 55 LEU C C 55 178.696 178.696 176.903 1.793 17890 3453 1 5 . 1 1 55 55 LEU CA C 55 56.246 56.246 55.883 0.363 17890 3454 1 5 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.654 0.952 17890 3455 1 5 . 1 1 55 55 LEU H H 55 8.675 8.675 7.972 0.703 17890 3456 1 5 . 1 1 56 56 ASP N N 56 126.651 126.651 124.364 2.287 17890 3457 1 5 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.721 -0.012 17890 3458 1 5 . 1 1 56 56 ASP C C 56 177.729 177.729 176.479 1.250 17890 3459 1 5 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.778 -0.155 17890 3460 1 5 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.508 0.124 17890 3461 1 5 . 1 1 56 56 ASP H H 56 9.683 9.683 8.389 1.294 17890 3462 1 5 . 1 1 57 57 GLY N N 57 109.299 109.299 108.029 1.270 17890 3463 1 5 . 1 1 57 57 GLY C C 57 174.558 174.558 174.276 0.282 17890 3464 1 5 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.451 0.504 17890 3465 1 5 . 1 1 57 57 GLY H H 57 8.157 8.157 8.262 -0.105 17890 3466 1 5 . 1 1 58 58 SER N N 58 116.740 116.740 115.560 1.180 17890 3467 1 5 . 1 1 58 58 SER HA H 58 4.288 4.288 4.583 -0.295 17890 3468 1 5 . 1 1 58 58 SER C C 58 177.252 177.252 176.233 1.019 17890 3469 1 5 . 1 1 58 58 SER CA C 58 58.737 58.737 56.446 2.291 17890 3470 1 5 . 1 1 58 58 SER CB C 58 64.576 64.576 64.074 0.502 17890 3471 1 5 . 1 1 58 58 SER H H 58 8.328 8.328 7.774 0.554 17890 3472 1 5 . 1 1 59 59 SER N N 59 119.768 119.768 121.891 -2.123 17890 3473 1 5 . 1 1 59 59 SER HA H 59 4.046 4.046 4.140 -0.094 17890 3474 1 5 . 1 1 59 59 SER C C 59 176.671 176.671 175.735 0.936 17890 3475 1 5 . 1 1 59 59 SER CA C 59 61.691 61.691 60.062 1.629 17890 3476 1 5 . 1 1 59 59 SER CB C 59 63.154 63.154 62.854 0.300 17890 3477 1 5 . 1 1 59 59 SER H H 59 9.020 9.020 8.858 0.162 17890 3478 1 5 . 1 1 60 60 GLU N N 60 119.133 119.133 121.011 -1.878 17890 3479 1 5 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.007 0.179 17890 3480 1 5 . 1 1 60 60 GLU C C 60 177.435 177.435 177.568 -0.133 17890 3481 1 5 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.401 1.632 17890 3482 1 5 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.718 -1.492 17890 3483 1 5 . 1 1 60 60 GLU H H 60 8.832 8.832 7.460 1.372 17890 3484 1 5 . 1 1 61 61 GLN N N 61 118.818 118.818 115.185 3.633 17890 3485 1 5 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.987 0.190 17890 3486 1 5 . 1 1 61 61 GLN C C 61 173.254 173.254 174.959 -1.705 17890 3487 1 5 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.870 -0.497 17890 3488 1 5 . 1 1 61 61 GLN CB C 61 27.922 27.922 29.980 -2.058 17890 3489 1 5 . 1 1 61 61 GLN H H 61 7.648 7.648 7.718 -0.070 17890 3490 1 5 . 1 1 62 62 ALA N N 62 122.562 122.562 122.034 0.528 17890 3491 1 5 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.544 0.520 17890 3492 1 5 . 1 1 62 62 ALA C C 62 176.637 176.637 175.324 1.313 17890 3493 1 5 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.115 0.064 17890 3494 1 5 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.207 -0.612 17890 3495 1 5 . 1 1 62 62 ALA H H 62 7.315 7.315 6.839 0.476 17890 3496 1 5 . 1 1 63 63 TRP N N 63 124.787 124.787 120.671 4.116 17890 3497 1 5 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.378 -0.414 17890 3498 1 5 . 1 1 63 63 TRP C C 63 174.351 174.351 175.386 -1.035 17890 3499 1 5 . 1 1 63 63 TRP CA C 63 55.902 55.902 55.938 -0.036 17890 3500 1 5 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.820 -1.703 17890 3501 1 5 . 1 1 63 63 TRP H H 63 9.544 9.544 9.110 0.434 17890 3502 1 5 . 1 1 64 64 ILE N N 64 122.482 122.482 119.231 3.251 17890 3503 1 5 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.977 -0.283 17890 3504 1 5 . 1 1 64 64 ILE C C 64 177.078 177.078 174.302 2.776 17890 3505 1 5 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.579 0.452 17890 3506 1 5 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.263 -0.894 17890 3507 1 5 . 1 1 64 64 ILE H H 64 10.235 10.235 9.447 0.788 17890 3508 1 5 . 1 1 65 65 LEU N N 65 132.183 132.183 128.879 3.304 17890 3509 1 5 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.514 -0.049 17890 3510 1 5 . 1 1 65 65 LEU C C 65 177.048 177.048 174.459 2.589 17890 3511 1 5 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.845 0.504 17890 3512 1 5 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.091 -3.747 17890 3513 1 5 . 1 1 65 65 LEU H H 65 9.432 9.432 9.296 0.136 17890 3514 1 5 . 1 1 66 66 ARG N N 66 120.807 120.807 125.880 -5.073 17890 3515 1 5 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.942 -0.054 17890 3516 1 5 . 1 1 66 66 ARG C C 66 175.275 175.275 174.454 0.821 17890 3517 1 5 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.469 0.586 17890 3518 1 5 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.348 -1.357 17890 3519 1 5 . 1 1 66 66 ARG H H 66 8.491 8.491 8.565 -0.074 17890 3520 1 5 . 1 1 67 67 SER N N 67 119.709 119.709 117.913 1.796 17890 3521 1 5 . 1 1 67 67 SER HA H 67 3.186 3.186 3.430 -0.244 17890 3522 1 5 . 1 1 67 67 SER C C 67 174.508 174.508 173.646 0.862 17890 3523 1 5 . 1 1 67 67 SER CA C 67 58.521 58.521 58.887 -0.366 17890 3524 1 5 . 1 1 67 67 SER CB C 67 62.590 62.590 63.215 -0.625 17890 3525 1 5 . 1 1 67 67 SER H H 67 8.557 8.557 8.677 -0.120 17890 3526 1 5 . 1 1 68 68 TYR N N 68 131.011 131.011 127.698 3.313 17890 3527 1 5 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.635 -0.187 17890 3528 1 5 . 1 1 68 68 TYR C C 68 174.687 174.687 174.792 -0.105 17890 3529 1 5 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.915 0.850 17890 3530 1 5 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.835 -1.847 17890 3531 1 5 . 1 1 68 68 TYR H H 68 8.531 8.531 8.639 -0.108 17890 3532 1 5 . 1 1 69 69 ASP N N 69 117.066 117.066 119.993 -2.927 17890 3533 1 5 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.884 -0.259 17890 3534 1 5 . 1 1 69 69 ASP C C 69 176.455 176.455 175.978 0.477 17890 3535 1 5 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.866 -0.775 17890 3536 1 5 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.803 -0.656 17890 3537 1 5 . 1 1 69 69 ASP H H 69 7.122 7.122 7.611 -0.489 17890 3538 1 5 . 1 1 70 70 SER N N 70 122.869 122.869 119.548 3.321 17890 3539 1 5 . 1 1 70 70 SER HA H 70 4.270 4.270 4.090 0.180 17890 3540 1 5 . 1 1 70 70 SER C C 70 177.010 177.010 175.859 1.151 17890 3541 1 5 . 1 1 70 70 SER CA C 70 60.837 60.837 61.015 -0.178 17890 3542 1 5 . 1 1 70 70 SER CB C 70 62.722 62.722 63.233 -0.511 17890 3543 1 5 . 1 1 70 70 SER H H 70 8.757 8.757 8.737 0.020 17890 3544 1 5 . 1 1 71 71 ASN N N 71 119.873 119.873 119.249 0.624 17890 3545 1 5 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.607 -0.036 17890 3546 1 5 . 1 1 71 71 ASN C C 71 176.226 176.226 175.926 0.300 17890 3547 1 5 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.353 0.360 17890 3548 1 5 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.526 0.115 17890 3549 1 5 . 1 1 71 71 ASN H H 71 8.342 8.342 8.638 -0.296 17890 3550 1 5 . 1 1 72 72 SER N N 72 112.202 112.202 113.502 -1.300 17890 3551 1 5 . 1 1 72 72 SER HA H 72 4.567 4.567 4.740 -0.173 17890 3552 1 5 . 1 1 72 72 SER C C 72 173.789 173.789 173.300 0.489 17890 3553 1 5 . 1 1 72 72 SER CA C 72 57.816 57.816 57.566 0.250 17890 3554 1 5 . 1 1 72 72 SER CB C 72 63.935 63.935 64.382 -0.447 17890 3555 1 5 . 1 1 72 72 SER H H 72 7.560 7.560 7.785 -0.225 17890 3556 1 5 . 1 1 73 73 ASN N N 73 117.437 117.437 118.671 -1.234 17890 3557 1 5 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.372 0.162 17890 3558 1 5 . 1 1 73 73 ASN C C 73 173.647 173.647 174.144 -0.497 17890 3559 1 5 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.513 0.010 17890 3560 1 5 . 1 1 73 73 ASN CB C 73 37.213 37.213 36.865 0.348 17890 3561 1 5 . 1 1 73 73 ASN H H 73 7.940 7.940 7.885 0.055 17890 3562 1 5 . 1 1 74 74 THR N N 74 104.227 104.227 108.516 -4.289 17890 3563 1 5 . 1 1 74 74 THR HA H 74 5.477 5.477 4.894 0.583 17890 3564 1 5 . 1 1 74 74 THR C C 74 176.824 176.824 173.878 2.946 17890 3565 1 5 . 1 1 74 74 THR CA C 74 59.768 59.768 61.434 -1.666 17890 3566 1 5 . 1 1 74 74 THR CB C 74 71.985 71.985 70.245 1.740 17890 3567 1 5 . 1 1 74 74 THR H H 74 7.737 7.737 7.796 -0.059 17890 3568 1 5 . 1 1 75 75 TRP N N 75 124.636 124.636 123.388 1.248 17890 3569 1 5 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.440 -0.233 17890 3570 1 5 . 1 1 75 75 TRP C C 75 175.876 175.876 176.316 -0.440 17890 3571 1 5 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.191 1.415 17890 3572 1 5 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.446 0.070 17890 3573 1 5 . 1 1 75 75 TRP H H 75 9.442 9.442 9.084 0.358 17890 3574 1 5 . 1 1 76 76 THR N N 76 110.544 110.544 114.937 -4.393 17890 3575 1 5 . 1 1 76 76 THR HA H 76 5.129 5.129 5.041 0.088 17890 3576 1 5 . 1 1 76 76 THR C C 76 174.506 174.506 174.586 -0.080 17890 3577 1 5 . 1 1 76 76 THR CA C 76 60.561 60.561 61.515 -0.954 17890 3578 1 5 . 1 1 76 76 THR CB C 76 71.688 71.688 69.983 1.706 17890 3579 1 5 . 1 1 76 76 THR H H 76 9.415 9.415 9.374 0.041 17890 3580 1 5 . 1 1 77 77 ILE N N 77 121.567 121.567 124.814 -3.247 17890 3581 1 5 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.198 -0.059 17890 3582 1 5 . 1 1 77 77 ILE C C 77 176.148 176.148 174.924 1.224 17890 3583 1 5 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.844 1.864 17890 3584 1 5 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.285 1.702 17890 3585 1 5 . 1 1 77 77 ILE H H 77 9.255 9.255 8.297 0.958 17890 3586 1 5 . 1 1 78 78 SER N N 78 122.269 122.269 122.159 0.110 17890 3587 1 5 . 1 1 78 78 SER HA H 78 5.601 5.601 5.223 0.378 17890 3588 1 5 . 1 1 78 78 SER CA C 78 55.835 55.835 55.692 0.143 17890 3589 1 5 . 1 1 78 78 SER CB C 78 65.858 65.858 66.299 -0.440 17890 3590 1 5 . 1 1 78 78 SER H H 78 9.226 9.226 8.693 0.533 17890 3591 1 5 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.255 -0.391 17890 3592 1 5 . 1 1 79 79 PRO C C 79 178.175 178.175 176.427 1.748 17890 3593 1 5 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.337 0.547 17890 3594 1 5 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.094 -1.822 17890 3595 1 5 . 1 1 80 80 VAL N N 80 121.906 121.906 120.394 1.512 17890 3596 1 5 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.749 -0.168 17890 3597 1 5 . 1 1 80 80 VAL C C 80 177.751 177.751 177.432 0.319 17890 3598 1 5 . 1 1 80 80 VAL CA C 80 66.067 66.067 65.078 0.989 17890 3599 1 5 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.475 0.010 17890 3600 1 5 . 1 1 80 80 VAL H H 80 7.328 7.328 8.120 -0.792 17890 3601 1 5 . 1 1 81 81 GLY N N 81 104.643 104.643 107.210 -2.567 17890 3602 1 5 . 1 1 81 81 GLY C C 81 174.979 174.979 174.541 0.438 17890 3603 1 5 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.753 -0.665 17890 3604 1 5 . 1 1 81 81 GLY H H 81 8.949 8.949 8.110 0.839 17890 3605 1 5 . 1 1 82 82 SER N N 82 111.865 111.865 115.735 -3.870 17890 3606 1 5 . 1 1 82 82 SER HA H 82 4.646 4.646 4.746 -0.100 17890 3607 1 5 . 1 1 82 82 SER CA C 82 55.441 55.441 55.157 0.284 17890 3608 1 5 . 1 1 82 82 SER CB C 82 62.277 62.277 63.668 -1.391 17890 3609 1 5 . 1 1 82 82 SER H H 82 6.968 6.968 7.178 -0.210 17890 3610 1 5 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.542 -0.195 17890 3611 1 5 . 1 1 83 83 PRO C C 83 176.660 176.660 176.448 0.212 17890 3612 1 5 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.360 0.843 17890 3613 1 5 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.785 1.034 17890 3614 1 5 . 1 1 84 84 ASN N N 84 116.542 116.542 116.283 0.259 17890 3615 1 5 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.696 0.305 17890 3616 1 5 . 1 1 84 84 ASN C C 84 175.825 175.825 175.008 0.817 17890 3617 1 5 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.836 -0.945 17890 3618 1 5 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.054 0.690 17890 3619 1 5 . 1 1 84 84 ASN H H 84 8.502 8.502 8.450 0.052 17890 3620 1 5 . 1 1 85 85 SER N N 85 114.633 114.633 112.645 1.988 17890 3621 1 5 . 1 1 85 85 SER HA H 85 4.624 4.624 4.956 -0.332 17890 3622 1 5 . 1 1 85 85 SER C C 85 172.963 172.963 172.367 0.596 17890 3623 1 5 . 1 1 85 85 SER CA C 85 59.210 59.210 57.153 2.057 17890 3624 1 5 . 1 1 85 85 SER CB C 85 64.697 64.697 66.388 -1.691 17890 3625 1 5 . 1 1 85 85 SER H H 85 7.980 7.980 7.648 0.332 17890 3626 1 5 . 1 1 86 86 GLN N N 86 119.016 119.016 118.054 0.962 17890 3627 1 5 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.150 0.296 17890 3628 1 5 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.855 -0.404 17890 3629 1 5 . 1 1 86 86 GLN CB C 86 34.398 34.398 33.807 0.591 17890 3630 1 5 . 1 1 86 86 GLN H H 86 9.399 9.399 8.974 0.425 17890 3631 1 5 . 1 1 87 87 ILE N N 87 119.691 119.691 120.257 -0.566 17890 3632 1 5 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.250 -0.675 17890 3633 1 5 . 1 1 87 87 ILE C C 87 176.505 176.505 175.950 0.555 17890 3634 1 5 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.705 4.789 17890 3635 1 5 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.274 -1.077 17890 3636 1 5 . 1 1 87 87 ILE H H 87 8.970 8.970 8.537 0.433 17890 3637 1 5 . 1 1 88 88 GLY N N 88 118.378 118.378 114.590 3.788 17890 3638 1 5 . 1 1 88 88 GLY C C 88 171.397 171.397 171.641 -0.244 17890 3639 1 5 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.189 -1.585 17890 3640 1 5 . 1 1 88 88 GLY H H 88 9.752 9.752 9.001 0.751 17890 3641 1 5 . 1 1 89 89 TRP N N 89 122.749 122.749 122.028 0.721 17890 3642 1 5 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.418 -0.820 17890 3643 1 5 . 1 1 89 89 TRP C C 89 175.924 175.924 174.769 1.155 17890 3644 1 5 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.977 0.306 17890 3645 1 5 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.448 -2.362 17890 3646 1 5 . 1 1 89 89 TRP H H 89 8.215 8.215 8.204 0.011 17890 3647 1 5 . 1 1 90 90 GLY N N 90 116.305 116.305 110.567 5.738 17890 3648 1 5 . 1 1 90 90 GLY C C 90 173.725 173.725 172.382 1.343 17890 3649 1 5 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.509 0.546 17890 3650 1 5 . 1 1 90 90 GLY H H 90 8.922 8.922 8.182 0.740 17890 3651 1 5 . 1 1 91 91 ALA N N 91 123.795 123.795 122.007 1.788 17890 3652 1 5 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.156 0.087 17890 3653 1 5 . 1 1 91 91 ALA C C 91 178.510 178.510 178.923 -0.413 17890 3654 1 5 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.448 0.042 17890 3655 1 5 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.774 -0.365 17890 3656 1 5 . 1 1 91 91 ALA H H 91 8.367 8.367 8.142 0.225 17890 3657 1 5 . 1 1 92 92 GLY N N 92 108.871 108.871 112.708 -3.837 17890 3658 1 5 . 1 1 92 92 GLY C C 92 174.528 174.528 174.836 -0.308 17890 3659 1 5 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.711 0.547 17890 3660 1 5 . 1 1 92 92 GLY H H 92 8.776 8.776 8.612 0.164 17890 3661 1 5 . 1 1 93 93 ASN N N 93 114.921 114.921 117.535 -2.614 17890 3662 1 5 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.766 -0.317 17890 3663 1 5 . 1 1 93 93 ASN C C 93 172.774 172.774 173.758 -0.984 17890 3664 1 5 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.237 0.736 17890 3665 1 5 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.177 -0.848 17890 3666 1 5 . 1 1 93 93 ASN H H 93 8.647 8.647 8.316 0.331 17890 3667 1 5 . 1 1 94 94 VAL N N 94 112.437 112.437 119.028 -6.591 17890 3668 1 5 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.650 0.415 17890 3669 1 5 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.105 -1.190 17890 3670 1 5 . 1 1 94 94 VAL CB C 94 34.155 34.155 36.071 -1.915 17890 3671 1 5 . 1 1 94 94 VAL H H 94 6.989 6.989 7.526 -0.537 17890 3672 1 5 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.930 -0.002 17890 3673 1 5 . 1 1 95 95 PRO C C 95 176.041 176.041 175.835 0.206 17890 3674 1 5 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.528 -1.327 17890 3675 1 5 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.549 -0.824 17890 3676 1 5 . 1 1 96 96 VAL N N 96 113.564 113.564 115.714 -2.150 17890 3677 1 5 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.970 -0.235 17890 3678 1 5 . 1 1 96 96 VAL C C 96 173.656 173.656 175.034 -1.378 17890 3679 1 5 . 1 1 96 96 VAL CA C 96 58.853 58.853 58.920 -0.067 17890 3680 1 5 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.818 1.335 17890 3681 1 5 . 1 1 96 96 VAL H H 96 8.199 8.199 8.765 -0.566 17890 3682 1 5 . 1 1 97 97 VAL N N 97 122.328 122.328 122.528 -0.200 17890 3683 1 5 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.691 -0.060 17890 3684 1 5 . 1 1 97 97 VAL C C 97 174.776 174.776 175.707 -0.931 17890 3685 1 5 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.362 0.295 17890 3686 1 5 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.933 -0.805 17890 3687 1 5 . 1 1 97 97 VAL H H 97 8.957 8.957 8.175 0.782 17890 3688 1 5 . 1 1 98 98 LEU N N 98 130.258 130.258 126.084 4.174 17890 3689 1 5 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.930 0.120 17890 3690 1 5 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.586 1.237 17890 3691 1 5 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.209 0.909 17890 3692 1 5 . 1 1 98 98 LEU H H 98 9.245 9.245 9.134 0.111 17890 3693 1 5 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.784 -0.005 17890 3694 1 5 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.044 0.445 17890 3695 1 5 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.123 -0.669 17890 3696 1 5 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.658 -0.673 17890 3697 1 5 . 1 1 100 100 PRO C C 100 177.309 177.309 175.814 1.495 17890 3698 1 5 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.043 0.781 17890 3699 1 5 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.121 -0.016 17890 3700 1 5 . 1 1 101 101 ASN N N 101 119.284 119.284 126.162 -6.878 17890 3701 1 5 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.664 -0.122 17890 3702 1 5 . 1 1 101 101 ASN C C 101 171.920 171.920 174.051 -2.131 17890 3703 1 5 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.822 -0.622 17890 3704 1 5 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.621 -1.996 17890 3705 1 5 . 1 1 101 101 ASN H H 101 7.273 7.273 9.358 -2.085 17890 3706 1 5 . 1 1 102 102 ASN N N 102 115.674 115.674 116.592 -0.918 17890 3707 1 5 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.682 -0.764 17890 3708 1 5 . 1 1 102 102 ASN C C 102 173.264 173.264 174.200 -0.936 17890 3709 1 5 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.793 1.246 17890 3710 1 5 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.306 -1.323 17890 3711 1 5 . 1 1 102 102 ASN H H 102 8.197 8.197 7.783 0.414 17890 3712 1 5 . 1 1 103 103 TYR N N 103 118.775 118.775 120.841 -2.066 17890 3713 1 5 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.362 0.123 17890 3714 1 5 . 1 1 103 103 TYR C C 103 175.248 175.248 175.330 -0.082 17890 3715 1 5 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.722 -2.232 17890 3716 1 5 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.487 -0.955 17890 3717 1 5 . 1 1 103 103 TYR H H 103 7.745 7.745 7.450 0.295 17890 3718 1 5 . 1 1 104 104 VAL N N 104 116.205 116.205 114.548 1.657 17890 3719 1 5 . 1 1 104 104 VAL HA H 104 4.977 4.977 5.019 -0.042 17890 3720 1 5 . 1 1 104 104 VAL C C 104 174.361 174.361 173.765 0.596 17890 3721 1 5 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.570 -1.319 17890 3722 1 5 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.657 -0.114 17890 3723 1 5 . 1 1 104 104 VAL H H 104 7.498 7.498 7.950 -0.452 17890 3724 1 5 . 1 1 105 105 TRP N N 105 119.557 119.557 120.049 -0.492 17890 3725 1 5 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.140 -0.265 17890 3726 1 5 . 1 1 105 105 TRP C C 105 175.526 175.526 176.318 -0.792 17890 3727 1 5 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.479 -0.595 17890 3728 1 5 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.511 0.028 17890 3729 1 5 . 1 1 105 105 TRP H H 105 8.926 8.926 8.916 0.010 17890 3730 1 5 . 1 1 106 106 THR N N 106 120.480 120.480 120.271 0.209 17890 3731 1 5 . 1 1 106 106 THR HA H 106 4.966 4.966 4.839 0.127 17890 3732 1 5 . 1 1 106 106 THR C C 106 174.177 174.177 173.996 0.181 17890 3733 1 5 . 1 1 106 106 THR CA C 106 62.091 62.091 63.784 -1.693 17890 3734 1 5 . 1 1 106 106 THR CB C 106 69.649 69.649 69.252 0.397 17890 3735 1 5 . 1 1 106 106 THR H H 106 9.525 9.525 9.198 0.327 17890 3736 1 5 . 1 1 107 107 LEU N N 107 127.146 127.146 128.816 -1.670 17890 3737 1 5 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.254 -0.427 17890 3738 1 5 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.373 0.336 17890 3739 1 5 . 1 1 107 107 LEU CB C 107 41.523 41.523 44.502 -2.979 17890 3740 1 5 . 1 1 107 107 LEU H H 107 7.591 7.591 8.739 -1.148 17890 3741 1 5 . 1 1 108 108 THR N N 108 119.928 119.928 119.174 0.754 17890 3742 1 5 . 1 1 108 108 THR HA H 108 4.411 4.411 4.699 -0.288 17890 3743 1 5 . 1 1 108 108 THR C C 108 173.319 173.319 173.142 0.177 17890 3744 1 5 . 1 1 108 108 THR CA C 108 62.243 62.243 61.152 1.091 17890 3745 1 5 . 1 1 108 108 THR CB C 108 70.138 70.138 71.547 -1.409 17890 3746 1 5 . 1 1 108 108 THR H H 108 8.141 8.141 8.759 -0.618 17890 3747 1 5 . 1 1 109 109 LEU N N 109 130.557 130.557 129.994 0.563 17890 3748 1 5 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.909 -0.364 17890 3749 1 5 . 1 1 109 109 LEU C C 109 175.217 175.217 176.745 -1.528 17890 3750 1 5 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.462 -0.176 17890 3751 1 5 . 1 1 109 109 LEU CB C 109 40.606 40.606 41.644 -1.038 17890 3752 1 5 . 1 1 109 109 LEU H H 109 8.924 8.924 8.738 0.186 17890 3753 1 5 . 1 1 110 110 THR N N 110 120.160 120.160 116.959 3.201 17890 3754 1 5 . 1 1 110 110 THR HA H 110 4.911 4.911 4.657 0.254 17890 3755 1 5 . 1 1 110 110 THR CA C 110 60.141 60.141 60.372 -0.231 17890 3756 1 5 . 1 1 110 110 THR CB C 110 72.785 72.785 70.736 2.049 17890 3757 1 5 . 1 1 110 110 THR H H 110 7.677 7.677 8.511 -0.834 17890 3758 1 5 . 1 1 111 111 SER HA H 111 4.204 4.204 4.214 -0.010 17890 3759 1 5 . 1 1 111 111 SER C C 111 174.755 174.755 174.845 -0.090 17890 3760 1 5 . 1 1 111 111 SER CA C 111 60.710 60.710 60.025 0.685 17890 3761 1 5 . 1 1 111 111 SER CB C 111 62.660 62.660 62.835 -0.175 17890 3762 1 5 . 1 1 112 112 GLY N N 112 107.313 107.313 106.113 1.200 17890 3763 1 5 . 1 1 112 112 GLY C C 112 173.023 173.023 172.868 0.155 17890 3764 1 5 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.146 -0.996 17890 3765 1 5 . 1 1 112 112 GLY H H 112 8.249 8.249 7.369 0.880 17890 3766 1 5 . 1 1 113 113 GLY N N 113 105.618 105.618 107.847 -2.229 17890 3767 1 5 . 1 1 113 113 GLY C C 113 175.844 175.844 171.844 4.000 17890 3768 1 5 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.966 -3.207 17890 3769 1 5 . 1 1 113 113 GLY H H 113 7.444 7.444 7.500 -0.056 17890 3770 1 5 . 1 1 114 114 TYR N N 114 121.548 121.548 118.538 3.010 17890 3771 1 5 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.479 -0.627 17890 3772 1 5 . 1 1 114 114 TYR C C 114 175.605 175.605 174.231 1.374 17890 3773 1 5 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.451 4.812 17890 3774 1 5 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.534 -4.601 17890 3775 1 5 . 1 1 114 114 TYR H H 114 9.677 9.677 8.954 0.723 17890 3776 1 5 . 1 1 115 115 ASN N N 115 123.274 123.274 117.598 5.676 17890 3777 1 5 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.193 -0.095 17890 3778 1 5 . 1 1 115 115 ASN C C 115 174.355 174.355 173.077 1.278 17890 3779 1 5 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.409 -1.363 17890 3780 1 5 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.661 -2.312 17890 3781 1 5 . 1 1 115 115 ASN H H 115 9.350 9.350 8.839 0.511 17890 3782 1 5 . 1 1 116 116 ILE N N 116 130.611 130.611 122.682 7.929 17890 3783 1 5 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.662 -0.423 17890 3784 1 5 . 1 1 116 116 ILE C C 116 173.998 173.998 173.855 0.143 17890 3785 1 5 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.201 1.998 17890 3786 1 5 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.466 -2.366 17890 3787 1 5 . 1 1 116 116 ILE H H 116 9.473 9.473 8.652 0.821 17890 3788 1 5 . 1 1 117 117 GLN N N 117 121.633 121.633 124.966 -3.333 17890 3789 1 5 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.058 0.877 17890 3790 1 5 . 1 1 117 117 GLN C C 117 177.902 177.902 175.871 2.031 17890 3791 1 5 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.881 -0.561 17890 3792 1 5 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.544 3.913 17890 3793 1 5 . 1 1 117 117 GLN H H 117 8.781 8.781 8.903 -0.122 17890 3794 1 5 . 1 1 118 118 ASP N N 118 116.836 116.836 120.444 -3.608 17890 3795 1 5 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.967 0.816 17890 3796 1 5 . 1 1 118 118 ASP C C 118 178.084 178.084 177.023 1.061 17890 3797 1 5 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.320 -1.550 17890 3798 1 5 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.165 -0.797 17890 3799 1 5 . 1 1 118 118 ASP H H 118 9.330 9.330 8.796 0.534 17890 3800 1 5 . 1 1 119 119 GLY N N 119 111.037 111.037 108.054 2.983 17890 3801 1 5 . 1 1 119 119 GLY C C 119 174.196 174.196 175.133 -0.937 17890 3802 1 5 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.925 2.051 17890 3803 1 5 . 1 1 119 119 GLY H H 119 8.986 8.986 8.309 0.677 17890 3804 1 5 . 1 1 120 120 LYS N N 120 114.809 114.809 121.212 -6.403 17890 3805 1 5 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.362 -0.013 17890 3806 1 5 . 1 1 120 120 LYS C C 120 175.174 175.174 177.019 -1.845 17890 3807 1 5 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.442 0.491 17890 3808 1 5 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.387 0.089 17890 3809 1 5 . 1 1 120 120 LYS H H 120 7.045 7.045 8.669 -1.624 17890 3810 1 5 . 1 1 121 121 ARG N N 121 116.291 116.291 112.549 3.742 17890 3811 1 5 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.026 -0.440 17890 3812 1 5 . 1 1 121 121 ARG C C 121 175.097 175.097 176.926 -1.829 17890 3813 1 5 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.259 0.810 17890 3814 1 5 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.635 -0.012 17890 3815 1 5 . 1 1 121 121 ARG H H 121 7.683 7.683 8.178 -0.495 17890 3816 1 5 . 1 1 122 122 THR N N 122 113.730 113.730 109.076 4.654 17890 3817 1 5 . 1 1 122 122 THR HA H 122 4.540 4.540 4.250 0.290 17890 3818 1 5 . 1 1 122 122 THR C C 122 175.302 175.302 174.590 0.712 17890 3819 1 5 . 1 1 122 122 THR CA C 122 62.871 62.871 64.417 -1.546 17890 3820 1 5 . 1 1 122 122 THR CB C 122 71.552 71.552 70.133 1.419 17890 3821 1 5 . 1 1 122 122 THR H H 122 11.059 11.059 8.142 2.917 17890 3822 1 5 . 1 1 123 123 VAL N N 123 118.350 118.350 113.801 4.549 17890 3823 1 5 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.623 0.187 17890 3824 1 5 . 1 1 123 123 VAL C C 123 174.730 174.730 173.657 1.073 17890 3825 1 5 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.507 0.804 17890 3826 1 5 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.672 2.410 17890 3827 1 5 . 1 1 123 123 VAL H H 123 8.181 8.181 7.414 0.767 17890 3828 1 5 . 1 1 124 124 SER N N 124 113.053 113.053 114.446 -1.393 17890 3829 1 5 . 1 1 124 124 SER HA H 124 5.820 5.820 5.293 0.527 17890 3830 1 5 . 1 1 124 124 SER C C 124 175.521 175.521 173.828 1.693 17890 3831 1 5 . 1 1 124 124 SER CA C 124 58.087 58.087 56.635 1.452 17890 3832 1 5 . 1 1 124 124 SER CB C 124 67.405 67.405 65.904 1.501 17890 3833 1 5 . 1 1 124 124 SER H H 124 9.138 9.138 8.678 0.460 17890 3834 1 5 . 1 1 125 125 TRP N N 125 124.900 124.900 124.330 0.570 17890 3835 1 5 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.923 0.687 17890 3836 1 5 . 1 1 125 125 TRP C C 125 178.114 178.114 177.396 0.718 17890 3837 1 5 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.297 -0.823 17890 3838 1 5 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.011 1.012 17890 3839 1 5 . 1 1 125 125 TRP H H 125 8.843 8.843 8.003 0.840 17890 3840 1 5 . 1 1 126 126 SER N N 126 119.243 119.243 113.863 5.380 17890 3841 1 5 . 1 1 126 126 SER HA H 126 5.443 5.443 5.347 0.096 17890 3842 1 5 . 1 1 126 126 SER C C 126 171.668 171.668 172.847 -1.179 17890 3843 1 5 . 1 1 126 126 SER CA C 126 58.696 58.696 57.214 1.482 17890 3844 1 5 . 1 1 126 126 SER CB C 126 66.176 66.176 66.310 -0.134 17890 3845 1 5 . 1 1 126 126 SER H H 126 9.835 9.835 9.268 0.567 17890 3846 1 5 . 1 1 127 127 LEU N N 127 113.708 113.708 117.836 -4.128 17890 3847 1 5 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.692 0.463 17890 3848 1 5 . 1 1 127 127 LEU C C 127 176.563 176.563 176.653 -0.090 17890 3849 1 5 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.431 -0.786 17890 3850 1 5 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.550 -1.854 17890 3851 1 5 . 1 1 127 127 LEU H H 127 6.559 6.559 8.316 -1.757 17890 3852 1 5 . 1 1 128 128 ASN N N 128 121.739 121.739 119.064 2.675 17890 3853 1 5 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.977 -0.288 17890 3854 1 5 . 1 1 128 128 ASN C C 128 175.452 175.452 175.336 0.116 17890 3855 1 5 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.962 1.046 17890 3856 1 5 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.411 -1.120 17890 3857 1 5 . 1 1 128 128 ASN H H 128 8.662 8.662 9.377 -0.716 17890 3858 1 5 . 1 1 129 129 ASN N N 129 119.586 119.586 116.410 3.176 17890 3859 1 5 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.906 0.091 17890 3860 1 5 . 1 1 129 129 ASN C C 129 175.900 175.900 174.809 1.091 17890 3861 1 5 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.430 0.803 17890 3862 1 5 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.113 0.143 17890 3863 1 5 . 1 1 129 129 ASN H H 129 10.962 10.962 8.790 2.172 17890 3864 1 5 . 1 1 130 130 ALA N N 130 128.292 128.292 121.992 6.300 17890 3865 1 5 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.001 -0.431 17890 3866 1 5 . 1 1 130 130 ALA C C 130 172.620 172.620 176.454 -3.834 17890 3867 1 5 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.454 -0.815 17890 3868 1 5 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.013 -0.913 17890 3869 1 5 . 1 1 130 130 ALA H H 130 10.629 10.629 8.692 1.937 17890 3870 1 5 . 1 1 131 131 THR N N 131 105.584 105.584 108.876 -3.292 17890 3871 1 5 . 1 1 131 131 THR HA H 131 4.462 4.462 4.240 0.222 17890 3872 1 5 . 1 1 131 131 THR C C 131 173.552 173.552 175.055 -1.503 17890 3873 1 5 . 1 1 131 131 THR CA C 131 58.338 58.338 60.427 -2.089 17890 3874 1 5 . 1 1 131 131 THR CB C 131 71.569 71.569 69.540 2.029 17890 3875 1 5 . 1 1 131 131 THR H H 131 7.092 7.092 7.700 -0.608 17890 3876 1 5 . 1 1 132 132 ALA N N 132 121.773 121.773 126.209 -4.436 17890 3877 1 5 . 1 1 132 132 ALA HA H 132 3.749 3.749 3.994 -0.245 17890 3878 1 5 . 1 1 132 132 ALA C C 132 178.819 178.819 178.065 0.754 17890 3879 1 5 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.048 1.236 17890 3880 1 5 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.603 -0.376 17890 3881 1 5 . 1 1 132 132 ALA H H 132 8.952 8.952 8.599 0.353 17890 3882 1 5 . 1 1 133 133 GLY N N 133 113.965 113.965 112.331 1.634 17890 3883 1 5 . 1 1 133 133 GLY C C 133 173.453 173.453 174.289 -0.836 17890 3884 1 5 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.802 0.364 17890 3885 1 5 . 1 1 133 133 GLY H H 133 9.016 9.016 8.666 0.350 17890 3886 1 5 . 1 1 134 134 GLU N N 134 123.460 123.460 121.570 1.890 17890 3887 1 5 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.292 -0.334 17890 3888 1 5 . 1 1 134 134 GLU C C 134 176.120 176.120 176.277 -0.157 17890 3889 1 5 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.079 1.320 17890 3890 1 5 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.946 0.439 17890 3891 1 5 . 1 1 134 134 GLU H H 134 7.598 7.598 7.591 0.007 17890 3892 1 5 . 1 1 135 135 GLU N N 135 122.633 122.633 124.895 -2.262 17890 3893 1 5 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.234 0.077 17890 3894 1 5 . 1 1 135 135 GLU C C 135 176.014 176.014 176.621 -0.607 17890 3895 1 5 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.391 -0.209 17890 3896 1 5 . 1 1 135 135 GLU CB C 135 29.453 29.453 29.939 -0.487 17890 3897 1 5 . 1 1 135 135 GLU H H 135 8.258 8.258 8.598 -0.340 17890 3898 1 5 . 1 1 136 136 VAL N N 136 123.635 123.635 126.264 -2.629 17890 3899 1 5 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.784 -0.092 17890 3900 1 5 . 1 1 136 136 VAL C C 136 173.932 173.932 174.862 -0.930 17890 3901 1 5 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.248 0.584 17890 3902 1 5 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.594 -0.730 17890 3903 1 5 . 1 1 136 136 VAL H H 136 7.267 7.267 7.840 -0.573 17890 3904 1 5 . 1 1 137 137 SER N N 137 118.950 118.950 121.197 -2.247 17890 3905 1 5 . 1 1 137 137 SER HA H 137 4.887 4.887 5.182 -0.295 17890 3906 1 5 . 1 1 137 137 SER C C 137 173.780 173.780 173.152 0.628 17890 3907 1 5 . 1 1 137 137 SER CA C 137 57.895 57.895 56.671 1.224 17890 3908 1 5 . 1 1 137 137 SER CB C 137 65.027 65.027 67.041 -2.014 17890 3909 1 5 . 1 1 137 137 SER H H 137 8.454 8.454 8.621 -0.167 17890 3910 1 5 . 1 1 138 138 ILE N N 138 123.511 123.511 119.718 3.793 17890 3911 1 5 . 1 1 138 138 ILE HA H 138 4.248 4.248 4.930 -0.682 17890 3912 1 5 . 1 1 138 138 ILE C C 138 176.142 176.142 175.574 0.568 17890 3913 1 5 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.528 1.322 17890 3914 1 5 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.695 -3.100 17890 3915 1 5 . 1 1 138 138 ILE H H 138 7.915 7.915 8.292 -0.377 17890 3916 1 5 . 1 1 139 139 GLY N N 139 115.638 115.638 110.936 4.702 17890 3917 1 5 . 1 1 139 139 GLY C C 139 171.947 171.947 173.256 -1.309 17890 3918 1 5 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.416 1.670 17890 3919 1 5 . 1 1 139 139 GLY H H 139 8.490 8.490 8.408 0.082 17890 3920 1 5 . 1 1 140 140 ALA N N 140 128.563 128.563 121.365 7.198 17890 3921 1 5 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.397 -0.001 17890 3922 1 5 . 1 1 140 140 ALA C C 140 177.956 177.956 177.200 0.756 17890 3923 1 5 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.650 -2.004 17890 3924 1 5 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.968 0.236 17890 3925 1 5 . 1 1 140 140 ALA H H 140 8.531 8.531 8.365 0.166 17890 3926 1 5 . 1 1 141 141 ASP N N 141 120.886 120.886 114.752 6.134 17890 3927 1 5 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.589 0.009 17890 3928 1 5 . 1 1 141 141 ASP C C 141 175.411 175.411 174.338 1.073 17890 3929 1 5 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.667 0.249 17890 3930 1 5 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.449 -1.757 17890 3931 1 5 . 1 1 141 141 ASP H H 141 8.507 8.507 7.690 0.817 17890 3932 1 5 . 1 1 142 142 ALA N N 142 125.604 125.604 123.023 2.581 17890 3933 1 5 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.666 -0.149 17890 3934 1 5 . 1 1 142 142 ALA C C 142 177.671 177.671 177.880 -0.209 17890 3935 1 5 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.560 0.433 17890 3936 1 5 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.095 0.441 17890 3937 1 5 . 1 1 142 142 ALA H H 142 7.894 7.894 8.213 -0.319 17890 3938 1 5 . 1 1 143 143 THR N N 143 118.085 118.085 117.552 0.533 17890 3939 1 5 . 1 1 143 143 THR HA H 143 3.744 3.744 4.139 -0.395 17890 3940 1 5 . 1 1 143 143 THR C C 143 175.464 175.464 175.028 0.436 17890 3941 1 5 . 1 1 143 143 THR CA C 143 64.548 64.548 64.799 -0.251 17890 3942 1 5 . 1 1 143 143 THR CB C 143 69.305 69.305 68.875 0.430 17890 3943 1 5 . 1 1 143 143 THR H H 143 8.268 8.268 8.912 -0.644 17890 3944 1 5 . 1 1 144 144 PHE N N 144 118.635 118.635 116.235 2.400 17890 3945 1 5 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.679 -0.333 17890 3946 1 5 . 1 1 144 144 PHE C C 144 176.209 176.209 174.944 1.265 17890 3947 1 5 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.815 3.647 17890 3948 1 5 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.350 0.254 17890 3949 1 5 . 1 1 144 144 PHE H H 144 8.719 8.719 7.932 0.787 17890 3950 1 5 . 1 1 145 145 SER N N 145 113.446 113.446 114.524 -1.078 17890 3951 1 5 . 1 1 145 145 SER HA H 145 4.866 4.866 4.016 0.850 17890 3952 1 5 . 1 1 145 145 SER C C 145 176.605 176.605 175.299 1.306 17890 3953 1 5 . 1 1 145 145 SER CA C 145 59.432 59.432 57.373 2.059 17890 3954 1 5 . 1 1 145 145 SER CB C 145 62.167 62.167 63.279 -1.112 17890 3955 1 5 . 1 1 145 145 SER H H 145 8.657 8.657 7.284 1.373 17890 3956 1 5 . 1 1 146 146 GLY N N 146 109.277 109.277 109.198 0.079 17890 3957 1 5 . 1 1 146 146 GLY C C 146 174.293 174.293 173.508 0.785 17890 3958 1 5 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.318 -0.378 17890 3959 1 5 . 1 1 146 146 GLY H H 146 7.467 7.467 7.618 -0.151 17890 3960 1 5 . 1 1 147 147 ARG N N 147 122.863 122.863 118.410 4.453 17890 3961 1 5 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.910 0.531 17890 3962 1 5 . 1 1 147 147 ARG C C 147 173.849 173.849 174.488 -0.639 17890 3963 1 5 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.956 -2.729 17890 3964 1 5 . 1 1 147 147 ARG CB C 147 32.597 32.597 34.072 -1.475 17890 3965 1 5 . 1 1 147 147 ARG H H 147 7.556 7.556 6.873 0.683 17890 3966 1 5 . 1 1 148 148 TRP N N 148 118.465 118.465 121.211 -2.746 17890 3967 1 5 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.101 -0.255 17890 3968 1 5 . 1 1 148 148 TRP C C 148 174.353 174.353 174.201 0.152 17890 3969 1 5 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.900 -1.238 17890 3970 1 5 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.318 -1.319 17890 3971 1 5 . 1 1 148 148 TRP H H 148 8.709 8.709 9.253 -0.544 17890 3972 1 5 . 1 1 149 149 VAL N N 149 125.852 125.852 118.024 7.828 17890 3973 1 5 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.559 -0.416 17890 3974 1 5 . 1 1 149 149 VAL C C 149 173.613 173.613 173.367 0.246 17890 3975 1 5 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.825 1.915 17890 3976 1 5 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.183 -2.800 17890 3977 1 5 . 1 1 149 149 VAL H H 149 9.700 9.700 8.865 0.835 17890 3978 1 5 . 1 1 150 150 ILE N N 150 125.140 125.140 127.593 -2.453 17890 3979 1 5 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.116 -0.254 17890 3980 1 5 . 1 1 150 150 ILE C C 150 175.661 175.661 174.103 1.558 17890 3981 1 5 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.507 1.314 17890 3982 1 5 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.556 -0.736 17890 3983 1 5 . 1 1 150 150 ILE H H 150 7.747 7.747 7.728 0.019 17890 3984 1 5 . 1 1 151 151 GLU N N 151 126.762 126.762 126.808 -0.046 17890 3985 1 5 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.877 0.003 17890 3986 1 5 . 1 1 151 151 GLU C C 151 174.424 174.424 174.793 -0.369 17890 3987 1 5 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.036 0.760 17890 3988 1 5 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.854 0.397 17890 3989 1 5 . 1 1 151 151 GLU H H 151 8.892 8.892 8.768 0.124 17890 3990 1 5 . 1 1 152 152 LYS N N 152 126.299 126.299 122.825 3.474 17890 3991 1 5 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.788 0.073 17890 3992 1 5 . 1 1 152 152 LYS C C 152 176.282 176.282 176.507 -0.225 17890 3993 1 5 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.814 0.691 17890 3994 1 5 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.554 0.781 17890 3995 1 5 . 1 1 152 152 LYS H H 152 8.640 8.640 8.347 0.293 17890 3996 1 6 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.045 -1.752 17890 3997 1 6 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.623 -0.001 17890 3998 1 6 . 1 1 8 8 HIS CA C 8 55.661 55.661 55.829 -0.168 17890 3999 1 6 . 1 1 8 8 HIS CB C 8 29.880 29.880 30.558 -0.678 17890 4000 1 6 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.551 0.095 17890 4001 1 6 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.940 -0.256 17890 4002 1 6 . 1 1 9 9 HIS CB C 9 29.831 29.831 31.140 -1.309 17890 4003 1 6 . 1 1 10 10 HIS N N 10 120.811 120.811 119.374 1.437 17890 4004 1 6 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.301 0.379 17890 4005 1 6 . 1 1 10 10 HIS C C 10 174.875 174.875 175.625 -0.750 17890 4006 1 6 . 1 1 10 10 HIS CA C 10 55.746 55.746 57.613 -1.867 17890 4007 1 6 . 1 1 10 10 HIS CB C 10 29.889 29.889 30.128 -0.239 17890 4008 1 6 . 1 1 10 10 HIS H H 10 8.583 8.583 8.050 0.533 17890 4009 1 6 . 1 1 11 11 SER N N 11 118.009 118.009 111.273 6.736 17890 4010 1 6 . 1 1 11 11 SER HA H 11 4.424 4.424 4.146 0.278 17890 4011 1 6 . 1 1 11 11 SER C C 11 174.962 174.962 174.023 0.939 17890 4012 1 6 . 1 1 11 11 SER CA C 11 58.660 58.660 58.875 -0.215 17890 4013 1 6 . 1 1 11 11 SER CB C 11 63.822 63.822 62.345 1.477 17890 4014 1 6 . 1 1 11 11 SER H H 11 8.438 8.438 7.022 1.416 17890 4015 1 6 . 1 1 12 12 GLY N N 12 111.011 111.011 105.952 5.059 17890 4016 1 6 . 1 1 12 12 GLY C C 12 173.907 173.907 174.157 -0.250 17890 4017 1 6 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.218 0.204 17890 4018 1 6 . 1 1 12 12 GLY H H 12 8.433 8.433 7.687 0.746 17890 4019 1 6 . 1 1 13 13 ASP N N 13 120.291 120.291 119.675 0.616 17890 4020 1 6 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.605 0.057 17890 4021 1 6 . 1 1 13 13 ASP C C 13 176.115 176.115 176.045 0.070 17890 4022 1 6 . 1 1 13 13 ASP CA C 13 54.303 54.303 55.712 -1.409 17890 4023 1 6 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.293 0.172 17890 4024 1 6 . 1 1 13 13 ASP H H 13 8.153 8.153 8.694 -0.541 17890 4025 1 6 . 1 1 14 14 SER N N 14 116.987 116.987 110.772 6.215 17890 4026 1 6 . 1 1 14 14 SER HA H 14 4.754 4.754 4.969 -0.215 17890 4027 1 6 . 1 1 14 14 SER CA C 14 56.469 56.469 55.086 1.383 17890 4028 1 6 . 1 1 14 14 SER CB C 14 63.553 63.553 65.576 -2.023 17890 4029 1 6 . 1 1 14 14 SER H H 14 8.210 8.210 7.571 0.639 17890 4030 1 6 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.552 -0.110 17890 4031 1 6 . 1 1 15 15 PRO C C 15 176.424 176.424 175.633 0.791 17890 4032 1 6 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.883 0.350 17890 4033 1 6 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.280 -0.132 17890 4034 1 6 . 1 1 16 16 ALA N N 16 124.219 124.219 122.496 1.723 17890 4035 1 6 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.558 -0.208 17890 4036 1 6 . 1 1 16 16 ALA C C 16 177.552 177.552 176.648 0.904 17890 4037 1 6 . 1 1 16 16 ALA CA C 16 52.433 52.433 51.703 0.730 17890 4038 1 6 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.346 -0.027 17890 4039 1 6 . 1 1 16 16 ALA H H 16 8.284 8.284 8.283 0.001 17890 4040 1 6 . 1 1 17 17 VAL N N 17 119.504 119.504 120.514 -1.010 17890 4041 1 6 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.226 0.023 17890 4042 1 6 . 1 1 17 17 VAL C C 17 176.322 176.322 176.278 0.044 17890 4043 1 6 . 1 1 17 17 VAL CA C 17 62.278 62.278 63.420 -1.142 17890 4044 1 6 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.401 0.556 17890 4045 1 6 . 1 1 17 17 VAL H H 17 8.046 8.046 7.811 0.235 17890 4046 1 6 . 1 1 18 18 THR N N 18 118.186 118.186 115.801 2.385 17890 4047 1 6 . 1 1 18 18 THR HA H 18 4.473 4.473 4.595 -0.122 17890 4048 1 6 . 1 1 18 18 THR C C 18 174.248 174.248 174.632 -0.384 17890 4049 1 6 . 1 1 18 18 THR CA C 18 61.565 61.565 61.183 0.382 17890 4050 1 6 . 1 1 18 18 THR CB C 18 70.165 70.165 69.756 0.409 17890 4051 1 6 . 1 1 18 18 THR H H 18 8.276 8.276 8.256 0.020 17890 4052 1 6 . 1 1 19 19 LEU N N 19 125.265 125.265 119.952 5.313 17890 4053 1 6 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.920 0.373 17890 4054 1 6 . 1 1 19 19 LEU C C 19 175.689 175.689 175.104 0.585 17890 4055 1 6 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.164 0.262 17890 4056 1 6 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.065 2.214 17890 4057 1 6 . 1 1 19 19 LEU H H 19 8.091 8.091 7.901 0.190 17890 4058 1 6 . 1 1 20 20 SER N N 20 114.622 114.622 114.477 0.145 17890 4059 1 6 . 1 1 20 20 SER HA H 20 4.947 4.947 4.903 0.044 17890 4060 1 6 . 1 1 20 20 SER C C 20 174.220 174.220 172.744 1.476 17890 4061 1 6 . 1 1 20 20 SER CA C 20 56.583 56.583 57.261 -0.678 17890 4062 1 6 . 1 1 20 20 SER CB C 20 65.653 65.653 64.862 0.791 17890 4063 1 6 . 1 1 20 20 SER H H 20 7.316 7.316 7.948 -0.632 17890 4064 1 6 . 1 1 21 21 ALA N N 21 125.517 125.517 123.492 2.025 17890 4065 1 6 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.939 -0.271 17890 4066 1 6 . 1 1 21 21 ALA C C 21 177.960 177.960 177.222 0.738 17890 4067 1 6 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.489 1.521 17890 4068 1 6 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.445 -0.220 17890 4069 1 6 . 1 1 21 21 ALA H H 21 8.993 8.993 8.455 0.538 17890 4070 1 6 . 1 1 22 22 GLY N N 22 109.543 109.543 110.901 -1.358 17890 4071 1 6 . 1 1 22 22 GLY C C 22 170.422 170.422 171.761 -1.339 17890 4072 1 6 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.129 0.252 17890 4073 1 6 . 1 1 22 22 GLY H H 22 8.411 8.411 8.911 -0.500 17890 4074 1 6 . 1 1 23 23 ASN N N 23 119.649 119.649 119.016 0.633 17890 4075 1 6 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.705 0.182 17890 4076 1 6 . 1 1 23 23 ASN C C 23 175.207 175.207 174.573 0.634 17890 4077 1 6 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.587 -0.766 17890 4078 1 6 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.499 -0.744 17890 4079 1 6 . 1 1 23 23 ASN H H 23 8.092 8.092 8.429 -0.337 17890 4080 1 6 . 1 1 24 24 TYR N N 24 120.889 120.889 121.620 -0.731 17890 4081 1 6 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.204 0.051 17890 4082 1 6 . 1 1 24 24 TYR C C 24 175.667 175.667 174.469 1.198 17890 4083 1 6 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.282 0.831 17890 4084 1 6 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.637 0.189 17890 4085 1 6 . 1 1 24 24 TYR H H 24 9.914 9.914 8.999 0.915 17890 4086 1 6 . 1 1 25 25 ILE N N 25 115.978 115.978 113.411 2.567 17890 4087 1 6 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.070 0.016 17890 4088 1 6 . 1 1 25 25 ILE C C 25 175.200 175.200 174.264 0.936 17890 4089 1 6 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.549 0.996 17890 4090 1 6 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.937 -0.815 17890 4091 1 6 . 1 1 25 25 ILE H H 25 9.216 9.216 9.286 -0.070 17890 4092 1 6 . 1 1 26 26 ILE N N 26 123.957 123.957 122.019 1.938 17890 4093 1 6 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.207 -0.231 17890 4094 1 6 . 1 1 26 26 ILE C C 26 174.810 174.810 174.851 -0.041 17890 4095 1 6 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.319 0.290 17890 4096 1 6 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.082 1.040 17890 4097 1 6 . 1 1 26 26 ILE H H 26 9.559 9.559 9.026 0.533 17890 4098 1 6 . 1 1 27 27 TYR N N 27 121.371 121.371 123.901 -2.530 17890 4099 1 6 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.605 0.585 17890 4100 1 6 . 1 1 27 27 TYR C C 27 173.963 173.963 173.338 0.625 17890 4101 1 6 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.991 -0.322 17890 4102 1 6 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.074 0.624 17890 4103 1 6 . 1 1 27 27 TYR H H 27 9.378 9.378 9.135 0.243 17890 4104 1 6 . 1 1 28 28 ASN N N 28 121.991 121.991 119.478 2.513 17890 4105 1 6 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.229 -0.461 17890 4106 1 6 . 1 1 28 28 ASN C C 28 174.352 174.352 176.542 -2.190 17890 4107 1 6 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.385 2.735 17890 4108 1 6 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.785 1.661 17890 4109 1 6 . 1 1 28 28 ASN H H 28 8.466 8.466 8.324 0.142 17890 4110 1 6 . 1 1 29 29 ARG N N 29 121.103 121.103 126.148 -5.045 17890 4111 1 6 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.078 -0.217 17890 4112 1 6 . 1 1 29 29 ARG C C 29 173.635 173.635 177.591 -3.956 17890 4113 1 6 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.796 1.497 17890 4114 1 6 . 1 1 29 29 ARG CB C 29 30.399 30.399 29.634 0.765 17890 4115 1 6 . 1 1 29 29 ARG H H 29 7.756 7.756 8.207 -0.451 17890 4116 1 6 . 1 1 30 30 VAL N N 30 118.412 118.412 117.576 0.836 17890 4117 1 6 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.798 0.146 17890 4118 1 6 . 1 1 30 30 VAL C C 30 176.199 176.199 175.961 0.238 17890 4119 1 6 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.808 -1.231 17890 4120 1 6 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.393 -2.171 17890 4121 1 6 . 1 1 30 30 VAL H H 30 8.976 8.976 7.759 1.217 17890 4122 1 6 . 1 1 31 31 LEU N N 31 125.418 125.418 116.125 9.293 17890 4123 1 6 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.044 0.441 17890 4124 1 6 . 1 1 31 31 LEU C C 31 179.123 179.123 176.060 3.063 17890 4125 1 6 . 1 1 31 31 LEU CA C 31 54.025 54.025 56.016 -1.991 17890 4126 1 6 . 1 1 31 31 LEU CB C 31 45.581 45.581 42.034 3.547 17890 4127 1 6 . 1 1 31 31 LEU H H 31 8.856 8.856 7.656 1.200 17890 4128 1 6 . 1 1 32 32 SER N N 32 116.890 116.890 115.598 1.292 17890 4129 1 6 . 1 1 32 32 SER HA H 32 5.365 5.365 4.829 0.536 17890 4130 1 6 . 1 1 32 32 SER CA C 32 57.269 57.269 56.850 0.419 17890 4131 1 6 . 1 1 32 32 SER CB C 32 62.213 62.213 64.325 -2.112 17890 4132 1 6 . 1 1 32 32 SER H H 32 9.307 9.307 8.599 0.708 17890 4133 1 6 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.451 -0.571 17890 4134 1 6 . 1 1 33 33 PRO C C 33 175.137 175.137 177.617 -2.480 17890 4135 1 6 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.919 0.366 17890 4136 1 6 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.532 0.499 17890 4137 1 6 . 1 1 34 34 ARG N N 34 110.279 110.279 119.035 -8.756 17890 4138 1 6 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.237 0.255 17890 4139 1 6 . 1 1 34 34 ARG C C 34 176.844 176.844 176.805 0.039 17890 4140 1 6 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.779 -1.343 17890 4141 1 6 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.116 0.468 17890 4142 1 6 . 1 1 34 34 ARG H H 34 7.257 7.257 7.929 -0.672 17890 4143 1 6 . 1 1 35 35 GLY N N 35 110.288 110.288 106.301 3.987 17890 4144 1 6 . 1 1 35 35 GLY C C 35 173.336 173.336 174.086 -0.750 17890 4145 1 6 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.775 2.255 17890 4146 1 6 . 1 1 35 35 GLY H H 35 8.589 8.589 7.607 0.982 17890 4147 1 6 . 1 1 36 36 GLU N N 36 116.838 116.838 118.881 -2.043 17890 4148 1 6 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.660 -0.312 17890 4149 1 6 . 1 1 36 36 GLU C C 36 176.915 176.915 175.615 1.300 17890 4150 1 6 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.848 1.059 17890 4151 1 6 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.564 -3.149 17890 4152 1 6 . 1 1 36 36 GLU H H 36 7.769 7.769 8.242 -0.473 17890 4153 1 6 . 1 1 37 37 LYS N N 37 123.775 123.775 120.352 3.423 17890 4154 1 6 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.106 0.317 17890 4155 1 6 . 1 1 37 37 LYS C C 37 176.067 176.067 175.608 0.459 17890 4156 1 6 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.706 -0.805 17890 4157 1 6 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.723 0.951 17890 4158 1 6 . 1 1 37 37 LYS H H 37 8.667 8.667 8.601 0.066 17890 4159 1 6 . 1 1 38 38 LEU N N 38 126.658 126.658 125.738 0.920 17890 4160 1 6 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.951 -0.724 17890 4161 1 6 . 1 1 38 38 LEU C C 38 174.332 174.332 175.000 -0.668 17890 4162 1 6 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.610 -0.267 17890 4163 1 6 . 1 1 38 38 LEU CB C 38 41.651 41.651 43.062 -1.411 17890 4164 1 6 . 1 1 38 38 LEU H H 38 10.455 10.455 8.919 1.536 17890 4165 1 6 . 1 1 39 39 ALA N N 39 127.018 127.018 126.618 0.400 17890 4166 1 6 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.327 -0.098 17890 4167 1 6 . 1 1 39 39 ALA C C 39 178.694 178.694 176.179 2.515 17890 4168 1 6 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.166 0.059 17890 4169 1 6 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.806 0.543 17890 4170 1 6 . 1 1 39 39 ALA H H 39 8.773 8.773 8.493 0.280 17890 4171 1 6 . 1 1 40 40 LEU N N 40 126.771 126.771 123.550 3.221 17890 4172 1 6 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.575 -0.221 17890 4173 1 6 . 1 1 40 40 LEU C C 40 178.309 178.309 176.634 1.675 17890 4174 1 6 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.055 0.790 17890 4175 1 6 . 1 1 40 40 LEU CB C 40 43.323 43.323 43.029 0.294 17890 4176 1 6 . 1 1 40 40 LEU H H 40 9.665 9.665 8.736 0.929 17890 4177 1 6 . 1 1 41 41 THR N N 41 126.578 126.578 124.600 1.978 17890 4178 1 6 . 1 1 41 41 THR HA H 41 4.916 4.916 5.155 -0.239 17890 4179 1 6 . 1 1 41 41 THR C C 41 172.547 172.547 173.498 -0.951 17890 4180 1 6 . 1 1 41 41 THR CA C 41 63.253 63.253 61.408 1.845 17890 4181 1 6 . 1 1 41 41 THR CB C 41 71.832 71.832 70.393 1.439 17890 4182 1 6 . 1 1 41 41 THR H H 41 9.802 9.802 9.097 0.705 17890 4183 1 6 . 1 1 42 42 TYR N N 42 130.506 130.506 129.891 0.615 17890 4184 1 6 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.566 0.536 17890 4185 1 6 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.937 -3.951 17890 4186 1 6 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.465 -0.310 17890 4187 1 6 . 1 1 42 42 TYR H H 42 9.428 9.428 8.867 0.561 17890 4188 1 6 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.412 0.078 17890 4189 1 6 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.058 0.515 17890 4190 1 6 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.623 0.021 17890 4191 1 6 . 1 1 44 44 GLY N N 44 113.736 113.736 106.611 7.125 17890 4192 1 6 . 1 1 44 44 GLY C C 44 171.790 171.790 173.456 -1.666 17890 4193 1 6 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.174 0.542 17890 4194 1 6 . 1 1 44 44 GLY H H 44 8.337 8.337 7.938 0.399 17890 4195 1 6 . 1 1 45 45 ARG N N 45 113.899 113.899 116.319 -2.420 17890 4196 1 6 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.552 0.024 17890 4197 1 6 . 1 1 45 45 ARG C C 45 175.151 175.151 173.546 1.605 17890 4198 1 6 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.129 0.036 17890 4199 1 6 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.536 1.683 17890 4200 1 6 . 1 1 45 45 ARG H H 45 6.463 6.463 7.434 -0.971 17890 4201 1 6 . 1 1 46 46 GLN N N 46 119.000 119.000 117.739 1.261 17890 4202 1 6 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.534 -0.085 17890 4203 1 6 . 1 1 46 46 GLN C C 46 177.282 177.282 176.247 1.035 17890 4204 1 6 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.278 1.335 17890 4205 1 6 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.753 0.743 17890 4206 1 6 . 1 1 46 46 GLN H H 46 8.683 8.683 8.525 0.158 17890 4207 1 6 . 1 1 47 47 ARG N N 47 113.526 113.526 119.747 -6.221 17890 4208 1 6 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.054 -0.524 17890 4209 1 6 . 1 1 47 47 ARG C C 47 174.130 174.130 174.890 -0.760 17890 4210 1 6 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.099 1.716 17890 4211 1 6 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.391 0.679 17890 4212 1 6 . 1 1 47 47 ARG H H 47 9.677 9.677 8.573 1.104 17890 4213 1 6 . 1 1 48 48 THR N N 48 114.672 114.672 114.886 -0.214 17890 4214 1 6 . 1 1 48 48 THR HA H 48 4.938 4.938 4.712 0.226 17890 4215 1 6 . 1 1 48 48 THR CA C 48 59.987 59.987 59.731 0.256 17890 4216 1 6 . 1 1 48 48 THR CB C 48 71.947 71.947 70.592 1.355 17890 4217 1 6 . 1 1 48 48 THR H H 48 8.104 8.104 7.585 0.519 17890 4218 1 6 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.546 -0.178 17890 4219 1 6 . 1 1 49 49 PRO C C 49 175.651 175.651 176.259 -0.608 17890 4220 1 6 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.253 0.928 17890 4221 1 6 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.259 0.438 17890 4222 1 6 . 1 1 50 50 VAL N N 50 122.562 122.562 118.646 3.916 17890 4223 1 6 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.304 -0.357 17890 4224 1 6 . 1 1 50 50 VAL C C 50 174.493 174.493 175.580 -1.087 17890 4225 1 6 . 1 1 50 50 VAL CA C 50 63.811 63.811 60.765 3.046 17890 4226 1 6 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.699 -2.531 17890 4227 1 6 . 1 1 50 50 VAL H H 50 8.123 8.123 7.853 0.270 17890 4228 1 6 . 1 1 51 51 THR N N 51 113.549 113.549 117.866 -4.317 17890 4229 1 6 . 1 1 51 51 THR HA H 51 5.372 5.372 4.867 0.505 17890 4230 1 6 . 1 1 51 51 THR C C 51 174.841 174.841 172.523 2.318 17890 4231 1 6 . 1 1 51 51 THR CA C 51 59.196 59.196 60.882 -1.686 17890 4232 1 6 . 1 1 51 51 THR CB C 51 72.703 72.703 72.143 0.560 17890 4233 1 6 . 1 1 51 51 THR H H 51 7.057 7.057 8.165 -1.108 17890 4234 1 6 . 1 1 52 52 VAL N N 52 107.374 107.374 120.261 -12.887 17890 4235 1 6 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.133 0.381 17890 4236 1 6 . 1 1 52 52 VAL C C 52 175.697 175.697 174.032 1.665 17890 4237 1 6 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.569 -1.097 17890 4238 1 6 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.539 -0.765 17890 4239 1 6 . 1 1 52 52 VAL H H 52 8.062 8.062 8.550 -0.488 17890 4240 1 6 . 1 1 53 53 SER N N 53 114.662 114.662 121.290 -6.628 17890 4241 1 6 . 1 1 53 53 SER HA H 53 4.690 4.690 4.933 -0.243 17890 4242 1 6 . 1 1 53 53 SER CA C 53 56.828 56.828 56.518 0.310 17890 4243 1 6 . 1 1 53 53 SER CB C 53 64.789 64.789 65.975 -1.186 17890 4244 1 6 . 1 1 53 53 SER H H 53 8.681 8.681 8.924 -0.243 17890 4245 1 6 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.538 0.238 17890 4246 1 6 . 1 1 54 54 PRO C C 54 177.724 177.724 176.733 0.991 17890 4247 1 6 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.977 0.448 17890 4248 1 6 . 1 1 54 54 PRO CB C 54 32.097 32.097 31.910 0.187 17890 4249 1 6 . 1 1 55 55 LEU N N 55 128.655 128.655 125.637 3.018 17890 4250 1 6 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.301 0.226 17890 4251 1 6 . 1 1 55 55 LEU C C 55 178.696 178.696 176.987 1.709 17890 4252 1 6 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.033 0.213 17890 4253 1 6 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.637 0.969 17890 4254 1 6 . 1 1 55 55 LEU H H 55 8.675 8.675 8.302 0.373 17890 4255 1 6 . 1 1 56 56 ASP N N 56 126.651 126.651 125.311 1.340 17890 4256 1 6 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.723 -0.014 17890 4257 1 6 . 1 1 56 56 ASP C C 56 177.729 177.729 176.481 1.248 17890 4258 1 6 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.749 -0.126 17890 4259 1 6 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.912 -0.280 17890 4260 1 6 . 1 1 56 56 ASP H H 56 9.683 9.683 8.565 1.118 17890 4261 1 6 . 1 1 57 57 GLY N N 57 109.299 109.299 108.532 0.767 17890 4262 1 6 . 1 1 57 57 GLY C C 57 174.558 174.558 174.307 0.251 17890 4263 1 6 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.730 0.225 17890 4264 1 6 . 1 1 57 57 GLY H H 57 8.157 8.157 8.429 -0.272 17890 4265 1 6 . 1 1 58 58 SER N N 58 116.740 116.740 115.480 1.260 17890 4266 1 6 . 1 1 58 58 SER HA H 58 4.288 4.288 4.445 -0.157 17890 4267 1 6 . 1 1 58 58 SER C C 58 177.252 177.252 175.992 1.260 17890 4268 1 6 . 1 1 58 58 SER CA C 58 58.737 58.737 57.282 1.454 17890 4269 1 6 . 1 1 58 58 SER CB C 58 64.576 64.576 64.353 0.223 17890 4270 1 6 . 1 1 58 58 SER H H 58 8.328 8.328 7.754 0.574 17890 4271 1 6 . 1 1 59 59 SER N N 59 119.768 119.768 117.512 2.256 17890 4272 1 6 . 1 1 59 59 SER HA H 59 4.046 4.046 4.076 -0.030 17890 4273 1 6 . 1 1 59 59 SER C C 59 176.671 176.671 175.846 0.825 17890 4274 1 6 . 1 1 59 59 SER CA C 59 61.691 61.691 60.344 1.347 17890 4275 1 6 . 1 1 59 59 SER CB C 59 63.154 63.154 62.836 0.318 17890 4276 1 6 . 1 1 59 59 SER H H 59 9.020 9.020 8.812 0.208 17890 4277 1 6 . 1 1 60 60 GLU N N 60 119.133 119.133 119.565 -0.432 17890 4278 1 6 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.012 0.174 17890 4279 1 6 . 1 1 60 60 GLU C C 60 177.435 177.435 177.833 -0.398 17890 4280 1 6 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.174 1.859 17890 4281 1 6 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.454 -1.228 17890 4282 1 6 . 1 1 60 60 GLU H H 60 8.832 8.832 8.496 0.336 17890 4283 1 6 . 1 1 61 61 GLN N N 61 118.818 118.818 115.834 2.984 17890 4284 1 6 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.103 0.074 17890 4285 1 6 . 1 1 61 61 GLN C C 61 173.254 173.254 175.219 -1.965 17890 4286 1 6 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.837 -0.464 17890 4287 1 6 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.633 -2.711 17890 4288 1 6 . 1 1 61 61 GLN H H 61 7.648 7.648 7.682 -0.034 17890 4289 1 6 . 1 1 62 62 ALA N N 62 122.562 122.562 122.568 -0.006 17890 4290 1 6 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.580 0.484 17890 4291 1 6 . 1 1 62 62 ALA C C 62 176.637 176.637 175.290 1.347 17890 4292 1 6 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.147 0.032 17890 4293 1 6 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.003 -0.408 17890 4294 1 6 . 1 1 62 62 ALA H H 62 7.315 7.315 7.041 0.274 17890 4295 1 6 . 1 1 63 63 TRP N N 63 124.787 124.787 119.781 5.006 17890 4296 1 6 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.260 -0.296 17890 4297 1 6 . 1 1 63 63 TRP C C 63 174.351 174.351 175.260 -0.909 17890 4298 1 6 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.187 -0.285 17890 4299 1 6 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.751 -1.634 17890 4300 1 6 . 1 1 63 63 TRP H H 63 9.544 9.544 9.087 0.457 17890 4301 1 6 . 1 1 64 64 ILE N N 64 122.482 122.482 119.278 3.204 17890 4302 1 6 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.964 -0.270 17890 4303 1 6 . 1 1 64 64 ILE C C 64 177.078 177.078 174.355 2.723 17890 4304 1 6 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.573 0.458 17890 4305 1 6 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.138 -0.769 17890 4306 1 6 . 1 1 64 64 ILE H H 64 10.235 10.235 9.455 0.780 17890 4307 1 6 . 1 1 65 65 LEU N N 65 132.183 132.183 128.631 3.552 17890 4308 1 6 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.491 -0.026 17890 4309 1 6 . 1 1 65 65 LEU C C 65 177.048 177.048 174.479 2.569 17890 4310 1 6 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.752 0.597 17890 4311 1 6 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.243 -3.899 17890 4312 1 6 . 1 1 65 65 LEU H H 65 9.432 9.432 9.284 0.148 17890 4313 1 6 . 1 1 66 66 ARG N N 66 120.807 120.807 125.622 -4.815 17890 4314 1 6 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.931 -0.043 17890 4315 1 6 . 1 1 66 66 ARG C C 66 175.275 175.275 174.428 0.847 17890 4316 1 6 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.527 0.528 17890 4317 1 6 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.410 -1.419 17890 4318 1 6 . 1 1 66 66 ARG H H 66 8.491 8.491 8.590 -0.099 17890 4319 1 6 . 1 1 67 67 SER N N 67 119.709 119.709 116.642 3.067 17890 4320 1 6 . 1 1 67 67 SER HA H 67 3.186 3.186 3.437 -0.251 17890 4321 1 6 . 1 1 67 67 SER C C 67 174.508 174.508 173.427 1.081 17890 4322 1 6 . 1 1 67 67 SER CA C 67 58.521 58.521 59.013 -0.492 17890 4323 1 6 . 1 1 67 67 SER CB C 67 62.590 62.590 63.425 -0.835 17890 4324 1 6 . 1 1 67 67 SER H H 67 8.557 8.557 8.693 -0.136 17890 4325 1 6 . 1 1 68 68 TYR N N 68 131.011 131.011 127.463 3.548 17890 4326 1 6 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.522 -0.074 17890 4327 1 6 . 1 1 68 68 TYR C C 68 174.687 174.687 174.989 -0.302 17890 4328 1 6 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.678 0.087 17890 4329 1 6 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.044 -2.056 17890 4330 1 6 . 1 1 68 68 TYR H H 68 8.531 8.531 8.467 0.064 17890 4331 1 6 . 1 1 69 69 ASP N N 69 117.066 117.066 119.833 -2.767 17890 4332 1 6 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.855 -0.230 17890 4333 1 6 . 1 1 69 69 ASP C C 69 176.455 176.455 176.297 0.158 17890 4334 1 6 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.959 -0.868 17890 4335 1 6 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.978 -0.831 17890 4336 1 6 . 1 1 69 69 ASP H H 69 7.122 7.122 7.613 -0.491 17890 4337 1 6 . 1 1 70 70 SER N N 70 122.869 122.869 120.029 2.840 17890 4338 1 6 . 1 1 70 70 SER HA H 70 4.270 4.270 4.045 0.225 17890 4339 1 6 . 1 1 70 70 SER C C 70 177.010 177.010 176.159 0.851 17890 4340 1 6 . 1 1 70 70 SER CA C 70 60.837 60.837 61.447 -0.610 17890 4341 1 6 . 1 1 70 70 SER CB C 70 62.722 62.722 63.227 -0.505 17890 4342 1 6 . 1 1 70 70 SER H H 70 8.757 8.757 8.823 -0.066 17890 4343 1 6 . 1 1 71 71 ASN N N 71 119.873 119.873 119.264 0.609 17890 4344 1 6 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.580 -0.009 17890 4345 1 6 . 1 1 71 71 ASN C C 71 176.226 176.226 176.013 0.213 17890 4346 1 6 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.330 0.385 17890 4347 1 6 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.356 0.285 17890 4348 1 6 . 1 1 71 71 ASN H H 71 8.342 8.342 8.532 -0.190 17890 4349 1 6 . 1 1 72 72 SER N N 72 112.202 112.202 112.633 -0.431 17890 4350 1 6 . 1 1 72 72 SER HA H 72 4.567 4.567 4.691 -0.124 17890 4351 1 6 . 1 1 72 72 SER C C 72 173.789 173.789 173.629 0.160 17890 4352 1 6 . 1 1 72 72 SER CA C 72 57.816 57.816 57.289 0.527 17890 4353 1 6 . 1 1 72 72 SER CB C 72 63.935 63.935 63.762 0.173 17890 4354 1 6 . 1 1 72 72 SER H H 72 7.560 7.560 7.796 -0.236 17890 4355 1 6 . 1 1 73 73 ASN N N 73 117.437 117.437 119.097 -1.660 17890 4356 1 6 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.402 0.132 17890 4357 1 6 . 1 1 73 73 ASN C C 73 173.647 173.647 174.262 -0.615 17890 4358 1 6 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.487 0.036 17890 4359 1 6 . 1 1 73 73 ASN CB C 73 37.213 37.213 36.886 0.327 17890 4360 1 6 . 1 1 73 73 ASN H H 73 7.940 7.940 7.956 -0.016 17890 4361 1 6 . 1 1 74 74 THR N N 74 104.227 104.227 109.574 -5.347 17890 4362 1 6 . 1 1 74 74 THR HA H 74 5.477 5.477 4.926 0.551 17890 4363 1 6 . 1 1 74 74 THR C C 74 176.824 176.824 173.936 2.888 17890 4364 1 6 . 1 1 74 74 THR CA C 74 59.768 59.768 61.694 -1.926 17890 4365 1 6 . 1 1 74 74 THR CB C 74 71.985 71.985 69.996 1.989 17890 4366 1 6 . 1 1 74 74 THR H H 74 7.737 7.737 7.753 -0.016 17890 4367 1 6 . 1 1 75 75 TRP N N 75 124.636 124.636 123.153 1.483 17890 4368 1 6 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.404 -0.197 17890 4369 1 6 . 1 1 75 75 TRP C C 75 175.876 175.876 176.153 -0.277 17890 4370 1 6 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.267 1.339 17890 4371 1 6 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.808 -0.292 17890 4372 1 6 . 1 1 75 75 TRP H H 75 9.442 9.442 9.074 0.368 17890 4373 1 6 . 1 1 76 76 THR N N 76 110.544 110.544 114.478 -3.934 17890 4374 1 6 . 1 1 76 76 THR HA H 76 5.129 5.129 5.042 0.087 17890 4375 1 6 . 1 1 76 76 THR C C 76 174.506 174.506 174.450 0.056 17890 4376 1 6 . 1 1 76 76 THR CA C 76 60.561 60.561 61.296 -0.735 17890 4377 1 6 . 1 1 76 76 THR CB C 76 71.688 71.688 70.195 1.493 17890 4378 1 6 . 1 1 76 76 THR H H 76 9.415 9.415 9.399 0.016 17890 4379 1 6 . 1 1 77 77 ILE N N 77 121.567 121.567 123.833 -2.266 17890 4380 1 6 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.208 -0.069 17890 4381 1 6 . 1 1 77 77 ILE C C 77 176.148 176.148 174.920 1.228 17890 4382 1 6 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.938 1.770 17890 4383 1 6 . 1 1 77 77 ILE CB C 77 40.987 40.987 40.035 0.952 17890 4384 1 6 . 1 1 77 77 ILE H H 77 9.255 9.255 8.682 0.573 17890 4385 1 6 . 1 1 78 78 SER N N 78 122.269 122.269 121.361 0.908 17890 4386 1 6 . 1 1 78 78 SER HA H 78 5.601 5.601 5.264 0.337 17890 4387 1 6 . 1 1 78 78 SER CA C 78 55.835 55.835 56.109 -0.274 17890 4388 1 6 . 1 1 78 78 SER CB C 78 65.858 65.858 66.583 -0.725 17890 4389 1 6 . 1 1 78 78 SER H H 78 9.226 9.226 8.649 0.577 17890 4390 1 6 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.363 -0.499 17890 4391 1 6 . 1 1 79 79 PRO C C 79 178.175 178.175 177.346 0.829 17890 4392 1 6 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.131 0.753 17890 4393 1 6 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.166 -1.894 17890 4394 1 6 . 1 1 80 80 VAL N N 80 121.906 121.906 116.438 5.468 17890 4395 1 6 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.880 -0.299 17890 4396 1 6 . 1 1 80 80 VAL C C 80 177.751 177.751 176.790 0.961 17890 4397 1 6 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.519 1.548 17890 4398 1 6 . 1 1 80 80 VAL CB C 80 31.485 31.485 30.929 0.556 17890 4399 1 6 . 1 1 80 80 VAL H H 80 7.328 7.328 7.772 -0.444 17890 4400 1 6 . 1 1 81 81 GLY N N 81 104.643 104.643 108.276 -3.633 17890 4401 1 6 . 1 1 81 81 GLY C C 81 174.979 174.979 174.564 0.415 17890 4402 1 6 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.246 -0.158 17890 4403 1 6 . 1 1 81 81 GLY H H 81 8.949 8.949 8.360 0.589 17890 4404 1 6 . 1 1 82 82 SER N N 82 111.865 111.865 116.265 -4.400 17890 4405 1 6 . 1 1 82 82 SER HA H 82 4.646 4.646 4.807 -0.161 17890 4406 1 6 . 1 1 82 82 SER CA C 82 55.441 55.441 55.052 0.389 17890 4407 1 6 . 1 1 82 82 SER CB C 82 62.277 62.277 63.724 -1.447 17890 4408 1 6 . 1 1 82 82 SER H H 82 6.968 6.968 7.285 -0.317 17890 4409 1 6 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.495 -0.148 17890 4410 1 6 . 1 1 83 83 PRO C C 83 176.660 176.660 176.640 0.020 17890 4411 1 6 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.491 0.712 17890 4412 1 6 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.806 1.013 17890 4413 1 6 . 1 1 84 84 ASN N N 84 116.542 116.542 114.281 2.261 17890 4414 1 6 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.626 0.375 17890 4415 1 6 . 1 1 84 84 ASN C C 84 175.825 175.825 174.822 1.003 17890 4416 1 6 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.579 -0.688 17890 4417 1 6 . 1 1 84 84 ASN CB C 84 38.744 38.744 37.777 0.967 17890 4418 1 6 . 1 1 84 84 ASN H H 84 8.502 8.502 8.383 0.119 17890 4419 1 6 . 1 1 85 85 SER N N 85 114.633 114.633 112.603 2.030 17890 4420 1 6 . 1 1 85 85 SER HA H 85 4.624 4.624 5.000 -0.376 17890 4421 1 6 . 1 1 85 85 SER C C 85 172.963 172.963 172.543 0.420 17890 4422 1 6 . 1 1 85 85 SER CA C 85 59.210 59.210 57.148 2.062 17890 4423 1 6 . 1 1 85 85 SER CB C 85 64.697 64.697 66.439 -1.742 17890 4424 1 6 . 1 1 85 85 SER H H 85 7.980 7.980 7.788 0.192 17890 4425 1 6 . 1 1 86 86 GLN N N 86 119.016 119.016 118.663 0.353 17890 4426 1 6 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.389 0.057 17890 4427 1 6 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.907 -0.455 17890 4428 1 6 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.001 0.397 17890 4429 1 6 . 1 1 86 86 GLN H H 86 9.399 9.399 9.186 0.213 17890 4430 1 6 . 1 1 87 87 ILE N N 87 119.691 119.691 120.803 -1.112 17890 4431 1 6 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.173 -0.598 17890 4432 1 6 . 1 1 87 87 ILE C C 87 176.505 176.505 175.952 0.553 17890 4433 1 6 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.808 4.686 17890 4434 1 6 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.711 -0.514 17890 4435 1 6 . 1 1 87 87 ILE H H 87 8.970 8.970 8.489 0.481 17890 4436 1 6 . 1 1 88 88 GLY N N 88 118.378 118.378 114.978 3.400 17890 4437 1 6 . 1 1 88 88 GLY C C 88 171.397 171.397 171.659 -0.262 17890 4438 1 6 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.873 -1.269 17890 4439 1 6 . 1 1 88 88 GLY H H 88 9.752 9.752 9.036 0.716 17890 4440 1 6 . 1 1 89 89 TRP N N 89 122.749 122.749 121.710 1.039 17890 4441 1 6 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.360 -0.762 17890 4442 1 6 . 1 1 89 89 TRP C C 89 175.924 175.924 174.700 1.224 17890 4443 1 6 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.133 0.150 17890 4444 1 6 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.541 -2.455 17890 4445 1 6 . 1 1 89 89 TRP H H 89 8.215 8.215 8.146 0.069 17890 4446 1 6 . 1 1 90 90 GLY N N 90 116.305 116.305 110.119 6.186 17890 4447 1 6 . 1 1 90 90 GLY C C 90 173.725 173.725 172.365 1.360 17890 4448 1 6 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.595 0.460 17890 4449 1 6 . 1 1 90 90 GLY H H 90 8.922 8.922 8.137 0.785 17890 4450 1 6 . 1 1 91 91 ALA N N 91 123.795 123.795 122.161 1.634 17890 4451 1 6 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.163 0.080 17890 4452 1 6 . 1 1 91 91 ALA C C 91 178.510 178.510 178.923 -0.413 17890 4453 1 6 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.420 0.070 17890 4454 1 6 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.798 -0.389 17890 4455 1 6 . 1 1 91 91 ALA H H 91 8.367 8.367 8.127 0.240 17890 4456 1 6 . 1 1 92 92 GLY N N 92 108.871 108.871 112.333 -3.462 17890 4457 1 6 . 1 1 92 92 GLY C C 92 174.528 174.528 174.884 -0.356 17890 4458 1 6 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.794 0.464 17890 4459 1 6 . 1 1 92 92 GLY H H 92 8.776 8.776 8.623 0.153 17890 4460 1 6 . 1 1 93 93 ASN N N 93 114.921 114.921 117.478 -2.557 17890 4461 1 6 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.768 -0.319 17890 4462 1 6 . 1 1 93 93 ASN C C 93 172.774 172.774 173.779 -1.005 17890 4463 1 6 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.239 0.734 17890 4464 1 6 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.210 -0.881 17890 4465 1 6 . 1 1 93 93 ASN H H 93 8.647 8.647 8.304 0.343 17890 4466 1 6 . 1 1 94 94 VAL N N 94 112.437 112.437 118.995 -6.558 17890 4467 1 6 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.639 0.426 17890 4468 1 6 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.072 -1.157 17890 4469 1 6 . 1 1 94 94 VAL CB C 94 34.155 34.155 36.031 -1.875 17890 4470 1 6 . 1 1 94 94 VAL H H 94 6.989 6.989 7.563 -0.574 17890 4471 1 6 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.922 0.006 17890 4472 1 6 . 1 1 95 95 PRO C C 95 176.041 176.041 175.522 0.519 17890 4473 1 6 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.608 -1.407 17890 4474 1 6 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.745 -1.020 17890 4475 1 6 . 1 1 96 96 VAL N N 96 113.564 113.564 115.950 -2.386 17890 4476 1 6 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.946 -0.211 17890 4477 1 6 . 1 1 96 96 VAL C C 96 173.656 173.656 175.066 -1.410 17890 4478 1 6 . 1 1 96 96 VAL CA C 96 58.853 58.853 58.972 -0.119 17890 4479 1 6 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.265 1.888 17890 4480 1 6 . 1 1 96 96 VAL H H 96 8.199 8.199 8.834 -0.634 17890 4481 1 6 . 1 1 97 97 VAL N N 97 122.328 122.328 123.167 -0.839 17890 4482 1 6 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.700 -0.069 17890 4483 1 6 . 1 1 97 97 VAL C C 97 174.776 174.776 175.790 -1.014 17890 4484 1 6 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.164 0.493 17890 4485 1 6 . 1 1 97 97 VAL CB C 97 31.128 31.128 32.022 -0.894 17890 4486 1 6 . 1 1 97 97 VAL H H 97 8.957 8.957 8.289 0.668 17890 4487 1 6 . 1 1 98 98 LEU N N 98 130.258 130.258 125.605 4.653 17890 4488 1 6 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.962 0.088 17890 4489 1 6 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.696 1.127 17890 4490 1 6 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.304 0.814 17890 4491 1 6 . 1 1 98 98 LEU H H 98 9.245 9.245 9.169 0.076 17890 4492 1 6 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.866 -0.087 17890 4493 1 6 . 1 1 99 99 PRO CA C 99 61.489 61.489 60.781 0.708 17890 4494 1 6 . 1 1 99 99 PRO CB C 99 30.454 30.454 30.871 -0.417 17890 4495 1 6 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.525 -0.540 17890 4496 1 6 . 1 1 100 100 PRO C C 100 177.309 177.309 175.887 1.422 17890 4497 1 6 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.804 0.020 17890 4498 1 6 . 1 1 100 100 PRO CB C 100 32.105 32.105 31.804 0.301 17890 4499 1 6 . 1 1 101 101 ASN N N 101 119.284 119.284 124.223 -4.939 17890 4500 1 6 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.633 -0.091 17890 4501 1 6 . 1 1 101 101 ASN C C 101 171.920 171.920 173.796 -1.876 17890 4502 1 6 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.242 -0.042 17890 4503 1 6 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.736 -2.111 17890 4504 1 6 . 1 1 101 101 ASN H H 101 7.273 7.273 9.307 -2.034 17890 4505 1 6 . 1 1 102 102 ASN N N 102 115.674 115.674 117.786 -2.112 17890 4506 1 6 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.802 -0.884 17890 4507 1 6 . 1 1 102 102 ASN C C 102 173.264 173.264 173.784 -0.520 17890 4508 1 6 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.688 1.351 17890 4509 1 6 . 1 1 102 102 ASN CB C 102 36.982 36.982 40.040 -3.058 17890 4510 1 6 . 1 1 102 102 ASN H H 102 8.197 8.197 7.718 0.479 17890 4511 1 6 . 1 1 103 103 TYR N N 103 118.775 118.775 120.402 -1.627 17890 4512 1 6 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.301 0.184 17890 4513 1 6 . 1 1 103 103 TYR C C 103 175.248 175.248 175.099 0.149 17890 4514 1 6 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.200 -1.710 17890 4515 1 6 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.384 -0.852 17890 4516 1 6 . 1 1 103 103 TYR H H 103 7.745 7.745 7.239 0.506 17890 4517 1 6 . 1 1 104 104 VAL N N 104 116.205 116.205 114.079 2.126 17890 4518 1 6 . 1 1 104 104 VAL HA H 104 4.977 4.977 5.021 -0.044 17890 4519 1 6 . 1 1 104 104 VAL C C 104 174.361 174.361 173.650 0.711 17890 4520 1 6 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.569 -1.318 17890 4521 1 6 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.628 -0.085 17890 4522 1 6 . 1 1 104 104 VAL H H 104 7.498 7.498 7.965 -0.467 17890 4523 1 6 . 1 1 105 105 TRP N N 105 119.557 119.557 119.558 -0.001 17890 4524 1 6 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.181 -0.306 17890 4525 1 6 . 1 1 105 105 TRP C C 105 175.526 175.526 176.407 -0.881 17890 4526 1 6 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.303 -0.419 17890 4527 1 6 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.368 0.171 17890 4528 1 6 . 1 1 105 105 TRP H H 105 8.926 8.926 9.011 -0.085 17890 4529 1 6 . 1 1 106 106 THR N N 106 120.480 120.480 120.437 0.043 17890 4530 1 6 . 1 1 106 106 THR HA H 106 4.966 4.966 4.774 0.192 17890 4531 1 6 . 1 1 106 106 THR C C 106 174.177 174.177 174.201 -0.024 17890 4532 1 6 . 1 1 106 106 THR CA C 106 62.091 62.091 64.515 -2.424 17890 4533 1 6 . 1 1 106 106 THR CB C 106 69.649 69.649 68.859 0.790 17890 4534 1 6 . 1 1 106 106 THR H H 106 9.525 9.525 9.158 0.367 17890 4535 1 6 . 1 1 107 107 LEU N N 107 127.146 127.146 130.382 -3.236 17890 4536 1 6 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.323 -0.496 17890 4537 1 6 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.664 0.045 17890 4538 1 6 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.779 -2.256 17890 4539 1 6 . 1 1 107 107 LEU H H 107 7.591 7.591 9.000 -1.409 17890 4540 1 6 . 1 1 108 108 THR N N 108 119.928 119.928 119.318 0.610 17890 4541 1 6 . 1 1 108 108 THR HA H 108 4.411 4.411 4.478 -0.067 17890 4542 1 6 . 1 1 108 108 THR C C 108 173.319 173.319 172.622 0.697 17890 4543 1 6 . 1 1 108 108 THR CA C 108 62.243 62.243 61.347 0.896 17890 4544 1 6 . 1 1 108 108 THR CB C 108 70.138 70.138 71.712 -1.574 17890 4545 1 6 . 1 1 108 108 THR H H 108 8.141 8.141 8.532 -0.391 17890 4546 1 6 . 1 1 109 109 LEU N N 109 130.557 130.557 127.872 2.685 17890 4547 1 6 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.537 0.008 17890 4548 1 6 . 1 1 109 109 LEU C C 109 175.217 175.217 176.093 -0.876 17890 4549 1 6 . 1 1 109 109 LEU CA C 109 55.286 55.286 54.923 0.363 17890 4550 1 6 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.860 -2.254 17890 4551 1 6 . 1 1 109 109 LEU H H 109 8.924 8.924 8.286 0.638 17890 4552 1 6 . 1 1 110 110 THR N N 110 120.160 120.160 116.626 3.534 17890 4553 1 6 . 1 1 110 110 THR HA H 110 4.911 4.911 4.621 0.290 17890 4554 1 6 . 1 1 110 110 THR CA C 110 60.141 60.141 60.753 -0.612 17890 4555 1 6 . 1 1 110 110 THR CB C 110 72.785 72.785 70.955 1.830 17890 4556 1 6 . 1 1 110 110 THR H H 110 7.677 7.677 8.612 -0.935 17890 4557 1 6 . 1 1 111 111 SER HA H 111 4.204 4.204 4.260 -0.056 17890 4558 1 6 . 1 1 111 111 SER C C 111 174.755 174.755 174.671 0.084 17890 4559 1 6 . 1 1 111 111 SER CA C 111 60.710 60.710 60.520 0.190 17890 4560 1 6 . 1 1 111 111 SER CB C 111 62.660 62.660 62.828 -0.168 17890 4561 1 6 . 1 1 112 112 GLY N N 112 107.313 107.313 107.127 0.186 17890 4562 1 6 . 1 1 112 112 GLY C C 112 173.023 173.023 172.669 0.354 17890 4563 1 6 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.314 -1.164 17890 4564 1 6 . 1 1 112 112 GLY H H 112 8.249 8.249 7.535 0.714 17890 4565 1 6 . 1 1 113 113 GLY N N 113 105.618 105.618 107.487 -1.869 17890 4566 1 6 . 1 1 113 113 GLY C C 113 175.844 175.844 171.624 4.220 17890 4567 1 6 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.931 -3.172 17890 4568 1 6 . 1 1 113 113 GLY H H 113 7.444 7.444 7.462 -0.018 17890 4569 1 6 . 1 1 114 114 TYR N N 114 121.548 121.548 119.345 2.203 17890 4570 1 6 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.266 -0.414 17890 4571 1 6 . 1 1 114 114 TYR C C 114 175.605 175.605 174.151 1.454 17890 4572 1 6 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.682 4.581 17890 4573 1 6 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.467 -4.534 17890 4574 1 6 . 1 1 114 114 TYR H H 114 9.677 9.677 8.907 0.770 17890 4575 1 6 . 1 1 115 115 ASN N N 115 123.274 123.274 117.655 5.619 17890 4576 1 6 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.160 -0.062 17890 4577 1 6 . 1 1 115 115 ASN C C 115 174.355 174.355 173.162 1.193 17890 4578 1 6 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.237 -1.191 17890 4579 1 6 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.642 -2.293 17890 4580 1 6 . 1 1 115 115 ASN H H 115 9.350 9.350 8.723 0.627 17890 4581 1 6 . 1 1 116 116 ILE N N 116 130.611 130.611 123.011 7.600 17890 4582 1 6 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.818 -0.579 17890 4583 1 6 . 1 1 116 116 ILE C C 116 173.998 173.998 173.942 0.056 17890 4584 1 6 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.192 2.007 17890 4585 1 6 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.548 -2.449 17890 4586 1 6 . 1 1 116 116 ILE H H 116 9.473 9.473 8.689 0.784 17890 4587 1 6 . 1 1 117 117 GLN N N 117 121.633 121.633 125.115 -3.482 17890 4588 1 6 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.026 0.909 17890 4589 1 6 . 1 1 117 117 GLN C C 117 177.902 177.902 175.934 1.968 17890 4590 1 6 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.814 -0.494 17890 4591 1 6 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.445 4.012 17890 4592 1 6 . 1 1 117 117 GLN H H 117 8.781 8.781 8.789 -0.008 17890 4593 1 6 . 1 1 118 118 ASP N N 118 116.836 116.836 119.724 -2.888 17890 4594 1 6 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.870 0.913 17890 4595 1 6 . 1 1 118 118 ASP C C 118 178.084 178.084 176.627 1.457 17890 4596 1 6 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.207 -1.437 17890 4597 1 6 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.243 -0.875 17890 4598 1 6 . 1 1 118 118 ASP H H 118 9.330 9.330 8.650 0.680 17890 4599 1 6 . 1 1 119 119 GLY N N 119 111.037 111.037 107.604 3.433 17890 4600 1 6 . 1 1 119 119 GLY C C 119 174.196 174.196 175.325 -1.129 17890 4601 1 6 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.078 1.898 17890 4602 1 6 . 1 1 119 119 GLY H H 119 8.986 8.986 8.355 0.631 17890 4603 1 6 . 1 1 120 120 LYS N N 120 114.809 114.809 121.815 -7.006 17890 4604 1 6 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.617 -0.268 17890 4605 1 6 . 1 1 120 120 LYS C C 120 175.174 175.174 176.429 -1.255 17890 4606 1 6 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.413 1.520 17890 4607 1 6 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.410 0.066 17890 4608 1 6 . 1 1 120 120 LYS H H 120 7.045 7.045 8.685 -1.640 17890 4609 1 6 . 1 1 121 121 ARG N N 121 116.291 116.291 114.193 2.098 17890 4610 1 6 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.068 -0.482 17890 4611 1 6 . 1 1 121 121 ARG C C 121 175.097 175.097 177.410 -2.313 17890 4612 1 6 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.239 0.830 17890 4613 1 6 . 1 1 121 121 ARG CB C 121 26.623 26.623 27.297 -0.674 17890 4614 1 6 . 1 1 121 121 ARG H H 121 7.683 7.683 7.946 -0.263 17890 4615 1 6 . 1 1 122 122 THR N N 122 113.730 113.730 109.510 4.220 17890 4616 1 6 . 1 1 122 122 THR HA H 122 4.540 4.540 4.227 0.313 17890 4617 1 6 . 1 1 122 122 THR C C 122 175.302 175.302 174.533 0.769 17890 4618 1 6 . 1 1 122 122 THR CA C 122 62.871 62.871 64.029 -1.158 17890 4619 1 6 . 1 1 122 122 THR CB C 122 71.552 71.552 69.849 1.703 17890 4620 1 6 . 1 1 122 122 THR H H 122 11.059 11.059 8.032 3.027 17890 4621 1 6 . 1 1 123 123 VAL N N 123 118.350 118.350 115.246 3.104 17890 4622 1 6 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.644 0.166 17890 4623 1 6 . 1 1 123 123 VAL C C 123 174.730 174.730 173.648 1.082 17890 4624 1 6 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.978 0.333 17890 4625 1 6 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.879 2.203 17890 4626 1 6 . 1 1 123 123 VAL H H 123 8.181 8.181 7.606 0.575 17890 4627 1 6 . 1 1 124 124 SER N N 124 113.053 113.053 114.192 -1.139 17890 4628 1 6 . 1 1 124 124 SER HA H 124 5.820 5.820 5.237 0.583 17890 4629 1 6 . 1 1 124 124 SER C C 124 175.521 175.521 173.617 1.904 17890 4630 1 6 . 1 1 124 124 SER CA C 124 58.087 58.087 56.571 1.516 17890 4631 1 6 . 1 1 124 124 SER CB C 124 67.405 67.405 65.560 1.845 17890 4632 1 6 . 1 1 124 124 SER H H 124 9.138 9.138 8.645 0.493 17890 4633 1 6 . 1 1 125 125 TRP N N 125 124.900 124.900 124.472 0.428 17890 4634 1 6 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.944 0.666 17890 4635 1 6 . 1 1 125 125 TRP C C 125 178.114 178.114 177.451 0.663 17890 4636 1 6 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.447 -0.973 17890 4637 1 6 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.136 0.887 17890 4638 1 6 . 1 1 125 125 TRP H H 125 8.843 8.843 8.069 0.774 17890 4639 1 6 . 1 1 126 126 SER N N 126 119.243 119.243 113.932 5.311 17890 4640 1 6 . 1 1 126 126 SER HA H 126 5.443 5.443 5.386 0.057 17890 4641 1 6 . 1 1 126 126 SER C C 126 171.668 171.668 172.900 -1.232 17890 4642 1 6 . 1 1 126 126 SER CA C 126 58.696 58.696 57.297 1.399 17890 4643 1 6 . 1 1 126 126 SER CB C 126 66.176 66.176 66.143 0.033 17890 4644 1 6 . 1 1 126 126 SER H H 126 9.835 9.835 9.255 0.580 17890 4645 1 6 . 1 1 127 127 LEU N N 127 113.708 113.708 117.787 -4.079 17890 4646 1 6 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.677 0.478 17890 4647 1 6 . 1 1 127 127 LEU C C 127 176.563 176.563 176.496 0.067 17890 4648 1 6 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.450 -0.805 17890 4649 1 6 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.311 -1.615 17890 4650 1 6 . 1 1 127 127 LEU H H 127 6.559 6.559 8.340 -1.781 17890 4651 1 6 . 1 1 128 128 ASN N N 128 121.739 121.739 117.918 3.821 17890 4652 1 6 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.976 -0.287 17890 4653 1 6 . 1 1 128 128 ASN C C 128 175.452 175.452 175.284 0.168 17890 4654 1 6 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.724 1.284 17890 4655 1 6 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.721 -1.430 17890 4656 1 6 . 1 1 128 128 ASN H H 128 8.662 8.662 9.374 -0.712 17890 4657 1 6 . 1 1 129 129 ASN N N 129 119.586 119.586 116.481 3.105 17890 4658 1 6 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.856 0.141 17890 4659 1 6 . 1 1 129 129 ASN C C 129 175.900 175.900 174.779 1.121 17890 4660 1 6 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.439 0.794 17890 4661 1 6 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.162 0.094 17890 4662 1 6 . 1 1 129 129 ASN H H 129 10.962 10.962 8.818 2.144 17890 4663 1 6 . 1 1 130 130 ALA N N 130 128.292 128.292 122.393 5.899 17890 4664 1 6 . 1 1 130 130 ALA HA H 130 3.570 3.570 3.979 -0.409 17890 4665 1 6 . 1 1 130 130 ALA C C 130 172.620 172.620 176.425 -3.805 17890 4666 1 6 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.457 -0.818 17890 4667 1 6 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.064 -0.964 17890 4668 1 6 . 1 1 130 130 ALA H H 130 10.629 10.629 8.634 1.995 17890 4669 1 6 . 1 1 131 131 THR N N 131 105.584 105.584 110.113 -4.529 17890 4670 1 6 . 1 1 131 131 THR HA H 131 4.462 4.462 4.348 0.114 17890 4671 1 6 . 1 1 131 131 THR C C 131 173.552 173.552 174.233 -0.681 17890 4672 1 6 . 1 1 131 131 THR CA C 131 58.338 58.338 60.334 -1.996 17890 4673 1 6 . 1 1 131 131 THR CB C 131 71.569 71.569 70.313 1.256 17890 4674 1 6 . 1 1 131 131 THR H H 131 7.092 7.092 7.474 -0.382 17890 4675 1 6 . 1 1 132 132 ALA N N 132 121.773 121.773 123.833 -2.060 17890 4676 1 6 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.057 -0.308 17890 4677 1 6 . 1 1 132 132 ALA C C 132 178.819 178.819 178.421 0.398 17890 4678 1 6 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.118 1.166 17890 4679 1 6 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.356 -0.129 17890 4680 1 6 . 1 1 132 132 ALA H H 132 8.952 8.952 8.434 0.518 17890 4681 1 6 . 1 1 133 133 GLY N N 133 113.965 113.965 112.069 1.896 17890 4682 1 6 . 1 1 133 133 GLY C C 133 173.453 173.453 174.256 -0.803 17890 4683 1 6 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.895 0.271 17890 4684 1 6 . 1 1 133 133 GLY H H 133 9.016 9.016 8.633 0.383 17890 4685 1 6 . 1 1 134 134 GLU N N 134 123.460 123.460 121.294 2.166 17890 4686 1 6 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.295 -0.337 17890 4687 1 6 . 1 1 134 134 GLU C C 134 176.120 176.120 176.125 -0.005 17890 4688 1 6 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.175 1.224 17890 4689 1 6 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.891 0.494 17890 4690 1 6 . 1 1 134 134 GLU H H 134 7.598 7.598 7.602 -0.004 17890 4691 1 6 . 1 1 135 135 GLU N N 135 122.633 122.633 125.455 -2.822 17890 4692 1 6 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.211 0.100 17890 4693 1 6 . 1 1 135 135 GLU C C 135 176.014 176.014 176.478 -0.464 17890 4694 1 6 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.438 -0.256 17890 4695 1 6 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.191 -0.738 17890 4696 1 6 . 1 1 135 135 GLU H H 135 8.258 8.258 8.609 -0.351 17890 4697 1 6 . 1 1 136 136 VAL N N 136 123.635 123.635 126.607 -2.972 17890 4698 1 6 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.816 -0.124 17890 4699 1 6 . 1 1 136 136 VAL C C 136 173.932 173.932 174.922 -0.990 17890 4700 1 6 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.472 0.360 17890 4701 1 6 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.659 -0.795 17890 4702 1 6 . 1 1 136 136 VAL H H 136 7.267 7.267 7.840 -0.573 17890 4703 1 6 . 1 1 137 137 SER N N 137 118.950 118.950 121.145 -2.195 17890 4704 1 6 . 1 1 137 137 SER HA H 137 4.887 4.887 5.170 -0.283 17890 4705 1 6 . 1 1 137 137 SER C C 137 173.780 173.780 173.133 0.647 17890 4706 1 6 . 1 1 137 137 SER CA C 137 57.895 57.895 56.737 1.158 17890 4707 1 6 . 1 1 137 137 SER CB C 137 65.027 65.027 66.846 -1.819 17890 4708 1 6 . 1 1 137 137 SER H H 137 8.454 8.454 8.656 -0.202 17890 4709 1 6 . 1 1 138 138 ILE N N 138 123.511 123.511 119.698 3.813 17890 4710 1 6 . 1 1 138 138 ILE HA H 138 4.248 4.248 4.965 -0.717 17890 4711 1 6 . 1 1 138 138 ILE C C 138 176.142 176.142 175.623 0.519 17890 4712 1 6 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.454 1.396 17890 4713 1 6 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.739 -3.143 17890 4714 1 6 . 1 1 138 138 ILE H H 138 7.915 7.915 8.303 -0.388 17890 4715 1 6 . 1 1 139 139 GLY N N 139 115.638 115.638 110.740 4.898 17890 4716 1 6 . 1 1 139 139 GLY C C 139 171.947 171.947 173.218 -1.271 17890 4717 1 6 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.428 1.658 17890 4718 1 6 . 1 1 139 139 GLY H H 139 8.490 8.490 8.295 0.195 17890 4719 1 6 . 1 1 140 140 ALA N N 140 128.563 128.563 121.372 7.191 17890 4720 1 6 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.412 -0.016 17890 4721 1 6 . 1 1 140 140 ALA C C 140 177.956 177.956 177.248 0.708 17890 4722 1 6 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.492 -1.847 17890 4723 1 6 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.373 -0.169 17890 4724 1 6 . 1 1 140 140 ALA H H 140 8.531 8.531 8.354 0.177 17890 4725 1 6 . 1 1 141 141 ASP N N 141 120.886 120.886 114.330 6.556 17890 4726 1 6 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.634 -0.036 17890 4727 1 6 . 1 1 141 141 ASP C C 141 175.411 175.411 174.031 1.380 17890 4728 1 6 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.026 0.890 17890 4729 1 6 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.989 -1.297 17890 4730 1 6 . 1 1 141 141 ASP H H 141 8.507 8.507 7.648 0.859 17890 4731 1 6 . 1 1 142 142 ALA N N 142 125.604 125.604 121.240 4.364 17890 4732 1 6 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.701 -0.184 17890 4733 1 6 . 1 1 142 142 ALA C C 142 177.671 177.671 177.549 0.122 17890 4734 1 6 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.641 0.352 17890 4735 1 6 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.515 0.020 17890 4736 1 6 . 1 1 142 142 ALA H H 142 7.894 7.894 8.141 -0.247 17890 4737 1 6 . 1 1 143 143 THR N N 143 118.085 118.085 115.260 2.825 17890 4738 1 6 . 1 1 143 143 THR HA H 143 3.744 3.744 4.282 -0.538 17890 4739 1 6 . 1 1 143 143 THR C C 143 175.464 175.464 175.236 0.228 17890 4740 1 6 . 1 1 143 143 THR CA C 143 64.548 64.548 63.748 0.800 17890 4741 1 6 . 1 1 143 143 THR CB C 143 69.305 69.305 68.861 0.445 17890 4742 1 6 . 1 1 143 143 THR H H 143 8.268 8.268 8.799 -0.531 17890 4743 1 6 . 1 1 144 144 PHE N N 144 118.635 118.635 117.883 0.752 17890 4744 1 6 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.782 -0.436 17890 4745 1 6 . 1 1 144 144 PHE C C 144 176.209 176.209 175.054 1.155 17890 4746 1 6 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.419 4.043 17890 4747 1 6 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.861 -0.257 17890 4748 1 6 . 1 1 144 144 PHE H H 144 8.719 8.719 7.924 0.795 17890 4749 1 6 . 1 1 145 145 SER N N 145 113.446 113.446 115.427 -1.981 17890 4750 1 6 . 1 1 145 145 SER HA H 145 4.866 4.866 4.091 0.775 17890 4751 1 6 . 1 1 145 145 SER C C 145 176.605 176.605 175.772 0.833 17890 4752 1 6 . 1 1 145 145 SER CA C 145 59.432 59.432 57.533 1.899 17890 4753 1 6 . 1 1 145 145 SER CB C 145 62.167 62.167 63.188 -1.021 17890 4754 1 6 . 1 1 145 145 SER H H 145 8.657 8.657 7.323 1.334 17890 4755 1 6 . 1 1 146 146 GLY N N 146 109.277 109.277 110.503 -1.226 17890 4756 1 6 . 1 1 146 146 GLY C C 146 174.293 174.293 173.288 1.005 17890 4757 1 6 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.275 -0.335 17890 4758 1 6 . 1 1 146 146 GLY H H 146 7.467 7.467 8.500 -1.033 17890 4759 1 6 . 1 1 147 147 ARG N N 147 122.863 122.863 118.394 4.469 17890 4760 1 6 . 1 1 147 147 ARG HA H 147 5.441 5.441 5.063 0.378 17890 4761 1 6 . 1 1 147 147 ARG C C 147 173.849 173.849 174.604 -0.755 17890 4762 1 6 . 1 1 147 147 ARG CA C 147 52.227 52.227 55.428 -3.201 17890 4763 1 6 . 1 1 147 147 ARG CB C 147 32.597 32.597 34.112 -1.516 17890 4764 1 6 . 1 1 147 147 ARG H H 147 7.556 7.556 6.998 0.558 17890 4765 1 6 . 1 1 148 148 TRP N N 148 118.465 118.465 121.024 -2.559 17890 4766 1 6 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.066 -0.220 17890 4767 1 6 . 1 1 148 148 TRP C C 148 174.353 174.353 174.030 0.323 17890 4768 1 6 . 1 1 148 148 TRP CA C 148 55.662 55.662 57.055 -1.393 17890 4769 1 6 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.558 -1.559 17890 4770 1 6 . 1 1 148 148 TRP H H 148 8.709 8.709 9.243 -0.534 17890 4771 1 6 . 1 1 149 149 VAL N N 149 125.852 125.852 117.787 8.065 17890 4772 1 6 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.414 -0.271 17890 4773 1 6 . 1 1 149 149 VAL C C 149 173.613 173.613 173.357 0.256 17890 4774 1 6 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.824 1.916 17890 4775 1 6 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.281 -2.898 17890 4776 1 6 . 1 1 149 149 VAL H H 149 9.700 9.700 8.860 0.840 17890 4777 1 6 . 1 1 150 150 ILE N N 150 125.140 125.140 126.518 -1.378 17890 4778 1 6 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.122 -0.260 17890 4779 1 6 . 1 1 150 150 ILE C C 150 175.661 175.661 174.736 0.925 17890 4780 1 6 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.497 1.324 17890 4781 1 6 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.461 -0.641 17890 4782 1 6 . 1 1 150 150 ILE H H 150 7.747 7.747 8.002 -0.255 17890 4783 1 6 . 1 1 151 151 GLU N N 151 126.762 126.762 127.718 -0.956 17890 4784 1 6 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.746 0.134 17890 4785 1 6 . 1 1 151 151 GLU C C 151 174.424 174.424 174.451 -0.027 17890 4786 1 6 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.759 1.037 17890 4787 1 6 . 1 1 151 151 GLU CB C 151 34.251 34.251 34.045 0.206 17890 4788 1 6 . 1 1 151 151 GLU H H 151 8.892 8.892 8.656 0.236 17890 4789 1 6 . 1 1 152 152 LYS N N 152 126.299 126.299 122.370 3.929 17890 4790 1 6 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.708 0.153 17890 4791 1 6 . 1 1 152 152 LYS C C 152 176.282 176.282 176.480 -0.198 17890 4792 1 6 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.946 0.559 17890 4793 1 6 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.522 0.814 17890 4794 1 6 . 1 1 152 152 LYS H H 152 8.640 8.640 8.277 0.363 17890 4795 1 7 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.239 -1.945 17890 4796 1 7 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.032 0.590 17890 4797 1 7 . 1 1 8 8 HIS CA C 8 55.661 55.661 58.644 -2.983 17890 4798 1 7 . 1 1 8 8 HIS CB C 8 29.880 29.880 29.262 0.618 17890 4799 1 7 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.741 -0.095 17890 4800 1 7 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.146 -0.462 17890 4801 1 7 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.056 -0.225 17890 4802 1 7 . 1 1 10 10 HIS N N 10 120.811 120.811 117.241 3.570 17890 4803 1 7 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.825 -0.145 17890 4804 1 7 . 1 1 10 10 HIS C C 10 174.875 174.875 175.545 -0.670 17890 4805 1 7 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.622 -0.876 17890 4806 1 7 . 1 1 10 10 HIS CB C 10 29.889 29.889 32.113 -2.224 17890 4807 1 7 . 1 1 10 10 HIS H H 10 8.583 8.583 8.084 0.499 17890 4808 1 7 . 1 1 11 11 SER N N 11 118.009 118.009 113.607 4.402 17890 4809 1 7 . 1 1 11 11 SER HA H 11 4.424 4.424 4.685 -0.261 17890 4810 1 7 . 1 1 11 11 SER C C 11 174.962 174.962 175.059 -0.097 17890 4811 1 7 . 1 1 11 11 SER CA C 11 58.660 58.660 58.620 0.040 17890 4812 1 7 . 1 1 11 11 SER CB C 11 63.822 63.822 65.928 -2.106 17890 4813 1 7 . 1 1 11 11 SER H H 11 8.438 8.438 8.635 -0.197 17890 4814 1 7 . 1 1 12 12 GLY N N 12 111.011 111.011 109.312 1.699 17890 4815 1 7 . 1 1 12 12 GLY C C 12 173.907 173.907 173.057 0.850 17890 4816 1 7 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.114 0.307 17890 4817 1 7 . 1 1 12 12 GLY H H 12 8.433 8.433 7.563 0.870 17890 4818 1 7 . 1 1 13 13 ASP N N 13 120.291 120.291 118.375 1.916 17890 4819 1 7 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.409 0.253 17890 4820 1 7 . 1 1 13 13 ASP C C 13 176.115 176.115 176.201 -0.086 17890 4821 1 7 . 1 1 13 13 ASP CA C 13 54.303 54.303 54.523 -0.219 17890 4822 1 7 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.357 0.108 17890 4823 1 7 . 1 1 13 13 ASP H H 13 8.153 8.153 7.668 0.485 17890 4824 1 7 . 1 1 14 14 SER N N 14 116.987 116.987 118.608 -1.621 17890 4825 1 7 . 1 1 14 14 SER HA H 14 4.754 4.754 4.626 0.128 17890 4826 1 7 . 1 1 14 14 SER CA C 14 56.469 56.469 58.036 -1.567 17890 4827 1 7 . 1 1 14 14 SER CB C 14 63.553 63.553 63.568 -0.015 17890 4828 1 7 . 1 1 14 14 SER H H 14 8.210 8.210 8.291 -0.081 17890 4829 1 7 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.410 0.032 17890 4830 1 7 . 1 1 15 15 PRO C C 15 176.424 176.424 176.115 0.309 17890 4831 1 7 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.384 -0.151 17890 4832 1 7 . 1 1 15 15 PRO CB C 15 32.148 32.148 31.873 0.275 17890 4833 1 7 . 1 1 16 16 ALA N N 16 124.219 124.219 121.320 2.899 17890 4834 1 7 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.123 0.227 17890 4835 1 7 . 1 1 16 16 ALA C C 16 177.552 177.552 177.640 -0.088 17890 4836 1 7 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.696 -0.263 17890 4837 1 7 . 1 1 16 16 ALA CB C 16 19.319 19.319 17.817 1.502 17890 4838 1 7 . 1 1 16 16 ALA H H 16 8.284 8.284 8.350 -0.066 17890 4839 1 7 . 1 1 17 17 VAL N N 17 119.504 119.504 117.813 1.691 17890 4840 1 7 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.001 0.248 17890 4841 1 7 . 1 1 17 17 VAL C C 17 176.322 176.322 176.028 0.294 17890 4842 1 7 . 1 1 17 17 VAL CA C 17 62.278 62.278 63.512 -1.234 17890 4843 1 7 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.947 0.010 17890 4844 1 7 . 1 1 17 17 VAL H H 17 8.046 8.046 7.765 0.281 17890 4845 1 7 . 1 1 18 18 THR N N 18 118.186 118.186 121.072 -2.886 17890 4846 1 7 . 1 1 18 18 THR HA H 18 4.473 4.473 4.533 -0.060 17890 4847 1 7 . 1 1 18 18 THR C C 18 174.248 174.248 174.301 -0.053 17890 4848 1 7 . 1 1 18 18 THR CA C 18 61.565 61.565 60.976 0.589 17890 4849 1 7 . 1 1 18 18 THR CB C 18 70.165 70.165 69.447 0.718 17890 4850 1 7 . 1 1 18 18 THR H H 18 8.276 8.276 8.295 -0.019 17890 4851 1 7 . 1 1 19 19 LEU N N 19 125.265 125.265 119.518 5.747 17890 4852 1 7 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.980 0.313 17890 4853 1 7 . 1 1 19 19 LEU C C 19 175.689 175.689 175.444 0.245 17890 4854 1 7 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.498 -0.071 17890 4855 1 7 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.175 2.104 17890 4856 1 7 . 1 1 19 19 LEU H H 19 8.091 8.091 8.212 -0.121 17890 4857 1 7 . 1 1 20 20 SER N N 20 114.622 114.622 114.049 0.573 17890 4858 1 7 . 1 1 20 20 SER HA H 20 4.947 4.947 4.912 0.035 17890 4859 1 7 . 1 1 20 20 SER C C 20 174.220 174.220 172.805 1.415 17890 4860 1 7 . 1 1 20 20 SER CA C 20 56.583 56.583 57.347 -0.764 17890 4861 1 7 . 1 1 20 20 SER CB C 20 65.653 65.653 64.784 0.869 17890 4862 1 7 . 1 1 20 20 SER H H 20 7.316 7.316 8.009 -0.693 17890 4863 1 7 . 1 1 21 21 ALA N N 21 125.517 125.517 123.956 1.561 17890 4864 1 7 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.889 -0.222 17890 4865 1 7 . 1 1 21 21 ALA C C 21 177.960 177.960 177.243 0.717 17890 4866 1 7 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.332 1.678 17890 4867 1 7 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.379 -0.154 17890 4868 1 7 . 1 1 21 21 ALA H H 21 8.993 8.993 8.625 0.368 17890 4869 1 7 . 1 1 22 22 GLY N N 22 109.543 109.543 112.023 -2.480 17890 4870 1 7 . 1 1 22 22 GLY C C 22 170.422 170.422 172.005 -1.583 17890 4871 1 7 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.717 -0.336 17890 4872 1 7 . 1 1 22 22 GLY H H 22 8.411 8.411 8.979 -0.568 17890 4873 1 7 . 1 1 23 23 ASN N N 23 119.649 119.649 120.206 -0.557 17890 4874 1 7 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.707 0.180 17890 4875 1 7 . 1 1 23 23 ASN C C 23 175.207 175.207 174.558 0.649 17890 4876 1 7 . 1 1 23 23 ASN CA C 23 51.821 51.821 53.182 -1.361 17890 4877 1 7 . 1 1 23 23 ASN CB C 23 38.755 38.755 40.080 -1.325 17890 4878 1 7 . 1 1 23 23 ASN H H 23 8.092 8.092 8.382 -0.290 17890 4879 1 7 . 1 1 24 24 TYR N N 24 120.889 120.889 122.264 -1.375 17890 4880 1 7 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.245 0.010 17890 4881 1 7 . 1 1 24 24 TYR C C 24 175.667 175.667 174.367 1.300 17890 4882 1 7 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.112 1.001 17890 4883 1 7 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.645 0.181 17890 4884 1 7 . 1 1 24 24 TYR H H 24 9.914 9.914 8.809 1.105 17890 4885 1 7 . 1 1 25 25 ILE N N 25 115.978 115.978 113.403 2.575 17890 4886 1 7 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.053 0.033 17890 4887 1 7 . 1 1 25 25 ILE C C 25 175.200 175.200 174.158 1.042 17890 4888 1 7 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.685 0.860 17890 4889 1 7 . 1 1 25 25 ILE CB C 25 41.122 41.122 42.084 -0.962 17890 4890 1 7 . 1 1 25 25 ILE H H 25 9.216 9.216 9.314 -0.098 17890 4891 1 7 . 1 1 26 26 ILE N N 26 123.957 123.957 122.542 1.415 17890 4892 1 7 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.211 -0.235 17890 4893 1 7 . 1 1 26 26 ILE C C 26 174.810 174.810 174.821 -0.011 17890 4894 1 7 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.360 0.249 17890 4895 1 7 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.270 0.852 17890 4896 1 7 . 1 1 26 26 ILE H H 26 9.559 9.559 9.051 0.508 17890 4897 1 7 . 1 1 27 27 TYR N N 27 121.371 121.371 124.054 -2.683 17890 4898 1 7 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.630 0.560 17890 4899 1 7 . 1 1 27 27 TYR C C 27 173.963 173.963 173.523 0.440 17890 4900 1 7 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.894 -0.225 17890 4901 1 7 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.032 0.666 17890 4902 1 7 . 1 1 27 27 TYR H H 27 9.378 9.378 9.097 0.281 17890 4903 1 7 . 1 1 28 28 ASN N N 28 121.991 121.991 120.132 1.859 17890 4904 1 7 . 1 1 28 28 ASN HA H 28 3.768 3.768 3.929 -0.161 17890 4905 1 7 . 1 1 28 28 ASN C C 28 174.352 174.352 176.119 -1.767 17890 4906 1 7 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.197 1.923 17890 4907 1 7 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.678 1.768 17890 4908 1 7 . 1 1 28 28 ASN H H 28 8.466 8.466 8.384 0.082 17890 4909 1 7 . 1 1 29 29 ARG N N 29 121.103 121.103 126.635 -5.532 17890 4910 1 7 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.012 -0.151 17890 4911 1 7 . 1 1 29 29 ARG C C 29 173.635 173.635 177.423 -3.788 17890 4912 1 7 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.552 0.741 17890 4913 1 7 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.221 0.178 17890 4914 1 7 . 1 1 29 29 ARG H H 29 7.756 7.756 8.235 -0.479 17890 4915 1 7 . 1 1 30 30 VAL N N 30 118.412 118.412 117.147 1.265 17890 4916 1 7 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.837 0.107 17890 4917 1 7 . 1 1 30 30 VAL C C 30 176.199 176.199 175.988 0.211 17890 4918 1 7 . 1 1 30 30 VAL CA C 30 62.577 62.577 64.245 -1.668 17890 4919 1 7 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.395 -2.173 17890 4920 1 7 . 1 1 30 30 VAL H H 30 8.976 8.976 7.809 1.167 17890 4921 1 7 . 1 1 31 31 LEU N N 31 125.418 125.418 116.566 8.852 17890 4922 1 7 . 1 1 31 31 LEU HA H 31 4.485 4.485 3.994 0.491 17890 4923 1 7 . 1 1 31 31 LEU C C 31 179.123 179.123 176.554 2.569 17890 4924 1 7 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.850 -1.825 17890 4925 1 7 . 1 1 31 31 LEU CB C 31 45.581 45.581 42.470 3.111 17890 4926 1 7 . 1 1 31 31 LEU H H 31 8.856 8.856 7.419 1.437 17890 4927 1 7 . 1 1 32 32 SER N N 32 116.890 116.890 115.547 1.343 17890 4928 1 7 . 1 1 32 32 SER HA H 32 5.365 5.365 5.040 0.325 17890 4929 1 7 . 1 1 32 32 SER CA C 32 57.269 57.269 55.716 1.553 17890 4930 1 7 . 1 1 32 32 SER CB C 32 62.213 62.213 64.082 -1.869 17890 4931 1 7 . 1 1 32 32 SER H H 32 9.307 9.307 8.048 1.259 17890 4932 1 7 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.477 -0.597 17890 4933 1 7 . 1 1 33 33 PRO C C 33 175.137 175.137 177.618 -2.481 17890 4934 1 7 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.369 0.916 17890 4935 1 7 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.719 0.312 17890 4936 1 7 . 1 1 34 34 ARG N N 34 110.279 110.279 119.225 -8.946 17890 4937 1 7 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.289 0.203 17890 4938 1 7 . 1 1 34 34 ARG C C 34 176.844 176.844 177.215 -0.371 17890 4939 1 7 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.691 -1.255 17890 4940 1 7 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.528 0.056 17890 4941 1 7 . 1 1 34 34 ARG H H 34 7.257 7.257 7.786 -0.529 17890 4942 1 7 . 1 1 35 35 GLY N N 35 110.288 110.288 106.257 4.031 17890 4943 1 7 . 1 1 35 35 GLY C C 35 173.336 173.336 173.789 -0.453 17890 4944 1 7 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.706 2.324 17890 4945 1 7 . 1 1 35 35 GLY H H 35 8.589 8.589 7.861 0.728 17890 4946 1 7 . 1 1 36 36 GLU N N 36 116.838 116.838 120.919 -4.081 17890 4947 1 7 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.281 0.067 17890 4948 1 7 . 1 1 36 36 GLU C C 36 176.915 176.915 176.371 0.544 17890 4949 1 7 . 1 1 36 36 GLU CA C 36 54.907 54.907 55.994 -1.087 17890 4950 1 7 . 1 1 36 36 GLU CB C 36 30.415 30.415 30.418 -0.003 17890 4951 1 7 . 1 1 36 36 GLU H H 36 7.769 7.769 8.075 -0.306 17890 4952 1 7 . 1 1 37 37 LYS N N 37 123.775 123.775 120.695 3.080 17890 4953 1 7 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.184 0.239 17890 4954 1 7 . 1 1 37 37 LYS C C 37 176.067 176.067 176.058 0.009 17890 4955 1 7 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.304 -0.403 17890 4956 1 7 . 1 1 37 37 LYS CB C 37 33.674 33.674 33.198 0.476 17890 4957 1 7 . 1 1 37 37 LYS H H 37 8.667 8.667 8.620 0.047 17890 4958 1 7 . 1 1 38 38 LEU N N 38 126.658 126.658 121.864 4.794 17890 4959 1 7 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.804 -0.577 17890 4960 1 7 . 1 1 38 38 LEU C C 38 174.332 174.332 175.479 -1.147 17890 4961 1 7 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.792 -0.449 17890 4962 1 7 . 1 1 38 38 LEU CB C 38 41.651 41.651 41.650 0.001 17890 4963 1 7 . 1 1 38 38 LEU H H 38 10.455 10.455 8.688 1.767 17890 4964 1 7 . 1 1 39 39 ALA N N 39 127.018 127.018 123.625 3.393 17890 4965 1 7 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.305 -0.076 17890 4966 1 7 . 1 1 39 39 ALA C C 39 178.694 178.694 176.448 2.246 17890 4967 1 7 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.325 -0.100 17890 4968 1 7 . 1 1 39 39 ALA CB C 39 21.349 21.349 21.170 0.179 17890 4969 1 7 . 1 1 39 39 ALA H H 39 8.773 8.773 8.542 0.231 17890 4970 1 7 . 1 1 40 40 LEU N N 40 126.771 126.771 124.174 2.597 17890 4971 1 7 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.552 -0.198 17890 4972 1 7 . 1 1 40 40 LEU C C 40 178.309 178.309 176.590 1.719 17890 4973 1 7 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.108 0.737 17890 4974 1 7 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.787 0.536 17890 4975 1 7 . 1 1 40 40 LEU H H 40 9.665 9.665 8.773 0.892 17890 4976 1 7 . 1 1 41 41 THR N N 41 126.578 126.578 125.074 1.504 17890 4977 1 7 . 1 1 41 41 THR HA H 41 4.916 4.916 5.173 -0.257 17890 4978 1 7 . 1 1 41 41 THR C C 41 172.547 172.547 173.285 -0.738 17890 4979 1 7 . 1 1 41 41 THR CA C 41 63.253 63.253 61.429 1.824 17890 4980 1 7 . 1 1 41 41 THR CB C 41 71.832 71.832 70.871 0.961 17890 4981 1 7 . 1 1 41 41 THR H H 41 9.802 9.802 9.096 0.706 17890 4982 1 7 . 1 1 42 42 TYR N N 42 130.506 130.506 129.553 0.953 17890 4983 1 7 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.589 0.513 17890 4984 1 7 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.484 -3.498 17890 4985 1 7 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.337 -0.181 17890 4986 1 7 . 1 1 42 42 TYR H H 42 9.428 9.428 8.847 0.581 17890 4987 1 7 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.395 0.095 17890 4988 1 7 . 1 1 43 43 PRO CA C 43 63.573 63.573 62.933 0.640 17890 4989 1 7 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.965 -0.321 17890 4990 1 7 . 1 1 44 44 GLY N N 44 113.736 113.736 105.989 7.747 17890 4991 1 7 . 1 1 44 44 GLY C C 44 171.790 171.790 173.113 -1.323 17890 4992 1 7 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.604 1.112 17890 4993 1 7 . 1 1 44 44 GLY H H 44 8.337 8.337 6.981 1.356 17890 4994 1 7 . 1 1 45 45 ARG N N 45 113.899 113.899 116.161 -2.262 17890 4995 1 7 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.602 -0.026 17890 4996 1 7 . 1 1 45 45 ARG C C 45 175.151 175.151 174.261 0.890 17890 4997 1 7 . 1 1 45 45 ARG CA C 45 54.165 54.165 55.087 -0.922 17890 4998 1 7 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.728 1.491 17890 4999 1 7 . 1 1 45 45 ARG H H 45 6.463 6.463 7.126 -0.663 17890 5000 1 7 . 1 1 46 46 GLN N N 46 119.000 119.000 119.634 -0.634 17890 5001 1 7 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.351 0.098 17890 5002 1 7 . 1 1 46 46 GLN C C 46 177.282 177.282 176.398 0.884 17890 5003 1 7 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.922 0.691 17890 5004 1 7 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.508 0.988 17890 5005 1 7 . 1 1 46 46 GLN H H 46 8.683 8.683 8.275 0.408 17890 5006 1 7 . 1 1 47 47 ARG N N 47 113.526 113.526 117.927 -4.401 17890 5007 1 7 . 1 1 47 47 ARG HA H 47 3.530 3.530 3.980 -0.450 17890 5008 1 7 . 1 1 47 47 ARG C C 47 174.130 174.130 175.109 -0.979 17890 5009 1 7 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.119 1.697 17890 5010 1 7 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.373 1.696 17890 5011 1 7 . 1 1 47 47 ARG H H 47 9.677 9.677 8.631 1.046 17890 5012 1 7 . 1 1 48 48 THR N N 48 114.672 114.672 114.945 -0.273 17890 5013 1 7 . 1 1 48 48 THR HA H 48 4.938 4.938 4.780 0.158 17890 5014 1 7 . 1 1 48 48 THR CA C 48 59.987 59.987 60.013 -0.026 17890 5015 1 7 . 1 1 48 48 THR CB C 48 71.947 71.947 71.390 0.557 17890 5016 1 7 . 1 1 48 48 THR H H 48 8.104 8.104 7.603 0.501 17890 5017 1 7 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.776 -0.408 17890 5018 1 7 . 1 1 49 49 PRO C C 49 175.651 175.651 176.172 -0.521 17890 5019 1 7 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.312 1.869 17890 5020 1 7 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.181 0.516 17890 5021 1 7 . 1 1 50 50 VAL N N 50 122.562 122.562 122.463 0.099 17890 5022 1 7 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.191 -0.244 17890 5023 1 7 . 1 1 50 50 VAL C C 50 174.493 174.493 176.060 -1.567 17890 5024 1 7 . 1 1 50 50 VAL CA C 50 63.811 63.811 62.382 1.429 17890 5025 1 7 . 1 1 50 50 VAL CB C 50 32.168 32.168 33.043 -0.875 17890 5026 1 7 . 1 1 50 50 VAL H H 50 8.123 8.123 8.613 -0.490 17890 5027 1 7 . 1 1 51 51 THR N N 51 113.549 113.549 117.355 -3.806 17890 5028 1 7 . 1 1 51 51 THR HA H 51 5.372 5.372 4.602 0.770 17890 5029 1 7 . 1 1 51 51 THR C C 51 174.841 174.841 172.595 2.246 17890 5030 1 7 . 1 1 51 51 THR CA C 51 59.196 59.196 60.824 -1.628 17890 5031 1 7 . 1 1 51 51 THR CB C 51 72.703 72.703 71.809 0.894 17890 5032 1 7 . 1 1 51 51 THR H H 51 7.057 7.057 7.999 -0.942 17890 5033 1 7 . 1 1 52 52 VAL N N 52 107.374 107.374 120.573 -13.199 17890 5034 1 7 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.131 0.383 17890 5035 1 7 . 1 1 52 52 VAL C C 52 175.697 175.697 173.638 2.059 17890 5036 1 7 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.983 -1.511 17890 5037 1 7 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.357 0.417 17890 5038 1 7 . 1 1 52 52 VAL H H 52 8.062 8.062 8.240 -0.178 17890 5039 1 7 . 1 1 53 53 SER N N 53 114.662 114.662 122.546 -7.884 17890 5040 1 7 . 1 1 53 53 SER HA H 53 4.690 4.690 4.977 -0.287 17890 5041 1 7 . 1 1 53 53 SER CA C 53 56.828 56.828 56.453 0.375 17890 5042 1 7 . 1 1 53 53 SER CB C 53 64.789 64.789 65.923 -1.134 17890 5043 1 7 . 1 1 53 53 SER H H 53 8.681 8.681 8.905 -0.224 17890 5044 1 7 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.574 0.202 17890 5045 1 7 . 1 1 54 54 PRO C C 54 177.724 177.724 176.227 1.497 17890 5046 1 7 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.939 0.486 17890 5047 1 7 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.293 -0.196 17890 5048 1 7 . 1 1 55 55 LEU N N 55 128.655 128.655 123.348 5.307 17890 5049 1 7 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.594 -0.067 17890 5050 1 7 . 1 1 55 55 LEU C C 55 178.696 178.696 176.073 2.623 17890 5051 1 7 . 1 1 55 55 LEU CA C 55 56.246 56.246 54.122 2.124 17890 5052 1 7 . 1 1 55 55 LEU CB C 55 43.606 43.606 44.218 -0.612 17890 5053 1 7 . 1 1 55 55 LEU H H 55 8.675 8.675 8.042 0.633 17890 5054 1 7 . 1 1 56 56 ASP N N 56 126.651 126.651 123.351 3.300 17890 5055 1 7 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.640 0.069 17890 5056 1 7 . 1 1 56 56 ASP C C 56 177.729 177.729 176.778 0.951 17890 5057 1 7 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.900 -0.277 17890 5058 1 7 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.784 -0.152 17890 5059 1 7 . 1 1 56 56 ASP H H 56 9.683 9.683 8.779 0.904 17890 5060 1 7 . 1 1 57 57 GLY N N 57 109.299 109.299 108.704 0.595 17890 5061 1 7 . 1 1 57 57 GLY C C 57 174.558 174.558 174.574 -0.016 17890 5062 1 7 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.592 1.363 17890 5063 1 7 . 1 1 57 57 GLY H H 57 8.157 8.157 8.208 -0.051 17890 5064 1 7 . 1 1 58 58 SER N N 58 116.740 116.740 116.319 0.421 17890 5065 1 7 . 1 1 58 58 SER HA H 58 4.288 4.288 4.515 -0.227 17890 5066 1 7 . 1 1 58 58 SER C C 58 177.252 177.252 176.111 1.141 17890 5067 1 7 . 1 1 58 58 SER CA C 58 58.737 58.737 57.204 1.533 17890 5068 1 7 . 1 1 58 58 SER CB C 58 64.576 64.576 64.154 0.422 17890 5069 1 7 . 1 1 58 58 SER H H 58 8.328 8.328 8.217 0.111 17890 5070 1 7 . 1 1 59 59 SER N N 59 119.768 119.768 118.345 1.423 17890 5071 1 7 . 1 1 59 59 SER HA H 59 4.046 4.046 4.257 -0.211 17890 5072 1 7 . 1 1 59 59 SER C C 59 176.671 176.671 176.120 0.551 17890 5073 1 7 . 1 1 59 59 SER CA C 59 61.691 61.691 59.917 1.774 17890 5074 1 7 . 1 1 59 59 SER CB C 59 63.154 63.154 62.925 0.229 17890 5075 1 7 . 1 1 59 59 SER H H 59 9.020 9.020 8.822 0.198 17890 5076 1 7 . 1 1 60 60 GLU N N 60 119.133 119.133 121.963 -2.830 17890 5077 1 7 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.045 0.141 17890 5078 1 7 . 1 1 60 60 GLU C C 60 177.435 177.435 177.272 0.163 17890 5079 1 7 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.763 1.270 17890 5080 1 7 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.705 -1.479 17890 5081 1 7 . 1 1 60 60 GLU H H 60 8.832 8.832 7.737 1.095 17890 5082 1 7 . 1 1 61 61 GLN N N 61 118.818 118.818 114.717 4.101 17890 5083 1 7 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.008 0.169 17890 5084 1 7 . 1 1 61 61 GLN C C 61 173.254 173.254 175.226 -1.972 17890 5085 1 7 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.802 -0.429 17890 5086 1 7 . 1 1 61 61 GLN CB C 61 27.922 27.922 29.535 -1.613 17890 5087 1 7 . 1 1 61 61 GLN H H 61 7.648 7.648 7.615 0.033 17890 5088 1 7 . 1 1 62 62 ALA N N 62 122.562 122.562 122.180 0.382 17890 5089 1 7 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.536 0.528 17890 5090 1 7 . 1 1 62 62 ALA C C 62 176.637 176.637 175.334 1.303 17890 5091 1 7 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.225 -0.046 17890 5092 1 7 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.208 -0.613 17890 5093 1 7 . 1 1 62 62 ALA H H 62 7.315 7.315 6.888 0.427 17890 5094 1 7 . 1 1 63 63 TRP N N 63 124.787 124.787 119.774 5.013 17890 5095 1 7 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.284 -0.320 17890 5096 1 7 . 1 1 63 63 TRP C C 63 174.351 174.351 175.233 -0.882 17890 5097 1 7 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.327 -0.425 17890 5098 1 7 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.843 -1.726 17890 5099 1 7 . 1 1 63 63 TRP H H 63 9.544 9.544 8.857 0.687 17890 5100 1 7 . 1 1 64 64 ILE N N 64 122.482 122.482 119.190 3.292 17890 5101 1 7 . 1 1 64 64 ILE HA H 64 4.694 4.694 5.078 -0.384 17890 5102 1 7 . 1 1 64 64 ILE C C 64 177.078 177.078 174.236 2.842 17890 5103 1 7 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.498 0.533 17890 5104 1 7 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.609 -1.240 17890 5105 1 7 . 1 1 64 64 ILE H H 64 10.235 10.235 9.347 0.888 17890 5106 1 7 . 1 1 65 65 LEU N N 65 132.183 132.183 128.520 3.663 17890 5107 1 7 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.535 -0.070 17890 5108 1 7 . 1 1 65 65 LEU C C 65 177.048 177.048 174.481 2.567 17890 5109 1 7 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.638 0.711 17890 5110 1 7 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.284 -3.940 17890 5111 1 7 . 1 1 65 65 LEU H H 65 9.432 9.432 9.236 0.196 17890 5112 1 7 . 1 1 66 66 ARG N N 66 120.807 120.807 125.014 -4.207 17890 5113 1 7 . 1 1 66 66 ARG HA H 66 4.888 4.888 5.001 -0.113 17890 5114 1 7 . 1 1 66 66 ARG C C 66 175.275 175.275 174.751 0.524 17890 5115 1 7 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.611 0.444 17890 5116 1 7 . 1 1 66 66 ARG CB C 66 32.991 32.991 33.766 -0.775 17890 5117 1 7 . 1 1 66 66 ARG H H 66 8.491 8.491 8.487 0.004 17890 5118 1 7 . 1 1 67 67 SER N N 67 119.709 119.709 118.511 1.198 17890 5119 1 7 . 1 1 67 67 SER HA H 67 3.186 3.186 3.259 -0.073 17890 5120 1 7 . 1 1 67 67 SER C C 67 174.508 174.508 173.568 0.940 17890 5121 1 7 . 1 1 67 67 SER CA C 67 58.521 58.521 58.812 -0.291 17890 5122 1 7 . 1 1 67 67 SER CB C 67 62.590 62.590 63.146 -0.556 17890 5123 1 7 . 1 1 67 67 SER H H 67 8.557 8.557 8.713 -0.156 17890 5124 1 7 . 1 1 68 68 TYR N N 68 131.011 131.011 127.749 3.262 17890 5125 1 7 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.654 -0.206 17890 5126 1 7 . 1 1 68 68 TYR C C 68 174.687 174.687 174.786 -0.099 17890 5127 1 7 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.633 1.132 17890 5128 1 7 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.948 -1.960 17890 5129 1 7 . 1 1 68 68 TYR H H 68 8.531 8.531 8.575 -0.044 17890 5130 1 7 . 1 1 69 69 ASP N N 69 117.066 117.066 120.200 -3.134 17890 5131 1 7 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.864 -0.239 17890 5132 1 7 . 1 1 69 69 ASP C C 69 176.455 176.455 175.902 0.553 17890 5133 1 7 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.997 -0.906 17890 5134 1 7 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.847 -0.700 17890 5135 1 7 . 1 1 69 69 ASP H H 69 7.122 7.122 7.817 -0.695 17890 5136 1 7 . 1 1 70 70 SER N N 70 122.869 122.869 119.189 3.680 17890 5137 1 7 . 1 1 70 70 SER HA H 70 4.270 4.270 4.086 0.184 17890 5138 1 7 . 1 1 70 70 SER C C 70 177.010 177.010 175.927 1.083 17890 5139 1 7 . 1 1 70 70 SER CA C 70 60.837 60.837 61.132 -0.295 17890 5140 1 7 . 1 1 70 70 SER CB C 70 62.722 62.722 63.338 -0.616 17890 5141 1 7 . 1 1 70 70 SER H H 70 8.757 8.757 8.694 0.063 17890 5142 1 7 . 1 1 71 71 ASN N N 71 119.873 119.873 119.416 0.457 17890 5143 1 7 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.602 -0.031 17890 5144 1 7 . 1 1 71 71 ASN C C 71 176.226 176.226 175.941 0.285 17890 5145 1 7 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.385 0.329 17890 5146 1 7 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.514 0.127 17890 5147 1 7 . 1 1 71 71 ASN H H 71 8.342 8.342 8.639 -0.297 17890 5148 1 7 . 1 1 72 72 SER N N 72 112.202 112.202 113.048 -0.846 17890 5149 1 7 . 1 1 72 72 SER HA H 72 4.567 4.567 4.708 -0.141 17890 5150 1 7 . 1 1 72 72 SER C C 72 173.789 173.789 173.064 0.725 17890 5151 1 7 . 1 1 72 72 SER CA C 72 57.816 57.816 57.562 0.254 17890 5152 1 7 . 1 1 72 72 SER CB C 72 63.935 63.935 64.591 -0.656 17890 5153 1 7 . 1 1 72 72 SER H H 72 7.560 7.560 7.580 -0.020 17890 5154 1 7 . 1 1 73 73 ASN N N 73 117.437 117.437 118.551 -1.114 17890 5155 1 7 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.473 0.061 17890 5156 1 7 . 1 1 73 73 ASN C C 73 173.647 173.647 174.329 -0.682 17890 5157 1 7 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.556 -0.034 17890 5158 1 7 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.133 0.080 17890 5159 1 7 . 1 1 73 73 ASN H H 73 7.940 7.940 7.789 0.151 17890 5160 1 7 . 1 1 74 74 THR N N 74 104.227 104.227 108.605 -4.378 17890 5161 1 7 . 1 1 74 74 THR HA H 74 5.477 5.477 5.150 0.327 17890 5162 1 7 . 1 1 74 74 THR C C 74 176.824 176.824 173.869 2.955 17890 5163 1 7 . 1 1 74 74 THR CA C 74 59.768 59.768 61.217 -1.449 17890 5164 1 7 . 1 1 74 74 THR CB C 74 71.985 71.985 70.375 1.610 17890 5165 1 7 . 1 1 74 74 THR H H 74 7.737 7.737 7.871 -0.134 17890 5166 1 7 . 1 1 75 75 TRP N N 75 124.636 124.636 124.259 0.377 17890 5167 1 7 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.426 -0.219 17890 5168 1 7 . 1 1 75 75 TRP C C 75 175.876 175.876 176.345 -0.469 17890 5169 1 7 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.205 1.401 17890 5170 1 7 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.305 0.211 17890 5171 1 7 . 1 1 75 75 TRP H H 75 9.442 9.442 9.346 0.096 17890 5172 1 7 . 1 1 76 76 THR N N 76 110.544 110.544 114.233 -3.689 17890 5173 1 7 . 1 1 76 76 THR HA H 76 5.129 5.129 4.990 0.139 17890 5174 1 7 . 1 1 76 76 THR C C 76 174.506 174.506 174.489 0.017 17890 5175 1 7 . 1 1 76 76 THR CA C 76 60.561 60.561 61.262 -0.701 17890 5176 1 7 . 1 1 76 76 THR CB C 76 71.688 71.688 70.142 1.546 17890 5177 1 7 . 1 1 76 76 THR H H 76 9.415 9.415 9.437 -0.022 17890 5178 1 7 . 1 1 77 77 ILE N N 77 121.567 121.567 123.115 -1.548 17890 5179 1 7 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.236 -0.096 17890 5180 1 7 . 1 1 77 77 ILE C C 77 176.148 176.148 175.157 0.991 17890 5181 1 7 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.711 1.998 17890 5182 1 7 . 1 1 77 77 ILE CB C 77 40.987 40.987 40.160 0.827 17890 5183 1 7 . 1 1 77 77 ILE H H 77 9.255 9.255 8.509 0.746 17890 5184 1 7 . 1 1 78 78 SER N N 78 122.269 122.269 121.228 1.041 17890 5185 1 7 . 1 1 78 78 SER HA H 78 5.601 5.601 5.369 0.232 17890 5186 1 7 . 1 1 78 78 SER CA C 78 55.835 55.835 56.067 -0.232 17890 5187 1 7 . 1 1 78 78 SER CB C 78 65.858 65.858 66.467 -0.609 17890 5188 1 7 . 1 1 78 78 SER H H 78 9.226 9.226 8.769 0.457 17890 5189 1 7 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.311 -0.447 17890 5190 1 7 . 1 1 79 79 PRO C C 79 178.175 178.175 177.399 0.776 17890 5191 1 7 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.183 0.701 17890 5192 1 7 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.983 -1.710 17890 5193 1 7 . 1 1 80 80 VAL N N 80 121.906 121.906 117.358 4.548 17890 5194 1 7 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.761 -0.180 17890 5195 1 7 . 1 1 80 80 VAL C C 80 177.751 177.751 176.960 0.791 17890 5196 1 7 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.896 1.171 17890 5197 1 7 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.093 0.392 17890 5198 1 7 . 1 1 80 80 VAL H H 80 7.328 7.328 7.628 -0.300 17890 5199 1 7 . 1 1 81 81 GLY N N 81 104.643 104.643 106.622 -1.979 17890 5200 1 7 . 1 1 81 81 GLY C C 81 174.979 174.979 174.814 0.165 17890 5201 1 7 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.125 -0.037 17890 5202 1 7 . 1 1 81 81 GLY H H 81 8.949 8.949 8.344 0.605 17890 5203 1 7 . 1 1 82 82 SER N N 82 111.865 111.865 116.267 -4.402 17890 5204 1 7 . 1 1 82 82 SER HA H 82 4.646 4.646 4.890 -0.244 17890 5205 1 7 . 1 1 82 82 SER CA C 82 55.441 55.441 55.617 -0.176 17890 5206 1 7 . 1 1 82 82 SER CB C 82 62.277 62.277 63.937 -1.660 17890 5207 1 7 . 1 1 82 82 SER H H 82 6.968 6.968 7.121 -0.153 17890 5208 1 7 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.569 -0.222 17890 5209 1 7 . 1 1 83 83 PRO C C 83 176.660 176.660 176.698 -0.038 17890 5210 1 7 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.439 0.764 17890 5211 1 7 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.928 0.891 17890 5212 1 7 . 1 1 84 84 ASN N N 84 116.542 116.542 114.939 1.603 17890 5213 1 7 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.598 0.403 17890 5214 1 7 . 1 1 84 84 ASN C C 84 175.825 175.825 175.276 0.549 17890 5215 1 7 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.887 -0.996 17890 5216 1 7 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.461 0.283 17890 5217 1 7 . 1 1 84 84 ASN H H 84 8.502 8.502 8.479 0.023 17890 5218 1 7 . 1 1 85 85 SER N N 85 114.633 114.633 113.359 1.274 17890 5219 1 7 . 1 1 85 85 SER HA H 85 4.624 4.624 4.850 -0.226 17890 5220 1 7 . 1 1 85 85 SER C C 85 172.963 172.963 172.216 0.747 17890 5221 1 7 . 1 1 85 85 SER CA C 85 59.210 59.210 57.808 1.402 17890 5222 1 7 . 1 1 85 85 SER CB C 85 64.697 64.697 66.652 -1.955 17890 5223 1 7 . 1 1 85 85 SER H H 85 7.980 7.980 7.866 0.114 17890 5224 1 7 . 1 1 86 86 GLN N N 86 119.016 119.016 118.282 0.734 17890 5225 1 7 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.608 -0.162 17890 5226 1 7 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.357 0.095 17890 5227 1 7 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.321 0.077 17890 5228 1 7 . 1 1 86 86 GLN H H 86 9.399 9.399 9.123 0.276 17890 5229 1 7 . 1 1 87 87 ILE N N 87 119.691 119.691 118.990 0.701 17890 5230 1 7 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.160 -0.585 17890 5231 1 7 . 1 1 87 87 ILE C C 87 176.505 176.505 176.053 0.452 17890 5232 1 7 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.977 4.516 17890 5233 1 7 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.361 -1.165 17890 5234 1 7 . 1 1 87 87 ILE H H 87 8.970 8.970 8.273 0.697 17890 5235 1 7 . 1 1 88 88 GLY N N 88 118.378 118.378 114.526 3.852 17890 5236 1 7 . 1 1 88 88 GLY C C 88 171.397 171.397 171.641 -0.244 17890 5237 1 7 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.042 -1.438 17890 5238 1 7 . 1 1 88 88 GLY H H 88 9.752 9.752 9.079 0.673 17890 5239 1 7 . 1 1 89 89 TRP N N 89 122.749 122.749 121.953 0.796 17890 5240 1 7 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.408 -0.810 17890 5241 1 7 . 1 1 89 89 TRP C C 89 175.924 175.924 174.754 1.170 17890 5242 1 7 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.062 0.221 17890 5243 1 7 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.458 -2.372 17890 5244 1 7 . 1 1 89 89 TRP H H 89 8.215 8.215 8.199 0.016 17890 5245 1 7 . 1 1 90 90 GLY N N 90 116.305 116.305 110.558 5.747 17890 5246 1 7 . 1 1 90 90 GLY C C 90 173.725 173.725 172.422 1.303 17890 5247 1 7 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.553 0.502 17890 5248 1 7 . 1 1 90 90 GLY H H 90 8.922 8.922 8.224 0.698 17890 5249 1 7 . 1 1 91 91 ALA N N 91 123.795 123.795 122.101 1.694 17890 5250 1 7 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.163 0.080 17890 5251 1 7 . 1 1 91 91 ALA C C 91 178.510 178.510 178.935 -0.425 17890 5252 1 7 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.440 0.050 17890 5253 1 7 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.785 -0.376 17890 5254 1 7 . 1 1 91 91 ALA H H 91 8.367 8.367 8.155 0.212 17890 5255 1 7 . 1 1 92 92 GLY N N 92 108.871 108.871 112.768 -3.897 17890 5256 1 7 . 1 1 92 92 GLY C C 92 174.528 174.528 174.845 -0.317 17890 5257 1 7 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.714 0.544 17890 5258 1 7 . 1 1 92 92 GLY H H 92 8.776 8.776 8.614 0.162 17890 5259 1 7 . 1 1 93 93 ASN N N 93 114.921 114.921 117.262 -2.341 17890 5260 1 7 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.778 -0.329 17890 5261 1 7 . 1 1 93 93 ASN C C 93 172.774 172.774 174.059 -1.285 17890 5262 1 7 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.411 0.562 17890 5263 1 7 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.967 -0.638 17890 5264 1 7 . 1 1 93 93 ASN H H 93 8.647 8.647 8.287 0.360 17890 5265 1 7 . 1 1 94 94 VAL N N 94 112.437 112.437 112.734 -0.297 17890 5266 1 7 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.632 0.433 17890 5267 1 7 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.463 -1.548 17890 5268 1 7 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.462 -0.307 17890 5269 1 7 . 1 1 94 94 VAL H H 94 6.989 6.989 7.473 -0.484 17890 5270 1 7 . 1 1 95 95 PRO HA H 95 4.928 4.928 5.003 -0.075 17890 5271 1 7 . 1 1 95 95 PRO C C 95 176.041 176.041 176.141 -0.100 17890 5272 1 7 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.375 -1.174 17890 5273 1 7 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.616 -0.891 17890 5274 1 7 . 1 1 96 96 VAL N N 96 113.564 113.564 117.025 -3.461 17890 5275 1 7 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.837 -0.102 17890 5276 1 7 . 1 1 96 96 VAL C C 96 173.656 173.656 175.019 -1.363 17890 5277 1 7 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.608 -0.756 17890 5278 1 7 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.566 1.587 17890 5279 1 7 . 1 1 96 96 VAL H H 96 8.199 8.199 8.898 -0.699 17890 5280 1 7 . 1 1 97 97 VAL N N 97 122.328 122.328 122.697 -0.369 17890 5281 1 7 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.551 0.080 17890 5282 1 7 . 1 1 97 97 VAL C C 97 174.776 174.776 175.646 -0.870 17890 5283 1 7 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.053 0.604 17890 5284 1 7 . 1 1 97 97 VAL CB C 97 31.128 31.128 32.010 -0.882 17890 5285 1 7 . 1 1 97 97 VAL H H 97 8.957 8.957 8.420 0.537 17890 5286 1 7 . 1 1 98 98 LEU N N 98 130.258 130.258 125.936 4.322 17890 5287 1 7 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.972 0.078 17890 5288 1 7 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.547 1.276 17890 5289 1 7 . 1 1 98 98 LEU CB C 98 46.118 46.118 44.878 1.240 17890 5290 1 7 . 1 1 98 98 LEU H H 98 9.245 9.245 9.113 0.132 17890 5291 1 7 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.719 0.060 17890 5292 1 7 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.077 0.412 17890 5293 1 7 . 1 1 99 99 PRO CB C 99 30.454 30.454 30.978 -0.524 17890 5294 1 7 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.517 -0.532 17890 5295 1 7 . 1 1 100 100 PRO C C 100 177.309 177.309 175.759 1.550 17890 5296 1 7 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.036 0.788 17890 5297 1 7 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.342 -0.237 17890 5298 1 7 . 1 1 101 101 ASN N N 101 119.284 119.284 125.686 -6.402 17890 5299 1 7 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.619 -0.077 17890 5300 1 7 . 1 1 101 101 ASN C C 101 171.920 171.920 173.826 -1.906 17890 5301 1 7 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.776 -0.576 17890 5302 1 7 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.309 -1.684 17890 5303 1 7 . 1 1 101 101 ASN H H 101 7.273 7.273 9.297 -2.024 17890 5304 1 7 . 1 1 102 102 ASN N N 102 115.674 115.674 116.371 -0.697 17890 5305 1 7 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.705 -0.787 17890 5306 1 7 . 1 1 102 102 ASN C C 102 173.264 173.264 174.314 -1.050 17890 5307 1 7 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.772 1.268 17890 5308 1 7 . 1 1 102 102 ASN CB C 102 36.982 36.982 37.949 -0.967 17890 5309 1 7 . 1 1 102 102 ASN H H 102 8.197 8.197 7.782 0.415 17890 5310 1 7 . 1 1 103 103 TYR N N 103 118.775 118.775 121.584 -2.809 17890 5311 1 7 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.333 0.152 17890 5312 1 7 . 1 1 103 103 TYR C C 103 175.248 175.248 174.860 0.388 17890 5313 1 7 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.962 -2.472 17890 5314 1 7 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.495 -0.963 17890 5315 1 7 . 1 1 103 103 TYR H H 103 7.745 7.745 7.364 0.381 17890 5316 1 7 . 1 1 104 104 VAL N N 104 116.205 116.205 116.013 0.192 17890 5317 1 7 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.899 0.078 17890 5318 1 7 . 1 1 104 104 VAL C C 104 174.361 174.361 173.564 0.797 17890 5319 1 7 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.847 -1.597 17890 5320 1 7 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.335 0.208 17890 5321 1 7 . 1 1 104 104 VAL H H 104 7.498 7.498 8.048 -0.550 17890 5322 1 7 . 1 1 105 105 TRP N N 105 119.557 119.557 119.209 0.348 17890 5323 1 7 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.043 -0.168 17890 5324 1 7 . 1 1 105 105 TRP C C 105 175.526 175.526 176.009 -0.483 17890 5325 1 7 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.330 -0.446 17890 5326 1 7 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.673 -0.134 17890 5327 1 7 . 1 1 105 105 TRP H H 105 8.926 8.926 9.114 -0.188 17890 5328 1 7 . 1 1 106 106 THR N N 106 120.480 120.480 119.843 0.637 17890 5329 1 7 . 1 1 106 106 THR HA H 106 4.966 4.966 4.906 0.060 17890 5330 1 7 . 1 1 106 106 THR C C 106 174.177 174.177 174.065 0.112 17890 5331 1 7 . 1 1 106 106 THR CA C 106 62.091 62.091 63.906 -1.815 17890 5332 1 7 . 1 1 106 106 THR CB C 106 69.649 69.649 69.233 0.416 17890 5333 1 7 . 1 1 106 106 THR H H 106 9.525 9.525 9.150 0.375 17890 5334 1 7 . 1 1 107 107 LEU N N 107 127.146 127.146 128.423 -1.277 17890 5335 1 7 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.128 -0.301 17890 5336 1 7 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.574 0.135 17890 5337 1 7 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.103 -1.580 17890 5338 1 7 . 1 1 107 107 LEU H H 107 7.591 7.591 8.812 -1.221 17890 5339 1 7 . 1 1 108 108 THR N N 108 119.928 119.928 121.371 -1.443 17890 5340 1 7 . 1 1 108 108 THR HA H 108 4.411 4.411 4.590 -0.179 17890 5341 1 7 . 1 1 108 108 THR C C 108 173.319 173.319 172.996 0.323 17890 5342 1 7 . 1 1 108 108 THR CA C 108 62.243 62.243 61.549 0.694 17890 5343 1 7 . 1 1 108 108 THR CB C 108 70.138 70.138 71.077 -0.939 17890 5344 1 7 . 1 1 108 108 THR H H 108 8.141 8.141 9.028 -0.887 17890 5345 1 7 . 1 1 109 109 LEU N N 109 130.557 130.557 129.061 1.496 17890 5346 1 7 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.895 -0.350 17890 5347 1 7 . 1 1 109 109 LEU C C 109 175.217 175.217 176.517 -1.300 17890 5348 1 7 . 1 1 109 109 LEU CA C 109 55.286 55.286 54.941 0.345 17890 5349 1 7 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.899 -2.293 17890 5350 1 7 . 1 1 109 109 LEU H H 109 8.924 8.924 8.751 0.173 17890 5351 1 7 . 1 1 110 110 THR N N 110 120.160 120.160 115.058 5.102 17890 5352 1 7 . 1 1 110 110 THR HA H 110 4.911 4.911 4.793 0.118 17890 5353 1 7 . 1 1 110 110 THR CA C 110 60.141 60.141 60.016 0.125 17890 5354 1 7 . 1 1 110 110 THR CB C 110 72.785 72.785 70.784 2.001 17890 5355 1 7 . 1 1 110 110 THR H H 110 7.677 7.677 8.385 -0.708 17890 5356 1 7 . 1 1 111 111 SER HA H 111 4.204 4.204 4.252 -0.048 17890 5357 1 7 . 1 1 111 111 SER C C 111 174.755 174.755 175.240 -0.485 17890 5358 1 7 . 1 1 111 111 SER CA C 111 60.710 60.710 59.431 1.280 17890 5359 1 7 . 1 1 111 111 SER CB C 111 62.660 62.660 62.874 -0.214 17890 5360 1 7 . 1 1 112 112 GLY N N 112 107.313 107.313 107.953 -0.640 17890 5361 1 7 . 1 1 112 112 GLY C C 112 173.023 173.023 172.904 0.119 17890 5362 1 7 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.143 -0.993 17890 5363 1 7 . 1 1 112 112 GLY H H 112 8.249 8.249 7.481 0.768 17890 5364 1 7 . 1 1 113 113 GLY N N 113 105.618 105.618 107.823 -2.205 17890 5365 1 7 . 1 1 113 113 GLY C C 113 175.844 175.844 171.841 4.003 17890 5366 1 7 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.974 -3.215 17890 5367 1 7 . 1 1 113 113 GLY H H 113 7.444 7.444 7.345 0.099 17890 5368 1 7 . 1 1 114 114 TYR N N 114 121.548 121.548 118.353 3.195 17890 5369 1 7 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.461 -0.609 17890 5370 1 7 . 1 1 114 114 TYR C C 114 175.605 175.605 174.375 1.230 17890 5371 1 7 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.431 4.832 17890 5372 1 7 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.436 -4.503 17890 5373 1 7 . 1 1 114 114 TYR H H 114 9.677 9.677 8.961 0.716 17890 5374 1 7 . 1 1 115 115 ASN N N 115 123.274 123.274 117.568 5.706 17890 5375 1 7 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.225 -0.127 17890 5376 1 7 . 1 1 115 115 ASN C C 115 174.355 174.355 173.100 1.255 17890 5377 1 7 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.524 -1.478 17890 5378 1 7 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.711 -2.362 17890 5379 1 7 . 1 1 115 115 ASN H H 115 9.350 9.350 8.939 0.411 17890 5380 1 7 . 1 1 116 116 ILE N N 116 130.611 130.611 121.757 8.854 17890 5381 1 7 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.885 -0.646 17890 5382 1 7 . 1 1 116 116 ILE C C 116 173.998 173.998 174.246 -0.248 17890 5383 1 7 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.950 2.249 17890 5384 1 7 . 1 1 116 116 ILE CB C 116 37.100 37.100 40.187 -3.087 17890 5385 1 7 . 1 1 116 116 ILE H H 116 9.473 9.473 8.364 1.109 17890 5386 1 7 . 1 1 117 117 GLN N N 117 121.633 121.633 124.903 -3.270 17890 5387 1 7 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.027 0.908 17890 5388 1 7 . 1 1 117 117 GLN C C 117 177.902 177.902 175.968 1.934 17890 5389 1 7 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.998 -0.678 17890 5390 1 7 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.612 3.845 17890 5391 1 7 . 1 1 117 117 GLN H H 117 8.781 8.781 8.734 0.047 17890 5392 1 7 . 1 1 118 118 ASP N N 118 116.836 116.836 119.983 -3.147 17890 5393 1 7 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.918 0.865 17890 5394 1 7 . 1 1 118 118 ASP C C 118 178.084 178.084 176.619 1.465 17890 5395 1 7 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.210 -1.440 17890 5396 1 7 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.215 -0.847 17890 5397 1 7 . 1 1 118 118 ASP H H 118 9.330 9.330 8.505 0.825 17890 5398 1 7 . 1 1 119 119 GLY N N 119 111.037 111.037 108.111 2.926 17890 5399 1 7 . 1 1 119 119 GLY C C 119 174.196 174.196 175.509 -1.313 17890 5400 1 7 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.918 2.058 17890 5401 1 7 . 1 1 119 119 GLY H H 119 8.986 8.986 8.317 0.669 17890 5402 1 7 . 1 1 120 120 LYS N N 120 114.809 114.809 121.760 -6.951 17890 5403 1 7 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.484 -0.135 17890 5404 1 7 . 1 1 120 120 LYS C C 120 175.174 175.174 176.161 -0.987 17890 5405 1 7 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.493 1.440 17890 5406 1 7 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.573 -0.097 17890 5407 1 7 . 1 1 120 120 LYS H H 120 7.045 7.045 8.733 -1.688 17890 5408 1 7 . 1 1 121 121 ARG N N 121 116.291 116.291 114.067 2.224 17890 5409 1 7 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.093 -0.507 17890 5410 1 7 . 1 1 121 121 ARG C C 121 175.097 175.097 177.111 -2.014 17890 5411 1 7 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.347 0.722 17890 5412 1 7 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.563 0.060 17890 5413 1 7 . 1 1 121 121 ARG H H 121 7.683 7.683 7.885 -0.202 17890 5414 1 7 . 1 1 122 122 THR N N 122 113.730 113.730 110.504 3.226 17890 5415 1 7 . 1 1 122 122 THR HA H 122 4.540 4.540 4.193 0.347 17890 5416 1 7 . 1 1 122 122 THR C C 122 175.302 175.302 174.401 0.901 17890 5417 1 7 . 1 1 122 122 THR CA C 122 62.871 62.871 64.188 -1.317 17890 5418 1 7 . 1 1 122 122 THR CB C 122 71.552 71.552 69.616 1.936 17890 5419 1 7 . 1 1 122 122 THR H H 122 11.059 11.059 8.153 2.906 17890 5420 1 7 . 1 1 123 123 VAL N N 123 118.350 118.350 115.511 2.839 17890 5421 1 7 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.597 0.213 17890 5422 1 7 . 1 1 123 123 VAL C C 123 174.730 174.730 173.671 1.059 17890 5423 1 7 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.048 0.263 17890 5424 1 7 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.907 2.175 17890 5425 1 7 . 1 1 123 123 VAL H H 123 8.181 8.181 7.711 0.470 17890 5426 1 7 . 1 1 124 124 SER N N 124 113.053 113.053 113.947 -0.894 17890 5427 1 7 . 1 1 124 124 SER HA H 124 5.820 5.820 5.176 0.644 17890 5428 1 7 . 1 1 124 124 SER C C 124 175.521 175.521 173.424 2.097 17890 5429 1 7 . 1 1 124 124 SER CA C 124 58.087 58.087 57.037 1.050 17890 5430 1 7 . 1 1 124 124 SER CB C 124 67.405 67.405 65.999 1.406 17890 5431 1 7 . 1 1 124 124 SER H H 124 9.138 9.138 8.689 0.449 17890 5432 1 7 . 1 1 125 125 TRP N N 125 124.900 124.900 124.941 -0.041 17890 5433 1 7 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.025 0.585 17890 5434 1 7 . 1 1 125 125 TRP C C 125 178.114 178.114 177.520 0.594 17890 5435 1 7 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.155 -0.681 17890 5436 1 7 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.853 1.170 17890 5437 1 7 . 1 1 125 125 TRP H H 125 8.843 8.843 8.017 0.826 17890 5438 1 7 . 1 1 126 126 SER N N 126 119.243 119.243 113.835 5.408 17890 5439 1 7 . 1 1 126 126 SER HA H 126 5.443 5.443 5.353 0.090 17890 5440 1 7 . 1 1 126 126 SER C C 126 171.668 171.668 172.868 -1.200 17890 5441 1 7 . 1 1 126 126 SER CA C 126 58.696 58.696 57.209 1.487 17890 5442 1 7 . 1 1 126 126 SER CB C 126 66.176 66.176 66.255 -0.079 17890 5443 1 7 . 1 1 126 126 SER H H 126 9.835 9.835 9.273 0.562 17890 5444 1 7 . 1 1 127 127 LEU N N 127 113.708 113.708 117.660 -3.952 17890 5445 1 7 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.664 0.491 17890 5446 1 7 . 1 1 127 127 LEU C C 127 176.563 176.563 176.667 -0.104 17890 5447 1 7 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.444 -0.798 17890 5448 1 7 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.237 -1.541 17890 5449 1 7 . 1 1 127 127 LEU H H 127 6.559 6.559 8.260 -1.701 17890 5450 1 7 . 1 1 128 128 ASN N N 128 121.739 121.739 118.703 3.036 17890 5451 1 7 . 1 1 128 128 ASN HA H 128 4.689 4.689 5.017 -0.328 17890 5452 1 7 . 1 1 128 128 ASN C C 128 175.452 175.452 175.619 -0.167 17890 5453 1 7 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.758 1.249 17890 5454 1 7 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.745 -1.454 17890 5455 1 7 . 1 1 128 128 ASN H H 128 8.662 8.662 9.733 -1.071 17890 5456 1 7 . 1 1 129 129 ASN N N 129 119.586 119.586 116.525 3.061 17890 5457 1 7 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.881 0.116 17890 5458 1 7 . 1 1 129 129 ASN C C 129 175.900 175.900 174.907 0.993 17890 5459 1 7 . 1 1 129 129 ASN CA C 129 54.233 54.233 52.710 1.523 17890 5460 1 7 . 1 1 129 129 ASN CB C 129 41.256 41.256 39.450 1.806 17890 5461 1 7 . 1 1 129 129 ASN H H 129 10.962 10.962 8.766 2.196 17890 5462 1 7 . 1 1 130 130 ALA N N 130 128.292 128.292 122.287 6.005 17890 5463 1 7 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.083 -0.513 17890 5464 1 7 . 1 1 130 130 ALA C C 130 172.620 172.620 176.090 -3.470 17890 5465 1 7 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.378 -0.739 17890 5466 1 7 . 1 1 130 130 ALA CB C 130 16.100 16.100 16.944 -0.844 17890 5467 1 7 . 1 1 130 130 ALA H H 130 10.629 10.629 8.226 2.403 17890 5468 1 7 . 1 1 131 131 THR N N 131 105.584 105.584 109.441 -3.857 17890 5469 1 7 . 1 1 131 131 THR HA H 131 4.462 4.462 4.727 -0.265 17890 5470 1 7 . 1 1 131 131 THR C C 131 173.552 173.552 174.303 -0.751 17890 5471 1 7 . 1 1 131 131 THR CA C 131 58.338 58.338 59.170 -0.832 17890 5472 1 7 . 1 1 131 131 THR CB C 131 71.569 71.569 71.668 -0.100 17890 5473 1 7 . 1 1 131 131 THR H H 131 7.092 7.092 7.948 -0.856 17890 5474 1 7 . 1 1 132 132 ALA N N 132 121.773 121.773 123.904 -2.131 17890 5475 1 7 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.052 -0.303 17890 5476 1 7 . 1 1 132 132 ALA C C 132 178.819 178.819 178.105 0.714 17890 5477 1 7 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.248 2.036 17890 5478 1 7 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.820 -0.593 17890 5479 1 7 . 1 1 132 132 ALA H H 132 8.952 8.952 8.622 0.330 17890 5480 1 7 . 1 1 133 133 GLY N N 133 113.965 113.965 110.439 3.526 17890 5481 1 7 . 1 1 133 133 GLY C C 133 173.453 173.453 174.760 -1.307 17890 5482 1 7 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.942 0.224 17890 5483 1 7 . 1 1 133 133 GLY H H 133 9.016 9.016 8.440 0.576 17890 5484 1 7 . 1 1 134 134 GLU N N 134 123.460 123.460 121.217 2.243 17890 5485 1 7 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.191 -0.233 17890 5486 1 7 . 1 1 134 134 GLU C C 134 176.120 176.120 175.171 0.949 17890 5487 1 7 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.539 0.860 17890 5488 1 7 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.629 0.756 17890 5489 1 7 . 1 1 134 134 GLU H H 134 7.598 7.598 7.523 0.075 17890 5490 1 7 . 1 1 135 135 GLU N N 135 122.633 122.633 122.705 -0.072 17890 5491 1 7 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.466 -0.155 17890 5492 1 7 . 1 1 135 135 GLU C C 135 176.014 176.014 175.717 0.297 17890 5493 1 7 . 1 1 135 135 GLU CA C 135 56.182 56.182 54.912 1.270 17890 5494 1 7 . 1 1 135 135 GLU CB C 135 29.453 29.453 31.701 -2.248 17890 5495 1 7 . 1 1 135 135 GLU H H 135 8.258 8.258 8.635 -0.377 17890 5496 1 7 . 1 1 136 136 VAL N N 136 123.635 123.635 125.230 -1.595 17890 5497 1 7 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.791 -0.099 17890 5498 1 7 . 1 1 136 136 VAL C C 136 173.932 173.932 175.125 -1.193 17890 5499 1 7 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.143 0.689 17890 5500 1 7 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.385 -0.521 17890 5501 1 7 . 1 1 136 136 VAL H H 136 7.267 7.267 8.483 -1.216 17890 5502 1 7 . 1 1 137 137 SER N N 137 118.950 118.950 121.548 -2.598 17890 5503 1 7 . 1 1 137 137 SER HA H 137 4.887 4.887 5.021 -0.134 17890 5504 1 7 . 1 1 137 137 SER C C 137 173.780 173.780 173.047 0.733 17890 5505 1 7 . 1 1 137 137 SER CA C 137 57.895 57.895 56.789 1.106 17890 5506 1 7 . 1 1 137 137 SER CB C 137 65.027 65.027 66.858 -1.831 17890 5507 1 7 . 1 1 137 137 SER H H 137 8.454 8.454 8.400 0.054 17890 5508 1 7 . 1 1 138 138 ILE N N 138 123.511 123.511 119.834 3.677 17890 5509 1 7 . 1 1 138 138 ILE HA H 138 4.248 4.248 4.971 -0.723 17890 5510 1 7 . 1 1 138 138 ILE C C 138 176.142 176.142 175.612 0.530 17890 5511 1 7 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.477 1.373 17890 5512 1 7 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.626 -3.031 17890 5513 1 7 . 1 1 138 138 ILE H H 138 7.915 7.915 8.532 -0.617 17890 5514 1 7 . 1 1 139 139 GLY N N 139 115.638 115.638 110.870 4.768 17890 5515 1 7 . 1 1 139 139 GLY C C 139 171.947 171.947 173.276 -1.329 17890 5516 1 7 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.401 1.685 17890 5517 1 7 . 1 1 139 139 GLY H H 139 8.490 8.490 8.394 0.096 17890 5518 1 7 . 1 1 140 140 ALA N N 140 128.563 128.563 121.360 7.203 17890 5519 1 7 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.396 -0.000 17890 5520 1 7 . 1 1 140 140 ALA C C 140 177.956 177.956 177.184 0.772 17890 5521 1 7 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.632 -1.986 17890 5522 1 7 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.953 0.251 17890 5523 1 7 . 1 1 140 140 ALA H H 140 8.531 8.531 8.379 0.152 17890 5524 1 7 . 1 1 141 141 ASP N N 141 120.886 120.886 114.612 6.274 17890 5525 1 7 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.582 0.016 17890 5526 1 7 . 1 1 141 141 ASP C C 141 175.411 175.411 174.314 1.097 17890 5527 1 7 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.707 0.209 17890 5528 1 7 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.340 -1.648 17890 5529 1 7 . 1 1 141 141 ASP H H 141 8.507 8.507 7.682 0.825 17890 5530 1 7 . 1 1 142 142 ALA N N 142 125.604 125.604 123.237 2.367 17890 5531 1 7 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.656 -0.139 17890 5532 1 7 . 1 1 142 142 ALA C C 142 177.671 177.671 177.962 -0.291 17890 5533 1 7 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.658 0.335 17890 5534 1 7 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.267 0.268 17890 5535 1 7 . 1 1 142 142 ALA H H 142 7.894 7.894 8.177 -0.283 17890 5536 1 7 . 1 1 143 143 THR N N 143 118.085 118.085 117.419 0.666 17890 5537 1 7 . 1 1 143 143 THR HA H 143 3.744 3.744 4.112 -0.368 17890 5538 1 7 . 1 1 143 143 THR C C 143 175.464 175.464 175.087 0.377 17890 5539 1 7 . 1 1 143 143 THR CA C 143 64.548 64.548 65.038 -0.490 17890 5540 1 7 . 1 1 143 143 THR CB C 143 69.305 69.305 69.048 0.257 17890 5541 1 7 . 1 1 143 143 THR H H 143 8.268 8.268 8.889 -0.621 17890 5542 1 7 . 1 1 144 144 PHE N N 144 118.635 118.635 116.306 2.329 17890 5543 1 7 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.694 -0.348 17890 5544 1 7 . 1 1 144 144 PHE C C 144 176.209 176.209 175.123 1.086 17890 5545 1 7 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.895 3.567 17890 5546 1 7 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.237 0.367 17890 5547 1 7 . 1 1 144 144 PHE H H 144 8.719 8.719 7.990 0.729 17890 5548 1 7 . 1 1 145 145 SER N N 145 113.446 113.446 114.447 -1.001 17890 5549 1 7 . 1 1 145 145 SER HA H 145 4.866 4.866 4.043 0.823 17890 5550 1 7 . 1 1 145 145 SER C C 145 176.605 176.605 175.273 1.332 17890 5551 1 7 . 1 1 145 145 SER CA C 145 59.432 59.432 57.382 2.050 17890 5552 1 7 . 1 1 145 145 SER CB C 145 62.167 62.167 63.240 -1.073 17890 5553 1 7 . 1 1 145 145 SER H H 145 8.657 8.657 7.231 1.426 17890 5554 1 7 . 1 1 146 146 GLY N N 146 109.277 109.277 109.243 0.034 17890 5555 1 7 . 1 1 146 146 GLY C C 146 174.293 174.293 173.836 0.457 17890 5556 1 7 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.289 -0.349 17890 5557 1 7 . 1 1 146 146 GLY H H 146 7.467 7.467 7.543 -0.076 17890 5558 1 7 . 1 1 147 147 ARG N N 147 122.863 122.863 118.727 4.136 17890 5559 1 7 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.824 0.617 17890 5560 1 7 . 1 1 147 147 ARG C C 147 173.849 173.849 174.524 -0.675 17890 5561 1 7 . 1 1 147 147 ARG CA C 147 52.227 52.227 55.038 -2.812 17890 5562 1 7 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.883 -1.286 17890 5563 1 7 . 1 1 147 147 ARG H H 147 7.556 7.556 6.931 0.625 17890 5564 1 7 . 1 1 148 148 TRP N N 148 118.465 118.465 120.589 -2.124 17890 5565 1 7 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.181 -0.335 17890 5566 1 7 . 1 1 148 148 TRP C C 148 174.353 174.353 174.269 0.084 17890 5567 1 7 . 1 1 148 148 TRP CA C 148 55.662 55.662 57.002 -1.340 17890 5568 1 7 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.451 -1.452 17890 5569 1 7 . 1 1 148 148 TRP H H 148 8.709 8.709 9.308 -0.599 17890 5570 1 7 . 1 1 149 149 VAL N N 149 125.852 125.852 118.197 7.655 17890 5571 1 7 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.529 -0.386 17890 5572 1 7 . 1 1 149 149 VAL C C 149 173.613 173.613 173.347 0.266 17890 5573 1 7 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.897 1.843 17890 5574 1 7 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.178 -2.795 17890 5575 1 7 . 1 1 149 149 VAL H H 149 9.700 9.700 8.844 0.856 17890 5576 1 7 . 1 1 150 150 ILE N N 150 125.140 125.140 126.723 -1.583 17890 5577 1 7 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.086 -0.224 17890 5578 1 7 . 1 1 150 150 ILE C C 150 175.661 175.661 175.157 0.504 17890 5579 1 7 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.413 1.408 17890 5580 1 7 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.091 -0.271 17890 5581 1 7 . 1 1 150 150 ILE H H 150 7.747 7.747 7.931 -0.184 17890 5582 1 7 . 1 1 151 151 GLU N N 151 126.762 126.762 128.308 -1.546 17890 5583 1 7 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.792 0.088 17890 5584 1 7 . 1 1 151 151 GLU C C 151 174.424 174.424 174.946 -0.522 17890 5585 1 7 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.287 0.509 17890 5586 1 7 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.964 0.287 17890 5587 1 7 . 1 1 151 151 GLU H H 151 8.892 8.892 8.973 -0.081 17890 5588 1 7 . 1 1 152 152 LYS N N 152 126.299 126.299 123.126 3.173 17890 5589 1 7 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.814 0.047 17890 5590 1 7 . 1 1 152 152 LYS C C 152 176.282 176.282 176.757 -0.475 17890 5591 1 7 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.721 0.784 17890 5592 1 7 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.547 0.789 17890 5593 1 7 . 1 1 152 152 LYS H H 152 8.640 8.640 8.444 0.196 17890 5594 1 8 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.163 -1.869 17890 5595 1 8 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.893 -0.271 17890 5596 1 8 . 1 1 8 8 HIS CA C 8 55.661 55.661 55.722 -0.061 17890 5597 1 8 . 1 1 8 8 HIS CB C 8 29.880 29.880 32.065 -2.185 17890 5598 1 8 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.759 -0.113 17890 5599 1 8 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.225 -0.541 17890 5600 1 8 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.699 -0.868 17890 5601 1 8 . 1 1 10 10 HIS N N 10 120.811 120.811 117.996 2.815 17890 5602 1 8 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.796 -0.116 17890 5603 1 8 . 1 1 10 10 HIS C C 10 174.875 174.875 173.721 1.154 17890 5604 1 8 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.194 0.552 17890 5605 1 8 . 1 1 10 10 HIS CB C 10 29.889 29.889 30.041 -0.152 17890 5606 1 8 . 1 1 10 10 HIS H H 10 8.583 8.583 7.975 0.608 17890 5607 1 8 . 1 1 11 11 SER N N 11 118.009 118.009 114.981 3.028 17890 5608 1 8 . 1 1 11 11 SER HA H 11 4.424 4.424 4.408 0.016 17890 5609 1 8 . 1 1 11 11 SER C C 11 174.962 174.962 173.769 1.193 17890 5610 1 8 . 1 1 11 11 SER CA C 11 58.660 58.660 58.419 0.241 17890 5611 1 8 . 1 1 11 11 SER CB C 11 63.822 63.822 63.845 -0.023 17890 5612 1 8 . 1 1 11 11 SER H H 11 8.438 8.438 8.734 -0.296 17890 5613 1 8 . 1 1 12 12 GLY N N 12 111.011 111.011 110.024 0.987 17890 5614 1 8 . 1 1 12 12 GLY C C 12 173.907 173.907 172.429 1.478 17890 5615 1 8 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.345 0.076 17890 5616 1 8 . 1 1 12 12 GLY H H 12 8.433 8.433 7.799 0.634 17890 5617 1 8 . 1 1 13 13 ASP N N 13 120.291 120.291 118.576 1.715 17890 5618 1 8 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.906 -0.244 17890 5619 1 8 . 1 1 13 13 ASP C C 13 176.115 176.115 176.035 0.080 17890 5620 1 8 . 1 1 13 13 ASP CA C 13 54.303 54.303 54.468 -0.165 17890 5621 1 8 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.649 -0.184 17890 5622 1 8 . 1 1 13 13 ASP H H 13 8.153 8.153 8.674 -0.521 17890 5623 1 8 . 1 1 14 14 SER N N 14 116.987 116.987 114.999 1.988 17890 5624 1 8 . 1 1 14 14 SER HA H 14 4.754 4.754 4.684 0.070 17890 5625 1 8 . 1 1 14 14 SER CA C 14 56.469 56.469 56.304 0.165 17890 5626 1 8 . 1 1 14 14 SER CB C 14 63.553 63.553 64.487 -0.934 17890 5627 1 8 . 1 1 14 14 SER H H 14 8.210 8.210 7.578 0.632 17890 5628 1 8 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.358 0.084 17890 5629 1 8 . 1 1 15 15 PRO C C 15 176.424 176.424 175.854 0.570 17890 5630 1 8 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.124 0.109 17890 5631 1 8 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.040 0.108 17890 5632 1 8 . 1 1 16 16 ALA N N 16 124.219 124.219 126.880 -2.661 17890 5633 1 8 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.499 -0.149 17890 5634 1 8 . 1 1 16 16 ALA C C 16 177.552 177.552 176.955 0.597 17890 5635 1 8 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.112 0.320 17890 5636 1 8 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.588 -0.269 17890 5637 1 8 . 1 1 16 16 ALA H H 16 8.284 8.284 8.304 -0.020 17890 5638 1 8 . 1 1 17 17 VAL N N 17 119.504 119.504 119.606 -0.102 17890 5639 1 8 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.157 0.092 17890 5640 1 8 . 1 1 17 17 VAL C C 17 176.322 176.322 176.443 -0.121 17890 5641 1 8 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.482 -0.204 17890 5642 1 8 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.368 0.589 17890 5643 1 8 . 1 1 17 17 VAL H H 17 8.046 8.046 7.822 0.224 17890 5644 1 8 . 1 1 18 18 THR N N 18 118.186 118.186 116.885 1.301 17890 5645 1 8 . 1 1 18 18 THR HA H 18 4.473 4.473 4.527 -0.054 17890 5646 1 8 . 1 1 18 18 THR C C 18 174.248 174.248 174.608 -0.360 17890 5647 1 8 . 1 1 18 18 THR CA C 18 61.565 61.565 61.247 0.318 17890 5648 1 8 . 1 1 18 18 THR CB C 18 70.165 70.165 69.482 0.683 17890 5649 1 8 . 1 1 18 18 THR H H 18 8.276 8.276 8.300 -0.024 17890 5650 1 8 . 1 1 19 19 LEU N N 19 125.265 125.265 119.478 5.787 17890 5651 1 8 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.987 0.306 17890 5652 1 8 . 1 1 19 19 LEU C C 19 175.689 175.689 175.541 0.148 17890 5653 1 8 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.578 -0.151 17890 5654 1 8 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.106 2.172 17890 5655 1 8 . 1 1 19 19 LEU H H 19 8.091 8.091 8.287 -0.196 17890 5656 1 8 . 1 1 20 20 SER N N 20 114.622 114.622 114.499 0.123 17890 5657 1 8 . 1 1 20 20 SER HA H 20 4.947 4.947 4.846 0.101 17890 5658 1 8 . 1 1 20 20 SER C C 20 174.220 174.220 173.120 1.100 17890 5659 1 8 . 1 1 20 20 SER CA C 20 56.583 56.583 57.245 -0.661 17890 5660 1 8 . 1 1 20 20 SER CB C 20 65.653 65.653 64.892 0.761 17890 5661 1 8 . 1 1 20 20 SER H H 20 7.316 7.316 7.939 -0.623 17890 5662 1 8 . 1 1 21 21 ALA N N 21 125.517 125.517 123.697 1.820 17890 5663 1 8 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.991 -0.323 17890 5664 1 8 . 1 1 21 21 ALA C C 21 177.960 177.960 177.197 0.763 17890 5665 1 8 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.486 1.524 17890 5666 1 8 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.442 -0.217 17890 5667 1 8 . 1 1 21 21 ALA H H 21 8.993 8.993 8.482 0.511 17890 5668 1 8 . 1 1 22 22 GLY N N 22 109.543 109.543 112.418 -2.875 17890 5669 1 8 . 1 1 22 22 GLY C C 22 170.422 170.422 172.024 -1.602 17890 5670 1 8 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.046 0.335 17890 5671 1 8 . 1 1 22 22 GLY H H 22 8.411 8.411 8.958 -0.547 17890 5672 1 8 . 1 1 23 23 ASN N N 23 119.649 119.649 119.752 -0.103 17890 5673 1 8 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.653 0.234 17890 5674 1 8 . 1 1 23 23 ASN C C 23 175.207 175.207 174.626 0.581 17890 5675 1 8 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.830 -1.009 17890 5676 1 8 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.725 -0.970 17890 5677 1 8 . 1 1 23 23 ASN H H 23 8.092 8.092 8.422 -0.330 17890 5678 1 8 . 1 1 24 24 TYR N N 24 120.889 120.889 121.686 -0.797 17890 5679 1 8 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.188 0.067 17890 5680 1 8 . 1 1 24 24 TYR C C 24 175.667 175.667 174.624 1.043 17890 5681 1 8 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.187 0.926 17890 5682 1 8 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.598 0.228 17890 5683 1 8 . 1 1 24 24 TYR H H 24 9.914 9.914 8.994 0.920 17890 5684 1 8 . 1 1 25 25 ILE N N 25 115.978 115.978 114.144 1.834 17890 5685 1 8 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.013 0.073 17890 5686 1 8 . 1 1 25 25 ILE C C 25 175.200 175.200 174.332 0.868 17890 5687 1 8 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.823 0.722 17890 5688 1 8 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.306 -0.184 17890 5689 1 8 . 1 1 25 25 ILE H H 25 9.216 9.216 9.301 -0.085 17890 5690 1 8 . 1 1 26 26 ILE N N 26 123.957 123.957 123.014 0.943 17890 5691 1 8 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.263 -0.287 17890 5692 1 8 . 1 1 26 26 ILE C C 26 174.810 174.810 174.959 -0.149 17890 5693 1 8 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.219 0.390 17890 5694 1 8 . 1 1 26 26 ILE CB C 26 41.122 41.122 39.808 1.314 17890 5695 1 8 . 1 1 26 26 ILE H H 26 9.559 9.559 9.080 0.479 17890 5696 1 8 . 1 1 27 27 TYR N N 27 121.371 121.371 124.260 -2.889 17890 5697 1 8 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.550 0.640 17890 5698 1 8 . 1 1 27 27 TYR C C 27 173.963 173.963 173.592 0.371 17890 5699 1 8 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.912 -0.243 17890 5700 1 8 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.904 0.794 17890 5701 1 8 . 1 1 27 27 TYR H H 27 9.378 9.378 9.056 0.322 17890 5702 1 8 . 1 1 28 28 ASN N N 28 121.991 121.991 120.660 1.331 17890 5703 1 8 . 1 1 28 28 ASN HA H 28 3.768 3.768 3.826 -0.058 17890 5704 1 8 . 1 1 28 28 ASN C C 28 174.352 174.352 175.622 -1.270 17890 5705 1 8 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.640 1.480 17890 5706 1 8 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.884 1.562 17890 5707 1 8 . 1 1 28 28 ASN H H 28 8.466 8.466 8.278 0.188 17890 5708 1 8 . 1 1 29 29 ARG N N 29 121.103 121.103 123.596 -2.493 17890 5709 1 8 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.093 -0.232 17890 5710 1 8 . 1 1 29 29 ARG C C 29 173.635 173.635 176.490 -2.855 17890 5711 1 8 . 1 1 29 29 ARG CA C 29 59.293 59.293 56.847 2.446 17890 5712 1 8 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.116 0.283 17890 5713 1 8 . 1 1 29 29 ARG H H 29 7.756 7.756 7.826 -0.070 17890 5714 1 8 . 1 1 30 30 VAL N N 30 118.412 118.412 118.854 -0.442 17890 5715 1 8 . 1 1 30 30 VAL HA H 30 3.944 3.944 4.167 -0.223 17890 5716 1 8 . 1 1 30 30 VAL C C 30 176.199 176.199 174.491 1.708 17890 5717 1 8 . 1 1 30 30 VAL CA C 30 62.577 62.577 61.392 1.185 17890 5718 1 8 . 1 1 30 30 VAL CB C 30 30.222 30.222 34.056 -3.834 17890 5719 1 8 . 1 1 30 30 VAL H H 30 8.976 8.976 7.826 1.150 17890 5720 1 8 . 1 1 31 31 LEU N N 31 125.418 125.418 123.559 1.859 17890 5721 1 8 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.668 -0.182 17890 5722 1 8 . 1 1 31 31 LEU C C 31 179.123 179.123 176.236 2.887 17890 5723 1 8 . 1 1 31 31 LEU CA C 31 54.025 54.025 52.661 1.364 17890 5724 1 8 . 1 1 31 31 LEU CB C 31 45.581 45.581 43.573 2.008 17890 5725 1 8 . 1 1 31 31 LEU H H 31 8.856 8.856 8.101 0.755 17890 5726 1 8 . 1 1 32 32 SER N N 32 116.890 116.890 116.141 0.749 17890 5727 1 8 . 1 1 32 32 SER HA H 32 5.365 5.365 4.790 0.575 17890 5728 1 8 . 1 1 32 32 SER CA C 32 57.269 57.269 56.205 1.064 17890 5729 1 8 . 1 1 32 32 SER CB C 32 62.213 62.213 64.379 -2.166 17890 5730 1 8 . 1 1 32 32 SER H H 32 9.307 9.307 8.513 0.794 17890 5731 1 8 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.364 -0.484 17890 5732 1 8 . 1 1 33 33 PRO C C 33 175.137 175.137 177.278 -2.141 17890 5733 1 8 . 1 1 33 33 PRO CA C 33 65.285 65.285 63.944 1.341 17890 5734 1 8 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.567 0.464 17890 5735 1 8 . 1 1 34 34 ARG N N 34 110.279 110.279 119.754 -9.475 17890 5736 1 8 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.128 0.364 17890 5737 1 8 . 1 1 34 34 ARG C C 34 176.844 176.844 177.333 -0.489 17890 5738 1 8 . 1 1 34 34 ARG CA C 34 54.436 54.436 56.192 -1.756 17890 5739 1 8 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.154 0.430 17890 5740 1 8 . 1 1 34 34 ARG H H 34 7.257 7.257 7.702 -0.445 17890 5741 1 8 . 1 1 35 35 GLY N N 35 110.288 110.288 106.127 4.161 17890 5742 1 8 . 1 1 35 35 GLY C C 35 173.336 173.336 173.894 -0.558 17890 5743 1 8 . 1 1 35 35 GLY CA C 35 47.030 47.030 45.025 2.005 17890 5744 1 8 . 1 1 35 35 GLY H H 35 8.589 8.589 7.803 0.786 17890 5745 1 8 . 1 1 36 36 GLU N N 36 116.838 116.838 119.215 -2.377 17890 5746 1 8 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.671 -0.323 17890 5747 1 8 . 1 1 36 36 GLU C C 36 176.915 176.915 174.987 1.928 17890 5748 1 8 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.007 0.900 17890 5749 1 8 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.586 -2.171 17890 5750 1 8 . 1 1 36 36 GLU H H 36 7.769 7.769 7.874 -0.105 17890 5751 1 8 . 1 1 37 37 LYS N N 37 123.775 123.775 121.563 2.212 17890 5752 1 8 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.174 0.249 17890 5753 1 8 . 1 1 37 37 LYS C C 37 176.067 176.067 175.241 0.826 17890 5754 1 8 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.498 -0.597 17890 5755 1 8 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.770 0.903 17890 5756 1 8 . 1 1 37 37 LYS H H 37 8.667 8.667 8.628 0.039 17890 5757 1 8 . 1 1 38 38 LEU N N 38 126.658 126.658 125.940 0.718 17890 5758 1 8 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.979 -0.752 17890 5759 1 8 . 1 1 38 38 LEU C C 38 174.332 174.332 174.888 -0.556 17890 5760 1 8 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.847 -0.505 17890 5761 1 8 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.269 -0.618 17890 5762 1 8 . 1 1 38 38 LEU H H 38 10.455 10.455 8.847 1.608 17890 5763 1 8 . 1 1 39 39 ALA N N 39 127.018 127.018 127.687 -0.669 17890 5764 1 8 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.316 -0.087 17890 5765 1 8 . 1 1 39 39 ALA C C 39 178.694 178.694 175.940 2.754 17890 5766 1 8 . 1 1 39 39 ALA CA C 39 50.225 50.225 49.956 0.269 17890 5767 1 8 . 1 1 39 39 ALA CB C 39 21.349 21.349 21.957 -0.608 17890 5768 1 8 . 1 1 39 39 ALA H H 39 8.773 8.773 8.771 0.002 17890 5769 1 8 . 1 1 40 40 LEU N N 40 126.771 126.771 123.048 3.723 17890 5770 1 8 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.536 -0.182 17890 5771 1 8 . 1 1 40 40 LEU C C 40 178.309 178.309 176.589 1.720 17890 5772 1 8 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.083 0.762 17890 5773 1 8 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.877 0.446 17890 5774 1 8 . 1 1 40 40 LEU H H 40 9.665 9.665 8.678 0.987 17890 5775 1 8 . 1 1 41 41 THR N N 41 126.578 126.578 124.728 1.850 17890 5776 1 8 . 1 1 41 41 THR HA H 41 4.916 4.916 5.163 -0.247 17890 5777 1 8 . 1 1 41 41 THR C C 41 172.547 172.547 173.421 -0.874 17890 5778 1 8 . 1 1 41 41 THR CA C 41 63.253 63.253 61.684 1.569 17890 5779 1 8 . 1 1 41 41 THR CB C 41 71.832 71.832 70.889 0.943 17890 5780 1 8 . 1 1 41 41 THR H H 41 9.802 9.802 9.161 0.641 17890 5781 1 8 . 1 1 42 42 TYR N N 42 130.506 130.506 129.228 1.278 17890 5782 1 8 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.658 0.444 17890 5783 1 8 . 1 1 42 42 TYR CA C 42 53.986 53.986 58.372 -4.386 17890 5784 1 8 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.060 0.095 17890 5785 1 8 . 1 1 42 42 TYR H H 42 9.428 9.428 9.085 0.343 17890 5786 1 8 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.318 0.172 17890 5787 1 8 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.212 0.360 17890 5788 1 8 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.284 0.360 17890 5789 1 8 . 1 1 44 44 GLY N N 44 113.736 113.736 104.416 9.320 17890 5790 1 8 . 1 1 44 44 GLY C C 44 171.790 171.790 173.411 -1.621 17890 5791 1 8 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.130 0.586 17890 5792 1 8 . 1 1 44 44 GLY H H 44 8.337 8.337 7.840 0.497 17890 5793 1 8 . 1 1 45 45 ARG N N 45 113.899 113.899 116.354 -2.455 17890 5794 1 8 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.532 0.044 17890 5795 1 8 . 1 1 45 45 ARG C C 45 175.151 175.151 173.470 1.681 17890 5796 1 8 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.095 0.070 17890 5797 1 8 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.641 1.578 17890 5798 1 8 . 1 1 45 45 ARG H H 45 6.463 6.463 7.395 -0.932 17890 5799 1 8 . 1 1 46 46 GLN N N 46 119.000 119.000 117.984 1.016 17890 5800 1 8 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.478 -0.029 17890 5801 1 8 . 1 1 46 46 GLN C C 46 177.282 177.282 176.587 0.695 17890 5802 1 8 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.247 1.366 17890 5803 1 8 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.895 0.601 17890 5804 1 8 . 1 1 46 46 GLN H H 46 8.683 8.683 8.581 0.102 17890 5805 1 8 . 1 1 47 47 ARG N N 47 113.526 113.526 118.171 -4.645 17890 5806 1 8 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.033 -0.503 17890 5807 1 8 . 1 1 47 47 ARG C C 47 174.130 174.130 175.388 -1.258 17890 5808 1 8 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.454 1.362 17890 5809 1 8 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.014 2.056 17890 5810 1 8 . 1 1 47 47 ARG H H 47 9.677 9.677 8.547 1.130 17890 5811 1 8 . 1 1 48 48 THR N N 48 114.672 114.672 114.931 -0.259 17890 5812 1 8 . 1 1 48 48 THR HA H 48 4.938 4.938 4.710 0.228 17890 5813 1 8 . 1 1 48 48 THR CA C 48 59.987 59.987 59.344 0.643 17890 5814 1 8 . 1 1 48 48 THR CB C 48 71.947 71.947 71.224 0.723 17890 5815 1 8 . 1 1 48 48 THR H H 48 8.104 8.104 7.480 0.624 17890 5816 1 8 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.663 -0.295 17890 5817 1 8 . 1 1 49 49 PRO C C 49 175.651 175.651 176.288 -0.637 17890 5818 1 8 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.056 1.125 17890 5819 1 8 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.217 0.480 17890 5820 1 8 . 1 1 50 50 VAL N N 50 122.562 122.562 120.087 2.475 17890 5821 1 8 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.259 -0.312 17890 5822 1 8 . 1 1 50 50 VAL C C 50 174.493 174.493 175.581 -1.088 17890 5823 1 8 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.212 2.599 17890 5824 1 8 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.655 -2.487 17890 5825 1 8 . 1 1 50 50 VAL H H 50 8.123 8.123 8.508 -0.385 17890 5826 1 8 . 1 1 51 51 THR N N 51 113.549 113.549 118.771 -5.222 17890 5827 1 8 . 1 1 51 51 THR HA H 51 5.372 5.372 4.751 0.621 17890 5828 1 8 . 1 1 51 51 THR C C 51 174.841 174.841 172.510 2.331 17890 5829 1 8 . 1 1 51 51 THR CA C 51 59.196 59.196 60.781 -1.585 17890 5830 1 8 . 1 1 51 51 THR CB C 51 72.703 72.703 71.948 0.755 17890 5831 1 8 . 1 1 51 51 THR H H 51 7.057 7.057 8.176 -1.119 17890 5832 1 8 . 1 1 52 52 VAL N N 52 107.374 107.374 120.356 -12.982 17890 5833 1 8 . 1 1 52 52 VAL HA H 52 5.514 5.514 4.981 0.533 17890 5834 1 8 . 1 1 52 52 VAL C C 52 175.697 175.697 173.959 1.738 17890 5835 1 8 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.905 -1.433 17890 5836 1 8 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.365 -0.591 17890 5837 1 8 . 1 1 52 52 VAL H H 52 8.062 8.062 8.509 -0.447 17890 5838 1 8 . 1 1 53 53 SER N N 53 114.662 114.662 121.917 -7.255 17890 5839 1 8 . 1 1 53 53 SER HA H 53 4.690 4.690 4.973 -0.283 17890 5840 1 8 . 1 1 53 53 SER CA C 53 56.828 56.828 55.953 0.875 17890 5841 1 8 . 1 1 53 53 SER CB C 53 64.789 64.789 65.674 -0.885 17890 5842 1 8 . 1 1 53 53 SER H H 53 8.681 8.681 9.076 -0.395 17890 5843 1 8 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.720 0.056 17890 5844 1 8 . 1 1 54 54 PRO C C 54 177.724 177.724 175.969 1.755 17890 5845 1 8 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.251 0.174 17890 5846 1 8 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.325 -0.228 17890 5847 1 8 . 1 1 55 55 LEU N N 55 128.655 128.655 123.350 5.305 17890 5848 1 8 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.572 -0.045 17890 5849 1 8 . 1 1 55 55 LEU C C 55 178.696 178.696 175.719 2.977 17890 5850 1 8 . 1 1 55 55 LEU CA C 55 56.246 56.246 54.233 2.013 17890 5851 1 8 . 1 1 55 55 LEU CB C 55 43.606 43.606 44.455 -0.849 17890 5852 1 8 . 1 1 55 55 LEU H H 55 8.675 8.675 8.195 0.480 17890 5853 1 8 . 1 1 56 56 ASP N N 56 126.651 126.651 125.068 1.583 17890 5854 1 8 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.800 -0.091 17890 5855 1 8 . 1 1 56 56 ASP C C 56 177.729 177.729 176.802 0.927 17890 5856 1 8 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.679 -1.056 17890 5857 1 8 . 1 1 56 56 ASP CB C 56 41.632 41.632 44.628 -2.996 17890 5858 1 8 . 1 1 56 56 ASP H H 56 9.683 9.683 9.637 0.046 17890 5859 1 8 . 1 1 57 57 GLY N N 57 109.299 109.299 109.444 -0.145 17890 5860 1 8 . 1 1 57 57 GLY C C 57 174.558 174.558 174.190 0.368 17890 5861 1 8 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.911 1.044 17890 5862 1 8 . 1 1 57 57 GLY H H 57 8.157 8.157 8.894 -0.737 17890 5863 1 8 . 1 1 58 58 SER N N 58 116.740 116.740 115.866 0.874 17890 5864 1 8 . 1 1 58 58 SER HA H 58 4.288 4.288 4.586 -0.298 17890 5865 1 8 . 1 1 58 58 SER C C 58 177.252 177.252 175.726 1.526 17890 5866 1 8 . 1 1 58 58 SER CA C 58 58.737 58.737 57.404 1.333 17890 5867 1 8 . 1 1 58 58 SER CB C 58 64.576 64.576 64.727 -0.151 17890 5868 1 8 . 1 1 58 58 SER H H 58 8.328 8.328 7.798 0.530 17890 5869 1 8 . 1 1 59 59 SER N N 59 119.768 119.768 116.398 3.370 17890 5870 1 8 . 1 1 59 59 SER HA H 59 4.046 4.046 4.146 -0.100 17890 5871 1 8 . 1 1 59 59 SER C C 59 176.671 176.671 175.623 1.048 17890 5872 1 8 . 1 1 59 59 SER CA C 59 61.691 61.691 60.119 1.572 17890 5873 1 8 . 1 1 59 59 SER CB C 59 63.154 63.154 62.884 0.270 17890 5874 1 8 . 1 1 59 59 SER H H 59 9.020 9.020 8.765 0.255 17890 5875 1 8 . 1 1 60 60 GLU N N 60 119.133 119.133 119.988 -0.855 17890 5876 1 8 . 1 1 60 60 GLU HA H 60 4.186 4.186 3.953 0.233 17890 5877 1 8 . 1 1 60 60 GLU C C 60 177.435 177.435 176.980 0.455 17890 5878 1 8 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.584 1.449 17890 5879 1 8 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.668 -1.442 17890 5880 1 8 . 1 1 60 60 GLU H H 60 8.832 8.832 7.946 0.886 17890 5881 1 8 . 1 1 61 61 GLN N N 61 118.818 118.818 114.412 4.406 17890 5882 1 8 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.926 0.251 17890 5883 1 8 . 1 1 61 61 GLN C C 61 173.254 173.254 174.538 -1.284 17890 5884 1 8 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.572 -0.199 17890 5885 1 8 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.172 -2.250 17890 5886 1 8 . 1 1 61 61 GLN H H 61 7.648 7.648 7.543 0.105 17890 5887 1 8 . 1 1 62 62 ALA N N 62 122.562 122.562 122.622 -0.060 17890 5888 1 8 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.523 0.541 17890 5889 1 8 . 1 1 62 62 ALA C C 62 176.637 176.637 175.057 1.580 17890 5890 1 8 . 1 1 62 62 ALA CA C 62 51.179 51.179 50.859 0.320 17890 5891 1 8 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.543 -0.948 17890 5892 1 8 . 1 1 62 62 ALA H H 62 7.315 7.315 6.710 0.605 17890 5893 1 8 . 1 1 63 63 TRP N N 63 124.787 124.787 119.490 5.297 17890 5894 1 8 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.373 -0.409 17890 5895 1 8 . 1 1 63 63 TRP C C 63 174.351 174.351 175.413 -1.062 17890 5896 1 8 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.025 -0.123 17890 5897 1 8 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.876 -1.759 17890 5898 1 8 . 1 1 63 63 TRP H H 63 9.544 9.544 9.101 0.443 17890 5899 1 8 . 1 1 64 64 ILE N N 64 122.482 122.482 119.182 3.300 17890 5900 1 8 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.961 -0.267 17890 5901 1 8 . 1 1 64 64 ILE C C 64 177.078 177.078 174.201 2.877 17890 5902 1 8 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.612 0.419 17890 5903 1 8 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.427 -1.058 17890 5904 1 8 . 1 1 64 64 ILE H H 64 10.235 10.235 9.411 0.824 17890 5905 1 8 . 1 1 65 65 LEU N N 65 132.183 132.183 128.911 3.272 17890 5906 1 8 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.533 -0.068 17890 5907 1 8 . 1 1 65 65 LEU C C 65 177.048 177.048 174.459 2.589 17890 5908 1 8 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.786 0.563 17890 5909 1 8 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.051 -3.707 17890 5910 1 8 . 1 1 65 65 LEU H H 65 9.432 9.432 9.355 0.077 17890 5911 1 8 . 1 1 66 66 ARG N N 66 120.807 120.807 125.931 -5.124 17890 5912 1 8 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.965 -0.077 17890 5913 1 8 . 1 1 66 66 ARG C C 66 175.275 175.275 174.454 0.821 17890 5914 1 8 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.493 0.562 17890 5915 1 8 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.407 -1.416 17890 5916 1 8 . 1 1 66 66 ARG H H 66 8.491 8.491 8.564 -0.073 17890 5917 1 8 . 1 1 67 67 SER N N 67 119.709 119.709 116.615 3.094 17890 5918 1 8 . 1 1 67 67 SER HA H 67 3.186 3.186 3.360 -0.174 17890 5919 1 8 . 1 1 67 67 SER C C 67 174.508 174.508 173.363 1.145 17890 5920 1 8 . 1 1 67 67 SER CA C 67 58.521 58.521 59.109 -0.588 17890 5921 1 8 . 1 1 67 67 SER CB C 67 62.590 62.590 63.434 -0.845 17890 5922 1 8 . 1 1 67 67 SER H H 67 8.557 8.557 8.677 -0.120 17890 5923 1 8 . 1 1 68 68 TYR N N 68 131.011 131.011 127.020 3.991 17890 5924 1 8 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.545 -0.097 17890 5925 1 8 . 1 1 68 68 TYR C C 68 174.687 174.687 174.784 -0.097 17890 5926 1 8 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.488 0.277 17890 5927 1 8 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.342 -2.354 17890 5928 1 8 . 1 1 68 68 TYR H H 68 8.531 8.531 8.520 0.011 17890 5929 1 8 . 1 1 69 69 ASP N N 69 117.066 117.066 120.381 -3.315 17890 5930 1 8 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.847 -0.222 17890 5931 1 8 . 1 1 69 69 ASP C C 69 176.455 176.455 176.166 0.289 17890 5932 1 8 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.783 -0.692 17890 5933 1 8 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.701 -0.554 17890 5934 1 8 . 1 1 69 69 ASP H H 69 7.122 7.122 7.609 -0.487 17890 5935 1 8 . 1 1 70 70 SER N N 70 122.869 122.869 119.527 3.342 17890 5936 1 8 . 1 1 70 70 SER HA H 70 4.270 4.270 4.134 0.136 17890 5937 1 8 . 1 1 70 70 SER C C 70 177.010 177.010 176.018 0.992 17890 5938 1 8 . 1 1 70 70 SER CA C 70 60.837 60.837 61.628 -0.791 17890 5939 1 8 . 1 1 70 70 SER CB C 70 62.722 62.722 63.235 -0.513 17890 5940 1 8 . 1 1 70 70 SER H H 70 8.757 8.757 8.748 0.009 17890 5941 1 8 . 1 1 71 71 ASN N N 71 119.873 119.873 118.789 1.084 17890 5942 1 8 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.582 -0.011 17890 5943 1 8 . 1 1 71 71 ASN C C 71 176.226 176.226 176.022 0.204 17890 5944 1 8 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.228 0.486 17890 5945 1 8 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.316 0.325 17890 5946 1 8 . 1 1 71 71 ASN H H 71 8.342 8.342 8.521 -0.179 17890 5947 1 8 . 1 1 72 72 SER N N 72 112.202 112.202 113.009 -0.807 17890 5948 1 8 . 1 1 72 72 SER HA H 72 4.567 4.567 4.716 -0.149 17890 5949 1 8 . 1 1 72 72 SER C C 72 173.789 173.789 173.256 0.533 17890 5950 1 8 . 1 1 72 72 SER CA C 72 57.816 57.816 56.891 0.925 17890 5951 1 8 . 1 1 72 72 SER CB C 72 63.935 63.935 63.966 -0.031 17890 5952 1 8 . 1 1 72 72 SER H H 72 7.560 7.560 7.774 -0.214 17890 5953 1 8 . 1 1 73 73 ASN N N 73 117.437 117.437 118.842 -1.405 17890 5954 1 8 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.412 0.122 17890 5955 1 8 . 1 1 73 73 ASN C C 73 173.647 173.647 174.281 -0.634 17890 5956 1 8 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.427 0.096 17890 5957 1 8 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.009 0.204 17890 5958 1 8 . 1 1 73 73 ASN H H 73 7.940 7.940 7.900 0.040 17890 5959 1 8 . 1 1 74 74 THR N N 74 104.227 104.227 109.529 -5.302 17890 5960 1 8 . 1 1 74 74 THR HA H 74 5.477 5.477 4.992 0.485 17890 5961 1 8 . 1 1 74 74 THR C C 74 176.824 176.824 173.953 2.871 17890 5962 1 8 . 1 1 74 74 THR CA C 74 59.768 59.768 61.672 -1.905 17890 5963 1 8 . 1 1 74 74 THR CB C 74 71.985 71.985 70.048 1.937 17890 5964 1 8 . 1 1 74 74 THR H H 74 7.737 7.737 7.838 -0.101 17890 5965 1 8 . 1 1 75 75 TRP N N 75 124.636 124.636 123.450 1.186 17890 5966 1 8 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.393 -0.186 17890 5967 1 8 . 1 1 75 75 TRP C C 75 175.876 175.876 176.172 -0.296 17890 5968 1 8 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.149 1.457 17890 5969 1 8 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.680 -0.164 17890 5970 1 8 . 1 1 75 75 TRP H H 75 9.442 9.442 9.095 0.347 17890 5971 1 8 . 1 1 76 76 THR N N 76 110.544 110.544 115.059 -4.515 17890 5972 1 8 . 1 1 76 76 THR HA H 76 5.129 5.129 5.074 0.055 17890 5973 1 8 . 1 1 76 76 THR C C 76 174.506 174.506 174.304 0.202 17890 5974 1 8 . 1 1 76 76 THR CA C 76 60.561 60.561 61.658 -1.097 17890 5975 1 8 . 1 1 76 76 THR CB C 76 71.688 71.688 70.165 1.523 17890 5976 1 8 . 1 1 76 76 THR H H 76 9.415 9.415 9.389 0.026 17890 5977 1 8 . 1 1 77 77 ILE N N 77 121.567 121.567 124.191 -2.624 17890 5978 1 8 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.196 -0.057 17890 5979 1 8 . 1 1 77 77 ILE C C 77 176.148 176.148 175.054 1.094 17890 5980 1 8 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.802 1.906 17890 5981 1 8 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.741 1.246 17890 5982 1 8 . 1 1 77 77 ILE H H 77 9.255 9.255 8.297 0.958 17890 5983 1 8 . 1 1 78 78 SER N N 78 122.269 122.269 121.822 0.447 17890 5984 1 8 . 1 1 78 78 SER HA H 78 5.601 5.601 5.271 0.330 17890 5985 1 8 . 1 1 78 78 SER CA C 78 55.835 55.835 55.822 0.013 17890 5986 1 8 . 1 1 78 78 SER CB C 78 65.858 65.858 66.274 -0.416 17890 5987 1 8 . 1 1 78 78 SER H H 78 9.226 9.226 8.725 0.501 17890 5988 1 8 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.186 -0.322 17890 5989 1 8 . 1 1 79 79 PRO C C 79 178.175 178.175 176.503 1.672 17890 5990 1 8 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.275 0.609 17890 5991 1 8 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.077 -1.805 17890 5992 1 8 . 1 1 80 80 VAL N N 80 121.906 121.906 119.858 2.048 17890 5993 1 8 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.742 -0.161 17890 5994 1 8 . 1 1 80 80 VAL C C 80 177.751 177.751 177.253 0.498 17890 5995 1 8 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.789 1.278 17890 5996 1 8 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.507 -0.022 17890 5997 1 8 . 1 1 80 80 VAL H H 80 7.328 7.328 7.988 -0.660 17890 5998 1 8 . 1 1 81 81 GLY N N 81 104.643 104.643 106.514 -1.871 17890 5999 1 8 . 1 1 81 81 GLY C C 81 174.979 174.979 174.521 0.458 17890 6000 1 8 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.581 -0.493 17890 6001 1 8 . 1 1 81 81 GLY H H 81 8.949 8.949 7.426 1.523 17890 6002 1 8 . 1 1 82 82 SER N N 82 111.865 111.865 114.988 -3.123 17890 6003 1 8 . 1 1 82 82 SER HA H 82 4.646 4.646 4.856 -0.210 17890 6004 1 8 . 1 1 82 82 SER CA C 82 55.441 55.441 55.830 -0.389 17890 6005 1 8 . 1 1 82 82 SER CB C 82 62.277 62.277 63.421 -1.144 17890 6006 1 8 . 1 1 82 82 SER H H 82 6.968 6.968 7.208 -0.240 17890 6007 1 8 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.611 -0.264 17890 6008 1 8 . 1 1 83 83 PRO C C 83 176.660 176.660 176.809 -0.149 17890 6009 1 8 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.451 0.752 17890 6010 1 8 . 1 1 83 83 PRO CB C 83 32.819 32.819 32.017 0.802 17890 6011 1 8 . 1 1 84 84 ASN N N 84 116.542 116.542 114.275 2.267 17890 6012 1 8 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.555 0.446 17890 6013 1 8 . 1 1 84 84 ASN C C 84 175.825 175.825 174.829 0.996 17890 6014 1 8 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.648 -0.757 17890 6015 1 8 . 1 1 84 84 ASN CB C 84 38.744 38.744 37.993 0.751 17890 6016 1 8 . 1 1 84 84 ASN H H 84 8.502 8.502 8.355 0.147 17890 6017 1 8 . 1 1 85 85 SER N N 85 114.633 114.633 113.096 1.537 17890 6018 1 8 . 1 1 85 85 SER HA H 85 4.624 4.624 4.865 -0.241 17890 6019 1 8 . 1 1 85 85 SER C C 85 172.963 172.963 172.558 0.405 17890 6020 1 8 . 1 1 85 85 SER CA C 85 59.210 59.210 57.322 1.888 17890 6021 1 8 . 1 1 85 85 SER CB C 85 64.697 64.697 66.087 -1.390 17890 6022 1 8 . 1 1 85 85 SER H H 85 7.980 7.980 7.665 0.315 17890 6023 1 8 . 1 1 86 86 GLN N N 86 119.016 119.016 116.918 2.098 17890 6024 1 8 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.325 0.121 17890 6025 1 8 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.397 0.055 17890 6026 1 8 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.355 0.043 17890 6027 1 8 . 1 1 86 86 GLN H H 86 9.399 9.399 8.944 0.455 17890 6028 1 8 . 1 1 87 87 ILE N N 87 119.691 119.691 119.111 0.580 17890 6029 1 8 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.221 -0.646 17890 6030 1 8 . 1 1 87 87 ILE C C 87 176.505 176.505 176.091 0.414 17890 6031 1 8 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.965 4.529 17890 6032 1 8 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.113 -0.916 17890 6033 1 8 . 1 1 87 87 ILE H H 87 8.970 8.970 8.344 0.626 17890 6034 1 8 . 1 1 88 88 GLY N N 88 118.378 118.378 114.663 3.715 17890 6035 1 8 . 1 1 88 88 GLY C C 88 171.397 171.397 171.687 -0.290 17890 6036 1 8 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.173 -1.569 17890 6037 1 8 . 1 1 88 88 GLY H H 88 9.752 9.752 9.215 0.537 17890 6038 1 8 . 1 1 89 89 TRP N N 89 122.749 122.749 122.193 0.556 17890 6039 1 8 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.461 -0.863 17890 6040 1 8 . 1 1 89 89 TRP C C 89 175.924 175.924 174.820 1.104 17890 6041 1 8 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.885 0.398 17890 6042 1 8 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.302 -2.216 17890 6043 1 8 . 1 1 89 89 TRP H H 89 8.215 8.215 8.215 0.000 17890 6044 1 8 . 1 1 90 90 GLY N N 90 116.305 116.305 111.316 4.989 17890 6045 1 8 . 1 1 90 90 GLY C C 90 173.725 173.725 172.474 1.251 17890 6046 1 8 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.513 0.542 17890 6047 1 8 . 1 1 90 90 GLY H H 90 8.922 8.922 8.303 0.619 17890 6048 1 8 . 1 1 91 91 ALA N N 91 123.795 123.795 122.047 1.748 17890 6049 1 8 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.148 0.095 17890 6050 1 8 . 1 1 91 91 ALA C C 91 178.510 178.510 178.946 -0.436 17890 6051 1 8 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.443 0.047 17890 6052 1 8 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.799 -0.390 17890 6053 1 8 . 1 1 91 91 ALA H H 91 8.367 8.367 8.169 0.198 17890 6054 1 8 . 1 1 92 92 GLY N N 92 108.871 108.871 112.826 -3.955 17890 6055 1 8 . 1 1 92 92 GLY C C 92 174.528 174.528 174.844 -0.316 17890 6056 1 8 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.711 0.547 17890 6057 1 8 . 1 1 92 92 GLY H H 92 8.776 8.776 8.612 0.164 17890 6058 1 8 . 1 1 93 93 ASN N N 93 114.921 114.921 117.216 -2.295 17890 6059 1 8 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.772 -0.323 17890 6060 1 8 . 1 1 93 93 ASN C C 93 172.774 172.774 174.116 -1.342 17890 6061 1 8 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.381 0.592 17890 6062 1 8 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.936 -0.607 17890 6063 1 8 . 1 1 93 93 ASN H H 93 8.647 8.647 8.285 0.362 17890 6064 1 8 . 1 1 94 94 VAL N N 94 112.437 112.437 112.937 -0.500 17890 6065 1 8 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.654 0.411 17890 6066 1 8 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.406 -1.491 17890 6067 1 8 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.372 -0.217 17890 6068 1 8 . 1 1 94 94 VAL H H 94 6.989 6.989 7.465 -0.476 17890 6069 1 8 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.972 -0.044 17890 6070 1 8 . 1 1 95 95 PRO C C 95 176.041 176.041 175.999 0.042 17890 6071 1 8 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.523 -1.322 17890 6072 1 8 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.550 -0.825 17890 6073 1 8 . 1 1 96 96 VAL N N 96 113.564 113.564 117.052 -3.488 17890 6074 1 8 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.855 -0.120 17890 6075 1 8 . 1 1 96 96 VAL C C 96 173.656 173.656 174.951 -1.295 17890 6076 1 8 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.074 -0.221 17890 6077 1 8 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.353 1.800 17890 6078 1 8 . 1 1 96 96 VAL H H 96 8.199 8.199 8.879 -0.680 17890 6079 1 8 . 1 1 97 97 VAL N N 97 122.328 122.328 123.722 -1.394 17890 6080 1 8 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.729 -0.098 17890 6081 1 8 . 1 1 97 97 VAL C C 97 174.776 174.776 175.807 -1.031 17890 6082 1 8 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.296 0.361 17890 6083 1 8 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.913 -0.785 17890 6084 1 8 . 1 1 97 97 VAL H H 97 8.957 8.957 8.505 0.452 17890 6085 1 8 . 1 1 98 98 LEU N N 98 130.258 130.258 125.601 4.657 17890 6086 1 8 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.959 0.091 17890 6087 1 8 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.622 1.201 17890 6088 1 8 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.144 0.974 17890 6089 1 8 . 1 1 98 98 LEU H H 98 9.245 9.245 9.142 0.103 17890 6090 1 8 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.787 -0.008 17890 6091 1 8 . 1 1 99 99 PRO CA C 99 61.489 61.489 60.984 0.505 17890 6092 1 8 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.054 -0.600 17890 6093 1 8 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.630 -0.645 17890 6094 1 8 . 1 1 100 100 PRO C C 100 177.309 177.309 175.761 1.548 17890 6095 1 8 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.094 0.730 17890 6096 1 8 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.238 -0.133 17890 6097 1 8 . 1 1 101 101 ASN N N 101 119.284 119.284 125.885 -6.601 17890 6098 1 8 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.627 -0.085 17890 6099 1 8 . 1 1 101 101 ASN C C 101 171.920 171.920 173.877 -1.957 17890 6100 1 8 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.768 -0.568 17890 6101 1 8 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.454 -1.829 17890 6102 1 8 . 1 1 101 101 ASN H H 101 7.273 7.273 9.404 -2.131 17890 6103 1 8 . 1 1 102 102 ASN N N 102 115.674 115.674 116.209 -0.535 17890 6104 1 8 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.718 -0.800 17890 6105 1 8 . 1 1 102 102 ASN C C 102 173.264 173.264 174.284 -1.020 17890 6106 1 8 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.777 1.262 17890 6107 1 8 . 1 1 102 102 ASN CB C 102 36.982 36.982 37.983 -1.001 17890 6108 1 8 . 1 1 102 102 ASN H H 102 8.197 8.197 7.744 0.453 17890 6109 1 8 . 1 1 103 103 TYR N N 103 118.775 118.775 121.567 -2.792 17890 6110 1 8 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.361 0.124 17890 6111 1 8 . 1 1 103 103 TYR C C 103 175.248 175.248 174.847 0.401 17890 6112 1 8 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.896 -2.406 17890 6113 1 8 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.535 -1.003 17890 6114 1 8 . 1 1 103 103 TYR H H 103 7.745 7.745 7.288 0.457 17890 6115 1 8 . 1 1 104 104 VAL N N 104 116.205 116.205 115.952 0.253 17890 6116 1 8 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.936 0.041 17890 6117 1 8 . 1 1 104 104 VAL C C 104 174.361 174.361 173.540 0.821 17890 6118 1 8 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.849 -1.598 17890 6119 1 8 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.373 0.170 17890 6120 1 8 . 1 1 104 104 VAL H H 104 7.498 7.498 8.058 -0.560 17890 6121 1 8 . 1 1 105 105 TRP N N 105 119.557 119.557 119.498 0.059 17890 6122 1 8 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.048 -0.173 17890 6123 1 8 . 1 1 105 105 TRP C C 105 175.526 175.526 176.275 -0.749 17890 6124 1 8 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.417 -0.533 17890 6125 1 8 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.576 -0.037 17890 6126 1 8 . 1 1 105 105 TRP H H 105 8.926 8.926 8.965 -0.039 17890 6127 1 8 . 1 1 106 106 THR N N 106 120.480 120.480 120.047 0.433 17890 6128 1 8 . 1 1 106 106 THR HA H 106 4.966 4.966 4.756 0.210 17890 6129 1 8 . 1 1 106 106 THR C C 106 174.177 174.177 173.971 0.206 17890 6130 1 8 . 1 1 106 106 THR CA C 106 62.091 62.091 64.004 -1.913 17890 6131 1 8 . 1 1 106 106 THR CB C 106 69.649 69.649 69.204 0.446 17890 6132 1 8 . 1 1 106 106 THR H H 106 9.525 9.525 9.149 0.376 17890 6133 1 8 . 1 1 107 107 LEU N N 107 127.146 127.146 129.018 -1.872 17890 6134 1 8 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.199 -0.372 17890 6135 1 8 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.413 0.295 17890 6136 1 8 . 1 1 107 107 LEU CB C 107 41.523 41.523 44.427 -2.904 17890 6137 1 8 . 1 1 107 107 LEU H H 107 7.591 7.591 8.824 -1.233 17890 6138 1 8 . 1 1 108 108 THR N N 108 119.928 119.928 120.220 -0.292 17890 6139 1 8 . 1 1 108 108 THR HA H 108 4.411 4.411 4.685 -0.274 17890 6140 1 8 . 1 1 108 108 THR C C 108 173.319 173.319 173.056 0.263 17890 6141 1 8 . 1 1 108 108 THR CA C 108 62.243 62.243 61.724 0.519 17890 6142 1 8 . 1 1 108 108 THR CB C 108 70.138 70.138 70.931 -0.793 17890 6143 1 8 . 1 1 108 108 THR H H 108 8.141 8.141 8.869 -0.728 17890 6144 1 8 . 1 1 109 109 LEU N N 109 130.557 130.557 130.307 0.250 17890 6145 1 8 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.025 -0.480 17890 6146 1 8 . 1 1 109 109 LEU C C 109 175.217 175.217 176.355 -1.138 17890 6147 1 8 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.277 0.009 17890 6148 1 8 . 1 1 109 109 LEU CB C 109 40.606 40.606 43.020 -2.414 17890 6149 1 8 . 1 1 109 109 LEU H H 109 8.924 8.924 8.707 0.217 17890 6150 1 8 . 1 1 110 110 THR N N 110 120.160 120.160 116.254 3.906 17890 6151 1 8 . 1 1 110 110 THR HA H 110 4.911 4.911 4.680 0.231 17890 6152 1 8 . 1 1 110 110 THR CA C 110 60.141 60.141 60.504 -0.363 17890 6153 1 8 . 1 1 110 110 THR CB C 110 72.785 72.785 70.989 1.796 17890 6154 1 8 . 1 1 110 110 THR H H 110 7.677 7.677 8.563 -0.886 17890 6155 1 8 . 1 1 111 111 SER HA H 111 4.204 4.204 4.205 -0.001 17890 6156 1 8 . 1 1 111 111 SER C C 111 174.755 174.755 174.890 -0.135 17890 6157 1 8 . 1 1 111 111 SER CA C 111 60.710 60.710 59.917 0.793 17890 6158 1 8 . 1 1 111 111 SER CB C 111 62.660 62.660 62.920 -0.260 17890 6159 1 8 . 1 1 112 112 GLY N N 112 107.313 107.313 106.997 0.316 17890 6160 1 8 . 1 1 112 112 GLY C C 112 173.023 173.023 172.780 0.243 17890 6161 1 8 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.055 -0.905 17890 6162 1 8 . 1 1 112 112 GLY H H 112 8.249 8.249 7.418 0.831 17890 6163 1 8 . 1 1 113 113 GLY N N 113 105.618 105.618 107.536 -1.918 17890 6164 1 8 . 1 1 113 113 GLY C C 113 175.844 175.844 171.773 4.071 17890 6165 1 8 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.934 -3.175 17890 6166 1 8 . 1 1 113 113 GLY H H 113 7.444 7.444 7.365 0.079 17890 6167 1 8 . 1 1 114 114 TYR N N 114 121.548 121.548 118.403 3.145 17890 6168 1 8 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.422 -0.570 17890 6169 1 8 . 1 1 114 114 TYR C C 114 175.605 175.605 174.478 1.127 17890 6170 1 8 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.454 4.809 17890 6171 1 8 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.371 -4.438 17890 6172 1 8 . 1 1 114 114 TYR H H 114 9.677 9.677 8.926 0.751 17890 6173 1 8 . 1 1 115 115 ASN N N 115 123.274 123.274 117.668 5.606 17890 6174 1 8 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.252 -0.154 17890 6175 1 8 . 1 1 115 115 ASN C C 115 174.355 174.355 173.223 1.132 17890 6176 1 8 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.387 -1.341 17890 6177 1 8 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.826 -2.477 17890 6178 1 8 . 1 1 115 115 ASN H H 115 9.350 9.350 8.964 0.386 17890 6179 1 8 . 1 1 116 116 ILE N N 116 130.611 130.611 122.301 8.310 17890 6180 1 8 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.779 -0.540 17890 6181 1 8 . 1 1 116 116 ILE C C 116 173.998 173.998 174.114 -0.116 17890 6182 1 8 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.087 2.112 17890 6183 1 8 . 1 1 116 116 ILE CB C 116 37.100 37.100 40.031 -2.931 17890 6184 1 8 . 1 1 116 116 ILE H H 116 9.473 9.473 8.279 1.194 17890 6185 1 8 . 1 1 117 117 GLN N N 117 121.633 121.633 125.192 -3.559 17890 6186 1 8 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.041 0.894 17890 6187 1 8 . 1 1 117 117 GLN C C 117 177.902 177.902 175.840 2.062 17890 6188 1 8 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.934 -0.614 17890 6189 1 8 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.524 3.933 17890 6190 1 8 . 1 1 117 117 GLN H H 117 8.781 8.781 8.949 -0.168 17890 6191 1 8 . 1 1 118 118 ASP N N 118 116.836 116.836 120.486 -3.650 17890 6192 1 8 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.868 0.915 17890 6193 1 8 . 1 1 118 118 ASP C C 118 178.084 178.084 176.997 1.087 17890 6194 1 8 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.392 -1.622 17890 6195 1 8 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.144 -0.776 17890 6196 1 8 . 1 1 118 118 ASP H H 118 9.330 9.330 8.866 0.464 17890 6197 1 8 . 1 1 119 119 GLY N N 119 111.037 111.037 108.232 2.805 17890 6198 1 8 . 1 1 119 119 GLY C C 119 174.196 174.196 175.609 -1.413 17890 6199 1 8 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.070 1.906 17890 6200 1 8 . 1 1 119 119 GLY H H 119 8.986 8.986 8.381 0.605 17890 6201 1 8 . 1 1 120 120 LYS N N 120 114.809 114.809 122.986 -8.177 17890 6202 1 8 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.390 -0.041 17890 6203 1 8 . 1 1 120 120 LYS C C 120 175.174 175.174 177.129 -1.955 17890 6204 1 8 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.801 0.132 17890 6205 1 8 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.431 0.045 17890 6206 1 8 . 1 1 120 120 LYS H H 120 7.045 7.045 8.589 -1.544 17890 6207 1 8 . 1 1 121 121 ARG N N 121 116.291 116.291 112.546 3.745 17890 6208 1 8 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.020 -0.434 17890 6209 1 8 . 1 1 121 121 ARG C C 121 175.097 175.097 176.947 -1.850 17890 6210 1 8 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.134 0.935 17890 6211 1 8 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.644 -0.021 17890 6212 1 8 . 1 1 121 121 ARG H H 121 7.683 7.683 8.524 -0.841 17890 6213 1 8 . 1 1 122 122 THR N N 122 113.730 113.730 109.947 3.783 17890 6214 1 8 . 1 1 122 122 THR HA H 122 4.540 4.540 4.274 0.266 17890 6215 1 8 . 1 1 122 122 THR C C 122 175.302 175.302 174.732 0.570 17890 6216 1 8 . 1 1 122 122 THR CA C 122 62.871 62.871 64.218 -1.347 17890 6217 1 8 . 1 1 122 122 THR CB C 122 71.552 71.552 70.028 1.524 17890 6218 1 8 . 1 1 122 122 THR H H 122 11.059 11.059 8.131 2.928 17890 6219 1 8 . 1 1 123 123 VAL N N 123 118.350 118.350 114.241 4.109 17890 6220 1 8 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.782 0.028 17890 6221 1 8 . 1 1 123 123 VAL C C 123 174.730 174.730 173.793 0.937 17890 6222 1 8 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.985 0.326 17890 6223 1 8 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.801 2.281 17890 6224 1 8 . 1 1 123 123 VAL H H 123 8.181 8.181 7.368 0.813 17890 6225 1 8 . 1 1 124 124 SER N N 124 113.053 113.053 114.114 -1.061 17890 6226 1 8 . 1 1 124 124 SER HA H 124 5.820 5.820 5.189 0.631 17890 6227 1 8 . 1 1 124 124 SER C C 124 175.521 175.521 173.556 1.965 17890 6228 1 8 . 1 1 124 124 SER CA C 124 58.087 58.087 56.732 1.355 17890 6229 1 8 . 1 1 124 124 SER CB C 124 67.405 67.405 66.235 1.170 17890 6230 1 8 . 1 1 124 124 SER H H 124 9.138 9.138 8.702 0.436 17890 6231 1 8 . 1 1 125 125 TRP N N 125 124.900 124.900 124.567 0.333 17890 6232 1 8 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.004 0.606 17890 6233 1 8 . 1 1 125 125 TRP C C 125 178.114 178.114 177.369 0.745 17890 6234 1 8 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.312 -0.838 17890 6235 1 8 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.858 1.165 17890 6236 1 8 . 1 1 125 125 TRP H H 125 8.843 8.843 7.930 0.913 17890 6237 1 8 . 1 1 126 126 SER N N 126 119.243 119.243 114.152 5.091 17890 6238 1 8 . 1 1 126 126 SER HA H 126 5.443 5.443 5.296 0.147 17890 6239 1 8 . 1 1 126 126 SER C C 126 171.668 171.668 172.871 -1.203 17890 6240 1 8 . 1 1 126 126 SER CA C 126 58.696 58.696 57.033 1.663 17890 6241 1 8 . 1 1 126 126 SER CB C 126 66.176 66.176 66.271 -0.095 17890 6242 1 8 . 1 1 126 126 SER H H 126 9.835 9.835 9.353 0.482 17890 6243 1 8 . 1 1 127 127 LEU N N 127 113.708 113.708 118.292 -4.584 17890 6244 1 8 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.653 0.502 17890 6245 1 8 . 1 1 127 127 LEU C C 127 176.563 176.563 176.856 -0.293 17890 6246 1 8 . 1 1 127 127 LEU CA C 127 52.645 52.645 52.795 -0.150 17890 6247 1 8 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.201 -1.505 17890 6248 1 8 . 1 1 127 127 LEU H H 127 6.559 6.559 8.225 -1.666 17890 6249 1 8 . 1 1 128 128 ASN N N 128 121.739 121.739 118.389 3.350 17890 6250 1 8 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.853 -0.164 17890 6251 1 8 . 1 1 128 128 ASN C C 128 175.452 175.452 175.334 0.118 17890 6252 1 8 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.624 1.383 17890 6253 1 8 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.665 -1.374 17890 6254 1 8 . 1 1 128 128 ASN H H 128 8.662 8.662 9.356 -0.694 17890 6255 1 8 . 1 1 129 129 ASN N N 129 119.586 119.586 116.115 3.471 17890 6256 1 8 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.997 -0.000 17890 6257 1 8 . 1 1 129 129 ASN C C 129 175.900 175.900 174.732 1.168 17890 6258 1 8 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.378 0.855 17890 6259 1 8 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.091 0.165 17890 6260 1 8 . 1 1 129 129 ASN H H 129 10.962 10.962 8.840 2.122 17890 6261 1 8 . 1 1 130 130 ALA N N 130 128.292 128.292 121.930 6.362 17890 6262 1 8 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.030 -0.460 17890 6263 1 8 . 1 1 130 130 ALA C C 130 172.620 172.620 176.399 -3.779 17890 6264 1 8 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.360 -0.721 17890 6265 1 8 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.644 -1.544 17890 6266 1 8 . 1 1 130 130 ALA H H 130 10.629 10.629 8.657 1.972 17890 6267 1 8 . 1 1 131 131 THR N N 131 105.584 105.584 110.391 -4.807 17890 6268 1 8 . 1 1 131 131 THR HA H 131 4.462 4.462 4.201 0.261 17890 6269 1 8 . 1 1 131 131 THR C C 131 173.552 173.552 175.015 -1.463 17890 6270 1 8 . 1 1 131 131 THR CA C 131 58.338 58.338 61.230 -2.892 17890 6271 1 8 . 1 1 131 131 THR CB C 131 71.569 71.569 69.540 2.029 17890 6272 1 8 . 1 1 131 131 THR H H 131 7.092 7.092 7.463 -0.371 17890 6273 1 8 . 1 1 132 132 ALA N N 132 121.773 121.773 124.271 -2.498 17890 6274 1 8 . 1 1 132 132 ALA HA H 132 3.749 3.749 3.893 -0.144 17890 6275 1 8 . 1 1 132 132 ALA C C 132 178.819 178.819 178.359 0.460 17890 6276 1 8 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.111 1.173 17890 6277 1 8 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.681 -0.454 17890 6278 1 8 . 1 1 132 132 ALA H H 132 8.952 8.952 8.253 0.699 17890 6279 1 8 . 1 1 133 133 GLY N N 133 113.965 113.965 112.376 1.589 17890 6280 1 8 . 1 1 133 133 GLY C C 133 173.453 173.453 174.259 -0.806 17890 6281 1 8 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.795 0.371 17890 6282 1 8 . 1 1 133 133 GLY H H 133 9.016 9.016 8.770 0.246 17890 6283 1 8 . 1 1 134 134 GLU N N 134 123.460 123.460 121.529 1.931 17890 6284 1 8 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.326 -0.368 17890 6285 1 8 . 1 1 134 134 GLU C C 134 176.120 176.120 176.068 0.052 17890 6286 1 8 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.031 1.368 17890 6287 1 8 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.950 0.436 17890 6288 1 8 . 1 1 134 134 GLU H H 134 7.598 7.598 7.616 -0.018 17890 6289 1 8 . 1 1 135 135 GLU N N 135 122.633 122.633 124.870 -2.237 17890 6290 1 8 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.220 0.091 17890 6291 1 8 . 1 1 135 135 GLU C C 135 176.014 176.014 176.515 -0.501 17890 6292 1 8 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.693 -0.511 17890 6293 1 8 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.446 -0.993 17890 6294 1 8 . 1 1 135 135 GLU H H 135 8.258 8.258 8.617 -0.359 17890 6295 1 8 . 1 1 136 136 VAL N N 136 123.635 123.635 126.168 -2.533 17890 6296 1 8 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.847 -0.155 17890 6297 1 8 . 1 1 136 136 VAL C C 136 173.932 173.932 175.867 -1.935 17890 6298 1 8 . 1 1 136 136 VAL CA C 136 63.832 63.832 64.148 -0.316 17890 6299 1 8 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.043 -0.179 17890 6300 1 8 . 1 1 136 136 VAL H H 136 7.267 7.267 7.722 -0.455 17890 6301 1 8 . 1 1 137 137 SER N N 137 118.950 118.950 118.161 0.789 17890 6302 1 8 . 1 1 137 137 SER HA H 137 4.887 4.887 4.998 -0.111 17890 6303 1 8 . 1 1 137 137 SER C C 137 173.780 173.780 172.999 0.781 17890 6304 1 8 . 1 1 137 137 SER CA C 137 57.895 57.895 56.971 0.924 17890 6305 1 8 . 1 1 137 137 SER CB C 137 65.027 65.027 66.651 -1.624 17890 6306 1 8 . 1 1 137 137 SER H H 137 8.454 8.454 8.561 -0.107 17890 6307 1 8 . 1 1 138 138 ILE N N 138 123.511 123.511 119.866 3.645 17890 6308 1 8 . 1 1 138 138 ILE HA H 138 4.248 4.248 4.945 -0.697 17890 6309 1 8 . 1 1 138 138 ILE C C 138 176.142 176.142 175.670 0.472 17890 6310 1 8 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.433 1.417 17890 6311 1 8 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.400 -2.805 17890 6312 1 8 . 1 1 138 138 ILE H H 138 7.915 7.915 8.523 -0.608 17890 6313 1 8 . 1 1 139 139 GLY N N 139 115.638 115.638 111.240 4.398 17890 6314 1 8 . 1 1 139 139 GLY C C 139 171.947 171.947 172.233 -0.286 17890 6315 1 8 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.184 1.903 17890 6316 1 8 . 1 1 139 139 GLY H H 139 8.490 8.490 8.201 0.289 17890 6317 1 8 . 1 1 140 140 ALA N N 140 128.563 128.563 122.294 6.269 17890 6318 1 8 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.242 0.154 17890 6319 1 8 . 1 1 140 140 ALA C C 140 177.956 177.956 177.163 0.793 17890 6320 1 8 . 1 1 140 140 ALA CA C 140 52.646 52.646 52.199 0.447 17890 6321 1 8 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.543 -0.339 17890 6322 1 8 . 1 1 140 140 ALA H H 140 8.531 8.531 8.268 0.263 17890 6323 1 8 . 1 1 141 141 ASP N N 141 120.886 120.886 119.122 1.764 17890 6324 1 8 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.398 0.200 17890 6325 1 8 . 1 1 141 141 ASP C C 141 175.411 175.411 175.753 -0.342 17890 6326 1 8 . 1 1 141 141 ASP CA C 141 53.916 53.916 55.180 -1.264 17890 6327 1 8 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.611 -0.918 17890 6328 1 8 . 1 1 141 141 ASP H H 141 8.507 8.507 8.332 0.175 17890 6329 1 8 . 1 1 142 142 ALA N N 142 125.604 125.604 126.660 -1.056 17890 6330 1 8 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.532 -0.015 17890 6331 1 8 . 1 1 142 142 ALA C C 142 177.671 177.671 177.995 -0.324 17890 6332 1 8 . 1 1 142 142 ALA CA C 142 51.993 51.993 50.948 1.045 17890 6333 1 8 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.025 0.510 17890 6334 1 8 . 1 1 142 142 ALA H H 142 7.894 7.894 8.262 -0.368 17890 6335 1 8 . 1 1 143 143 THR N N 143 118.085 118.085 117.689 0.396 17890 6336 1 8 . 1 1 143 143 THR HA H 143 3.744 3.744 4.080 -0.336 17890 6337 1 8 . 1 1 143 143 THR C C 143 175.464 175.464 175.063 0.401 17890 6338 1 8 . 1 1 143 143 THR CA C 143 64.548 64.548 64.940 -0.392 17890 6339 1 8 . 1 1 143 143 THR CB C 143 69.305 69.305 68.888 0.418 17890 6340 1 8 . 1 1 143 143 THR H H 143 8.268 8.268 8.842 -0.574 17890 6341 1 8 . 1 1 144 144 PHE N N 144 118.635 118.635 116.082 2.553 17890 6342 1 8 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.610 -0.264 17890 6343 1 8 . 1 1 144 144 PHE C C 144 176.209 176.209 175.307 0.902 17890 6344 1 8 . 1 1 144 144 PHE CA C 144 61.462 61.462 58.235 3.227 17890 6345 1 8 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.300 0.304 17890 6346 1 8 . 1 1 144 144 PHE H H 144 8.719 8.719 7.821 0.898 17890 6347 1 8 . 1 1 145 145 SER N N 145 113.446 113.446 115.807 -2.361 17890 6348 1 8 . 1 1 145 145 SER HA H 145 4.866 4.866 4.444 0.422 17890 6349 1 8 . 1 1 145 145 SER C C 145 176.605 176.605 176.162 0.443 17890 6350 1 8 . 1 1 145 145 SER CA C 145 59.432 59.432 57.686 1.746 17890 6351 1 8 . 1 1 145 145 SER CB C 145 62.167 62.167 63.103 -0.936 17890 6352 1 8 . 1 1 145 145 SER H H 145 8.657 8.657 7.166 1.491 17890 6353 1 8 . 1 1 146 146 GLY N N 146 109.277 109.277 110.579 -1.302 17890 6354 1 8 . 1 1 146 146 GLY C C 146 174.293 174.293 173.471 0.822 17890 6355 1 8 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.515 -0.575 17890 6356 1 8 . 1 1 146 146 GLY H H 146 7.467 7.467 7.562 -0.095 17890 6357 1 8 . 1 1 147 147 ARG N N 147 122.863 122.863 118.436 4.427 17890 6358 1 8 . 1 1 147 147 ARG HA H 147 5.441 5.441 5.188 0.253 17890 6359 1 8 . 1 1 147 147 ARG C C 147 173.849 173.849 174.865 -1.016 17890 6360 1 8 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.697 -2.470 17890 6361 1 8 . 1 1 147 147 ARG CB C 147 32.597 32.597 34.044 -1.447 17890 6362 1 8 . 1 1 147 147 ARG H H 147 7.556 7.556 7.157 0.399 17890 6363 1 8 . 1 1 148 148 TRP N N 148 118.465 118.465 119.586 -1.121 17890 6364 1 8 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.041 -0.195 17890 6365 1 8 . 1 1 148 148 TRP C C 148 174.353 174.353 174.628 -0.275 17890 6366 1 8 . 1 1 148 148 TRP CA C 148 55.662 55.662 57.011 -1.349 17890 6367 1 8 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.447 -1.448 17890 6368 1 8 . 1 1 148 148 TRP H H 148 8.709 8.709 9.278 -0.569 17890 6369 1 8 . 1 1 149 149 VAL N N 149 125.852 125.852 118.884 6.968 17890 6370 1 8 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.452 -0.309 17890 6371 1 8 . 1 1 149 149 VAL C C 149 173.613 173.613 174.117 -0.504 17890 6372 1 8 . 1 1 149 149 VAL CA C 149 61.740 61.740 61.092 0.648 17890 6373 1 8 . 1 1 149 149 VAL CB C 149 32.383 32.383 34.691 -2.308 17890 6374 1 8 . 1 1 149 149 VAL H H 149 9.700 9.700 8.953 0.747 17890 6375 1 8 . 1 1 150 150 ILE N N 150 125.140 125.140 124.223 0.917 17890 6376 1 8 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.010 -0.148 17890 6377 1 8 . 1 1 150 150 ILE C C 150 175.661 175.661 175.137 0.524 17890 6378 1 8 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.268 1.553 17890 6379 1 8 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.410 -0.590 17890 6380 1 8 . 1 1 150 150 ILE H H 150 7.747 7.747 7.992 -0.245 17890 6381 1 8 . 1 1 151 151 GLU N N 151 126.762 126.762 128.321 -1.559 17890 6382 1 8 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.832 0.048 17890 6383 1 8 . 1 1 151 151 GLU C C 151 174.424 174.424 174.661 -0.237 17890 6384 1 8 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.280 0.516 17890 6385 1 8 . 1 1 151 151 GLU CB C 151 34.251 34.251 34.207 0.044 17890 6386 1 8 . 1 1 151 151 GLU H H 151 8.892 8.892 8.786 0.106 17890 6387 1 8 . 1 1 152 152 LYS N N 152 126.299 126.299 123.289 3.010 17890 6388 1 8 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.749 0.112 17890 6389 1 8 . 1 1 152 152 LYS C C 152 176.282 176.282 176.700 -0.418 17890 6390 1 8 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.697 0.808 17890 6391 1 8 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.547 0.789 17890 6392 1 8 . 1 1 152 152 LYS H H 152 8.640 8.640 8.432 0.208 17890 6393 1 9 . 1 1 2 2 GLY CA C 2 43.294 43.294 46.195 -2.901 17890 6394 1 9 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.165 0.457 17890 6395 1 9 . 1 1 8 8 HIS CA C 8 55.661 55.661 57.124 -1.463 17890 6396 1 9 . 1 1 8 8 HIS CB C 8 29.880 29.880 29.531 0.349 17890 6397 1 9 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.745 -0.099 17890 6398 1 9 . 1 1 9 9 HIS CA C 9 55.684 55.684 54.494 1.190 17890 6399 1 9 . 1 1 9 9 HIS CB C 9 29.831 29.831 31.547 -1.716 17890 6400 1 9 . 1 1 10 10 HIS N N 10 120.811 120.811 117.395 3.416 17890 6401 1 9 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.847 -0.167 17890 6402 1 9 . 1 1 10 10 HIS C C 10 174.875 174.875 173.533 1.342 17890 6403 1 9 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.860 -0.114 17890 6404 1 9 . 1 1 10 10 HIS CB C 10 29.889 29.889 31.249 -1.360 17890 6405 1 9 . 1 1 10 10 HIS H H 10 8.583 8.583 8.060 0.523 17890 6406 1 9 . 1 1 11 11 SER N N 11 118.009 118.009 115.120 2.889 17890 6407 1 9 . 1 1 11 11 SER HA H 11 4.424 4.424 4.772 -0.348 17890 6408 1 9 . 1 1 11 11 SER C C 11 174.962 174.962 174.067 0.895 17890 6409 1 9 . 1 1 11 11 SER CA C 11 58.660 58.660 58.706 -0.046 17890 6410 1 9 . 1 1 11 11 SER CB C 11 63.822 63.822 64.439 -0.617 17890 6411 1 9 . 1 1 11 11 SER H H 11 8.438 8.438 8.675 -0.237 17890 6412 1 9 . 1 1 12 12 GLY N N 12 111.011 111.011 108.418 2.593 17890 6413 1 9 . 1 1 12 12 GLY C C 12 173.907 173.907 173.566 0.341 17890 6414 1 9 . 1 1 12 12 GLY CA C 12 45.421 45.421 46.107 -0.686 17890 6415 1 9 . 1 1 12 12 GLY H H 12 8.433 8.433 8.176 0.257 17890 6416 1 9 . 1 1 13 13 ASP N N 13 120.291 120.291 119.939 0.352 17890 6417 1 9 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.568 0.094 17890 6418 1 9 . 1 1 13 13 ASP C C 13 176.115 176.115 175.626 0.489 17890 6419 1 9 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.432 0.871 17890 6420 1 9 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.872 -0.407 17890 6421 1 9 . 1 1 13 13 ASP H H 13 8.153 8.153 8.440 -0.287 17890 6422 1 9 . 1 1 14 14 SER N N 14 116.987 116.987 116.690 0.297 17890 6423 1 9 . 1 1 14 14 SER HA H 14 4.754 4.754 4.614 0.140 17890 6424 1 9 . 1 1 14 14 SER CA C 14 56.469 56.469 57.454 -0.985 17890 6425 1 9 . 1 1 14 14 SER CB C 14 63.553 63.553 63.781 -0.227 17890 6426 1 9 . 1 1 14 14 SER H H 14 8.210 8.210 8.010 0.200 17890 6427 1 9 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.334 0.108 17890 6428 1 9 . 1 1 15 15 PRO C C 15 176.424 176.424 175.806 0.618 17890 6429 1 9 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.340 -0.107 17890 6430 1 9 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.101 0.047 17890 6431 1 9 . 1 1 16 16 ALA N N 16 124.219 124.219 123.289 0.930 17890 6432 1 9 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.358 -0.008 17890 6433 1 9 . 1 1 16 16 ALA C C 16 177.552 177.552 176.998 0.554 17890 6434 1 9 . 1 1 16 16 ALA CA C 16 52.433 52.433 51.924 0.509 17890 6435 1 9 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.548 -0.229 17890 6436 1 9 . 1 1 16 16 ALA H H 16 8.284 8.284 8.131 0.153 17890 6437 1 9 . 1 1 17 17 VAL N N 17 119.504 119.504 119.585 -0.081 17890 6438 1 9 . 1 1 17 17 VAL HA H 17 4.249 4.249 3.978 0.271 17890 6439 1 9 . 1 1 17 17 VAL C C 17 176.322 176.322 176.194 0.128 17890 6440 1 9 . 1 1 17 17 VAL CA C 17 62.278 62.278 63.157 -0.880 17890 6441 1 9 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.900 0.057 17890 6442 1 9 . 1 1 17 17 VAL H H 17 8.046 8.046 7.648 0.398 17890 6443 1 9 . 1 1 18 18 THR N N 18 118.186 118.186 122.528 -4.342 17890 6444 1 9 . 1 1 18 18 THR HA H 18 4.473 4.473 4.500 -0.027 17890 6445 1 9 . 1 1 18 18 THR C C 18 174.248 174.248 174.439 -0.191 17890 6446 1 9 . 1 1 18 18 THR CA C 18 61.565 61.565 61.988 -0.423 17890 6447 1 9 . 1 1 18 18 THR CB C 18 70.165 70.165 68.963 1.202 17890 6448 1 9 . 1 1 18 18 THR H H 18 8.276 8.276 8.799 -0.523 17890 6449 1 9 . 1 1 19 19 LEU N N 19 125.265 125.265 121.990 3.275 17890 6450 1 9 . 1 1 19 19 LEU HA H 19 4.293 4.293 4.121 0.172 17890 6451 1 9 . 1 1 19 19 LEU C C 19 175.689 175.689 176.959 -1.270 17890 6452 1 9 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.686 -0.259 17890 6453 1 9 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.950 1.329 17890 6454 1 9 . 1 1 19 19 LEU H H 19 8.091 8.091 7.997 0.094 17890 6455 1 9 . 1 1 20 20 SER N N 20 114.622 114.622 115.265 -0.643 17890 6456 1 9 . 1 1 20 20 SER HA H 20 4.947 4.947 4.883 0.064 17890 6457 1 9 . 1 1 20 20 SER C C 20 174.220 174.220 172.927 1.293 17890 6458 1 9 . 1 1 20 20 SER CA C 20 56.583 56.583 57.311 -0.728 17890 6459 1 9 . 1 1 20 20 SER CB C 20 65.653 65.653 65.370 0.283 17890 6460 1 9 . 1 1 20 20 SER H H 20 7.316 7.316 7.886 -0.570 17890 6461 1 9 . 1 1 21 21 ALA N N 21 125.517 125.517 124.131 1.386 17890 6462 1 9 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.871 -0.203 17890 6463 1 9 . 1 1 21 21 ALA C C 21 177.960 177.960 177.429 0.531 17890 6464 1 9 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.399 1.611 17890 6465 1 9 . 1 1 21 21 ALA CB C 21 19.225 19.225 18.975 0.250 17890 6466 1 9 . 1 1 21 21 ALA H H 21 8.993 8.993 8.623 0.370 17890 6467 1 9 . 1 1 22 22 GLY N N 22 109.543 109.543 112.376 -2.833 17890 6468 1 9 . 1 1 22 22 GLY C C 22 170.422 170.422 171.993 -1.571 17890 6469 1 9 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.670 -0.289 17890 6470 1 9 . 1 1 22 22 GLY H H 22 8.411 8.411 9.031 -0.620 17890 6471 1 9 . 1 1 23 23 ASN N N 23 119.649 119.649 119.698 -0.049 17890 6472 1 9 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.768 0.119 17890 6473 1 9 . 1 1 23 23 ASN C C 23 175.207 175.207 174.554 0.653 17890 6474 1 9 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.502 -0.681 17890 6475 1 9 . 1 1 23 23 ASN CB C 23 38.755 38.755 40.013 -1.258 17890 6476 1 9 . 1 1 23 23 ASN H H 23 8.092 8.092 8.371 -0.279 17890 6477 1 9 . 1 1 24 24 TYR N N 24 120.889 120.889 121.809 -0.920 17890 6478 1 9 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.137 0.118 17890 6479 1 9 . 1 1 24 24 TYR C C 24 175.667 175.667 174.518 1.149 17890 6480 1 9 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.238 0.875 17890 6481 1 9 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.604 0.222 17890 6482 1 9 . 1 1 24 24 TYR H H 24 9.914 9.914 8.984 0.930 17890 6483 1 9 . 1 1 25 25 ILE N N 25 115.978 115.978 113.827 2.151 17890 6484 1 9 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.101 -0.015 17890 6485 1 9 . 1 1 25 25 ILE C C 25 175.200 175.200 174.365 0.835 17890 6486 1 9 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.548 0.997 17890 6487 1 9 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.927 -0.805 17890 6488 1 9 . 1 1 25 25 ILE H H 25 9.216 9.216 9.334 -0.118 17890 6489 1 9 . 1 1 26 26 ILE N N 26 123.957 123.957 122.926 1.031 17890 6490 1 9 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.241 -0.265 17890 6491 1 9 . 1 1 26 26 ILE C C 26 174.810 174.810 174.931 -0.121 17890 6492 1 9 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.085 0.524 17890 6493 1 9 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.273 0.849 17890 6494 1 9 . 1 1 26 26 ILE H H 26 9.559 9.559 9.103 0.456 17890 6495 1 9 . 1 1 27 27 TYR N N 27 121.371 121.371 124.202 -2.831 17890 6496 1 9 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.527 0.663 17890 6497 1 9 . 1 1 27 27 TYR C C 27 173.963 173.963 173.599 0.364 17890 6498 1 9 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.995 -0.326 17890 6499 1 9 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.986 0.712 17890 6500 1 9 . 1 1 27 27 TYR H H 27 9.378 9.378 8.984 0.394 17890 6501 1 9 . 1 1 28 28 ASN N N 28 121.991 121.991 120.200 1.791 17890 6502 1 9 . 1 1 28 28 ASN HA H 28 3.768 3.768 3.935 -0.167 17890 6503 1 9 . 1 1 28 28 ASN C C 28 174.352 174.352 175.715 -1.363 17890 6504 1 9 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.563 1.557 17890 6505 1 9 . 1 1 28 28 ASN CB C 28 41.446 41.446 40.043 1.403 17890 6506 1 9 . 1 1 28 28 ASN H H 28 8.466 8.466 8.472 -0.006 17890 6507 1 9 . 1 1 29 29 ARG N N 29 121.103 121.103 123.325 -2.222 17890 6508 1 9 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.153 -0.292 17890 6509 1 9 . 1 1 29 29 ARG C C 29 173.635 173.635 176.575 -2.940 17890 6510 1 9 . 1 1 29 29 ARG CA C 29 59.293 59.293 56.907 2.385 17890 6511 1 9 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.218 0.181 17890 6512 1 9 . 1 1 29 29 ARG H H 29 7.756 7.756 7.940 -0.184 17890 6513 1 9 . 1 1 30 30 VAL N N 30 118.412 118.412 119.210 -0.798 17890 6514 1 9 . 1 1 30 30 VAL HA H 30 3.944 3.944 4.215 -0.271 17890 6515 1 9 . 1 1 30 30 VAL C C 30 176.199 176.199 174.699 1.500 17890 6516 1 9 . 1 1 30 30 VAL CA C 30 62.577 62.577 61.516 1.061 17890 6517 1 9 . 1 1 30 30 VAL CB C 30 30.222 30.222 34.088 -3.866 17890 6518 1 9 . 1 1 30 30 VAL H H 30 8.976 8.976 7.970 1.006 17890 6519 1 9 . 1 1 31 31 LEU N N 31 125.418 125.418 123.544 1.874 17890 6520 1 9 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.633 -0.148 17890 6521 1 9 . 1 1 31 31 LEU C C 31 179.123 179.123 176.400 2.723 17890 6522 1 9 . 1 1 31 31 LEU CA C 31 54.025 54.025 52.688 1.337 17890 6523 1 9 . 1 1 31 31 LEU CB C 31 45.581 45.581 43.589 1.992 17890 6524 1 9 . 1 1 31 31 LEU H H 31 8.856 8.856 8.082 0.774 17890 6525 1 9 . 1 1 32 32 SER N N 32 116.890 116.890 116.228 0.662 17890 6526 1 9 . 1 1 32 32 SER HA H 32 5.365 5.365 4.800 0.565 17890 6527 1 9 . 1 1 32 32 SER CA C 32 57.269 57.269 56.177 1.092 17890 6528 1 9 . 1 1 32 32 SER CB C 32 62.213 62.213 64.408 -2.195 17890 6529 1 9 . 1 1 32 32 SER H H 32 9.307 9.307 8.531 0.776 17890 6530 1 9 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.337 -0.457 17890 6531 1 9 . 1 1 33 33 PRO C C 33 175.137 175.137 177.266 -2.129 17890 6532 1 9 . 1 1 33 33 PRO CA C 33 65.285 65.285 63.986 1.298 17890 6533 1 9 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.540 0.491 17890 6534 1 9 . 1 1 34 34 ARG N N 34 110.279 110.279 119.529 -9.250 17890 6535 1 9 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.099 0.393 17890 6536 1 9 . 1 1 34 34 ARG C C 34 176.844 176.844 177.257 -0.413 17890 6537 1 9 . 1 1 34 34 ARG CA C 34 54.436 54.436 56.978 -2.542 17890 6538 1 9 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.499 0.085 17890 6539 1 9 . 1 1 34 34 ARG H H 34 7.257 7.257 7.790 -0.533 17890 6540 1 9 . 1 1 35 35 GLY N N 35 110.288 110.288 106.285 4.003 17890 6541 1 9 . 1 1 35 35 GLY C C 35 173.336 173.336 173.984 -0.648 17890 6542 1 9 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.987 2.043 17890 6543 1 9 . 1 1 35 35 GLY H H 35 8.589 8.589 7.910 0.679 17890 6544 1 9 . 1 1 36 36 GLU N N 36 116.838 116.838 118.760 -1.922 17890 6545 1 9 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.629 -0.281 17890 6546 1 9 . 1 1 36 36 GLU C C 36 176.915 176.915 175.481 1.434 17890 6547 1 9 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.146 0.761 17890 6548 1 9 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.810 -2.395 17890 6549 1 9 . 1 1 36 36 GLU H H 36 7.769 7.769 7.946 -0.177 17890 6550 1 9 . 1 1 37 37 LYS N N 37 123.775 123.775 119.985 3.790 17890 6551 1 9 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.103 0.320 17890 6552 1 9 . 1 1 37 37 LYS C C 37 176.067 176.067 175.661 0.406 17890 6553 1 9 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.414 -0.513 17890 6554 1 9 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.833 0.841 17890 6555 1 9 . 1 1 37 37 LYS H H 37 8.667 8.667 8.467 0.200 17890 6556 1 9 . 1 1 38 38 LEU N N 38 126.658 126.658 125.104 1.554 17890 6557 1 9 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.949 -0.722 17890 6558 1 9 . 1 1 38 38 LEU C C 38 174.332 174.332 174.583 -0.251 17890 6559 1 9 . 1 1 38 38 LEU CA C 38 53.343 53.343 54.095 -0.752 17890 6560 1 9 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.826 -1.175 17890 6561 1 9 . 1 1 38 38 LEU H H 38 10.455 10.455 8.850 1.605 17890 6562 1 9 . 1 1 39 39 ALA N N 39 127.018 127.018 128.492 -1.474 17890 6563 1 9 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.388 -0.159 17890 6564 1 9 . 1 1 39 39 ALA C C 39 178.694 178.694 175.756 2.938 17890 6565 1 9 . 1 1 39 39 ALA CA C 39 50.225 50.225 49.753 0.472 17890 6566 1 9 . 1 1 39 39 ALA CB C 39 21.349 21.349 22.465 -1.116 17890 6567 1 9 . 1 1 39 39 ALA H H 39 8.773 8.773 8.933 -0.160 17890 6568 1 9 . 1 1 40 40 LEU N N 40 126.771 126.771 122.915 3.856 17890 6569 1 9 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.483 -0.129 17890 6570 1 9 . 1 1 40 40 LEU C C 40 178.309 178.309 176.552 1.757 17890 6571 1 9 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.075 0.770 17890 6572 1 9 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.765 0.558 17890 6573 1 9 . 1 1 40 40 LEU H H 40 9.665 9.665 8.758 0.907 17890 6574 1 9 . 1 1 41 41 THR N N 41 126.578 126.578 125.406 1.172 17890 6575 1 9 . 1 1 41 41 THR HA H 41 4.916 4.916 5.219 -0.303 17890 6576 1 9 . 1 1 41 41 THR C C 41 172.547 172.547 173.576 -1.029 17890 6577 1 9 . 1 1 41 41 THR CA C 41 63.253 63.253 61.426 1.827 17890 6578 1 9 . 1 1 41 41 THR CB C 41 71.832 71.832 70.661 1.171 17890 6579 1 9 . 1 1 41 41 THR H H 41 9.802 9.802 9.066 0.736 17890 6580 1 9 . 1 1 42 42 TYR N N 42 130.506 130.506 129.984 0.522 17890 6581 1 9 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.533 0.569 17890 6582 1 9 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.760 -3.774 17890 6583 1 9 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.298 -0.143 17890 6584 1 9 . 1 1 42 42 TYR H H 42 9.428 9.428 8.871 0.557 17890 6585 1 9 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.362 0.128 17890 6586 1 9 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.119 0.454 17890 6587 1 9 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.694 -0.050 17890 6588 1 9 . 1 1 44 44 GLY N N 44 113.736 113.736 106.910 6.826 17890 6589 1 9 . 1 1 44 44 GLY C C 44 171.790 171.790 173.153 -1.363 17890 6590 1 9 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.599 1.117 17890 6591 1 9 . 1 1 44 44 GLY H H 44 8.337 8.337 6.988 1.349 17890 6592 1 9 . 1 1 45 45 ARG N N 45 113.899 113.899 116.725 -2.826 17890 6593 1 9 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.669 -0.093 17890 6594 1 9 . 1 1 45 45 ARG C C 45 175.151 175.151 173.776 1.375 17890 6595 1 9 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.956 -0.791 17890 6596 1 9 . 1 1 45 45 ARG CB C 45 33.219 33.219 32.001 1.218 17890 6597 1 9 . 1 1 45 45 ARG H H 45 6.463 6.463 7.313 -0.850 17890 6598 1 9 . 1 1 46 46 GLN N N 46 119.000 119.000 118.990 0.010 17890 6599 1 9 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.462 -0.013 17890 6600 1 9 . 1 1 46 46 GLN C C 46 177.282 177.282 176.894 0.388 17890 6601 1 9 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.796 0.817 17890 6602 1 9 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.427 1.069 17890 6603 1 9 . 1 1 46 46 GLN H H 46 8.683 8.683 8.438 0.245 17890 6604 1 9 . 1 1 47 47 ARG N N 47 113.526 113.526 119.113 -5.587 17890 6605 1 9 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.089 -0.559 17890 6606 1 9 . 1 1 47 47 ARG C C 47 174.130 174.130 174.906 -0.776 17890 6607 1 9 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.118 1.698 17890 6608 1 9 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.271 0.799 17890 6609 1 9 . 1 1 47 47 ARG H H 47 9.677 9.677 8.402 1.275 17890 6610 1 9 . 1 1 48 48 THR N N 48 114.672 114.672 115.281 -0.609 17890 6611 1 9 . 1 1 48 48 THR HA H 48 4.938 4.938 4.708 0.230 17890 6612 1 9 . 1 1 48 48 THR CA C 48 59.987 59.987 59.982 0.005 17890 6613 1 9 . 1 1 48 48 THR CB C 48 71.947 71.947 71.422 0.525 17890 6614 1 9 . 1 1 48 48 THR H H 48 8.104 8.104 7.535 0.569 17890 6615 1 9 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.581 -0.213 17890 6616 1 9 . 1 1 49 49 PRO C C 49 175.651 175.651 176.312 -0.661 17890 6617 1 9 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.892 1.289 17890 6618 1 9 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.117 0.580 17890 6619 1 9 . 1 1 50 50 VAL N N 50 122.562 122.562 123.247 -0.685 17890 6620 1 9 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.034 -0.087 17890 6621 1 9 . 1 1 50 50 VAL C C 50 174.493 174.493 176.158 -1.665 17890 6622 1 9 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.837 1.974 17890 6623 1 9 . 1 1 50 50 VAL CB C 50 32.168 32.168 32.293 -0.125 17890 6624 1 9 . 1 1 50 50 VAL H H 50 8.123 8.123 8.722 -0.599 17890 6625 1 9 . 1 1 51 51 THR N N 51 113.549 113.549 119.708 -6.159 17890 6626 1 9 . 1 1 51 51 THR HA H 51 5.372 5.372 4.880 0.492 17890 6627 1 9 . 1 1 51 51 THR C C 51 174.841 174.841 172.996 1.845 17890 6628 1 9 . 1 1 51 51 THR CA C 51 59.196 59.196 60.694 -1.498 17890 6629 1 9 . 1 1 51 51 THR CB C 51 72.703 72.703 71.603 1.099 17890 6630 1 9 . 1 1 51 51 THR H H 51 7.057 7.057 8.224 -1.167 17890 6631 1 9 . 1 1 52 52 VAL N N 52 107.374 107.374 120.175 -12.801 17890 6632 1 9 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.056 0.458 17890 6633 1 9 . 1 1 52 52 VAL C C 52 175.697 175.697 173.677 2.020 17890 6634 1 9 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.952 -1.480 17890 6635 1 9 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.993 -0.219 17890 6636 1 9 . 1 1 52 52 VAL H H 52 8.062 8.062 8.418 -0.356 17890 6637 1 9 . 1 1 53 53 SER N N 53 114.662 114.662 120.598 -5.936 17890 6638 1 9 . 1 1 53 53 SER HA H 53 4.690 4.690 5.003 -0.313 17890 6639 1 9 . 1 1 53 53 SER CA C 53 56.828 56.828 55.944 0.884 17890 6640 1 9 . 1 1 53 53 SER CB C 53 64.789 64.789 64.616 0.173 17890 6641 1 9 . 1 1 53 53 SER H H 53 8.681 8.681 9.084 -0.403 17890 6642 1 9 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.611 0.165 17890 6643 1 9 . 1 1 54 54 PRO C C 54 177.724 177.724 176.480 1.244 17890 6644 1 9 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.422 0.003 17890 6645 1 9 . 1 1 54 54 PRO CB C 54 32.097 32.097 31.846 0.251 17890 6646 1 9 . 1 1 55 55 LEU N N 55 128.655 128.655 125.239 3.416 17890 6647 1 9 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.103 0.424 17890 6648 1 9 . 1 1 55 55 LEU C C 55 178.696 178.696 176.397 2.299 17890 6649 1 9 . 1 1 55 55 LEU CA C 55 56.246 56.246 55.964 0.282 17890 6650 1 9 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.149 1.457 17890 6651 1 9 . 1 1 55 55 LEU H H 55 8.675 8.675 8.400 0.275 17890 6652 1 9 . 1 1 56 56 ASP N N 56 126.651 126.651 126.058 0.593 17890 6653 1 9 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.758 -0.049 17890 6654 1 9 . 1 1 56 56 ASP C C 56 177.729 177.729 176.883 0.846 17890 6655 1 9 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.710 -0.087 17890 6656 1 9 . 1 1 56 56 ASP CB C 56 41.632 41.632 43.072 -1.440 17890 6657 1 9 . 1 1 56 56 ASP H H 56 9.683 9.683 8.800 0.882 17890 6658 1 9 . 1 1 57 57 GLY N N 57 109.299 109.299 108.397 0.902 17890 6659 1 9 . 1 1 57 57 GLY C C 57 174.558 174.558 174.532 0.026 17890 6660 1 9 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.132 0.823 17890 6661 1 9 . 1 1 57 57 GLY H H 57 8.157 8.157 8.062 0.095 17890 6662 1 9 . 1 1 58 58 SER N N 58 116.740 116.740 115.846 0.894 17890 6663 1 9 . 1 1 58 58 SER HA H 58 4.288 4.288 4.582 -0.294 17890 6664 1 9 . 1 1 58 58 SER C C 58 177.252 177.252 176.184 1.068 17890 6665 1 9 . 1 1 58 58 SER CA C 58 58.737 58.737 56.739 1.998 17890 6666 1 9 . 1 1 58 58 SER CB C 58 64.576 64.576 64.270 0.306 17890 6667 1 9 . 1 1 58 58 SER H H 58 8.328 8.328 7.779 0.549 17890 6668 1 9 . 1 1 59 59 SER N N 59 119.768 119.768 119.075 0.693 17890 6669 1 9 . 1 1 59 59 SER HA H 59 4.046 4.046 4.105 -0.059 17890 6670 1 9 . 1 1 59 59 SER C C 59 176.671 176.671 175.612 1.059 17890 6671 1 9 . 1 1 59 59 SER CA C 59 61.691 61.691 60.340 1.351 17890 6672 1 9 . 1 1 59 59 SER CB C 59 63.154 63.154 62.824 0.330 17890 6673 1 9 . 1 1 59 59 SER H H 59 9.020 9.020 8.809 0.211 17890 6674 1 9 . 1 1 60 60 GLU N N 60 119.133 119.133 121.232 -2.099 17890 6675 1 9 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.061 0.125 17890 6676 1 9 . 1 1 60 60 GLU C C 60 177.435 177.435 177.985 -0.550 17890 6677 1 9 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.635 1.398 17890 6678 1 9 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.802 -1.576 17890 6679 1 9 . 1 1 60 60 GLU H H 60 8.832 8.832 7.664 1.168 17890 6680 1 9 . 1 1 61 61 GLN N N 61 118.818 118.818 115.550 3.268 17890 6681 1 9 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.025 0.152 17890 6682 1 9 . 1 1 61 61 GLN C C 61 173.254 173.254 175.550 -2.296 17890 6683 1 9 . 1 1 61 61 GLN CA C 61 54.373 54.373 55.180 -0.807 17890 6684 1 9 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.005 -2.083 17890 6685 1 9 . 1 1 61 61 GLN H H 61 7.648 7.648 7.660 -0.012 17890 6686 1 9 . 1 1 62 62 ALA N N 62 122.562 122.562 122.119 0.443 17890 6687 1 9 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.565 0.499 17890 6688 1 9 . 1 1 62 62 ALA C C 62 176.637 176.637 175.365 1.272 17890 6689 1 9 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.291 -0.112 17890 6690 1 9 . 1 1 62 62 ALA CB C 62 20.595 20.595 20.930 -0.335 17890 6691 1 9 . 1 1 62 62 ALA H H 62 7.315 7.315 7.038 0.277 17890 6692 1 9 . 1 1 63 63 TRP N N 63 124.787 124.787 119.703 5.084 17890 6693 1 9 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.282 -0.318 17890 6694 1 9 . 1 1 63 63 TRP C C 63 174.351 174.351 175.248 -0.897 17890 6695 1 9 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.273 -0.371 17890 6696 1 9 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.885 -1.768 17890 6697 1 9 . 1 1 63 63 TRP H H 63 9.544 9.544 9.026 0.518 17890 6698 1 9 . 1 1 64 64 ILE N N 64 122.482 122.482 119.231 3.251 17890 6699 1 9 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.994 -0.300 17890 6700 1 9 . 1 1 64 64 ILE C C 64 177.078 177.078 174.267 2.811 17890 6701 1 9 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.583 0.448 17890 6702 1 9 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.296 -0.927 17890 6703 1 9 . 1 1 64 64 ILE H H 64 10.235 10.235 9.370 0.865 17890 6704 1 9 . 1 1 65 65 LEU N N 65 132.183 132.183 128.820 3.363 17890 6705 1 9 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.553 -0.088 17890 6706 1 9 . 1 1 65 65 LEU C C 65 177.048 177.048 174.499 2.549 17890 6707 1 9 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.831 0.518 17890 6708 1 9 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.077 -3.733 17890 6709 1 9 . 1 1 65 65 LEU H H 65 9.432 9.432 9.255 0.177 17890 6710 1 9 . 1 1 66 66 ARG N N 66 120.807 120.807 125.131 -4.324 17890 6711 1 9 . 1 1 66 66 ARG HA H 66 4.888 4.888 5.044 -0.156 17890 6712 1 9 . 1 1 66 66 ARG C C 66 175.275 175.275 174.655 0.620 17890 6713 1 9 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.684 0.371 17890 6714 1 9 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.693 -1.702 17890 6715 1 9 . 1 1 66 66 ARG H H 66 8.491 8.491 8.385 0.106 17890 6716 1 9 . 1 1 67 67 SER N N 67 119.709 119.709 117.760 1.949 17890 6717 1 9 . 1 1 67 67 SER HA H 67 3.186 3.186 3.205 -0.019 17890 6718 1 9 . 1 1 67 67 SER C C 67 174.508 174.508 173.557 0.951 17890 6719 1 9 . 1 1 67 67 SER CA C 67 58.521 58.521 58.783 -0.262 17890 6720 1 9 . 1 1 67 67 SER CB C 67 62.590 62.590 63.115 -0.525 17890 6721 1 9 . 1 1 67 67 SER H H 67 8.557 8.557 8.628 -0.071 17890 6722 1 9 . 1 1 68 68 TYR N N 68 131.011 131.011 127.608 3.403 17890 6723 1 9 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.638 -0.190 17890 6724 1 9 . 1 1 68 68 TYR C C 68 174.687 174.687 174.761 -0.074 17890 6725 1 9 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.785 0.980 17890 6726 1 9 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.032 -2.043 17890 6727 1 9 . 1 1 68 68 TYR H H 68 8.531 8.531 8.660 -0.129 17890 6728 1 9 . 1 1 69 69 ASP N N 69 117.066 117.066 120.128 -3.062 17890 6729 1 9 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.888 -0.263 17890 6730 1 9 . 1 1 69 69 ASP C C 69 176.455 176.455 176.009 0.446 17890 6731 1 9 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.910 -0.819 17890 6732 1 9 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.813 -0.666 17890 6733 1 9 . 1 1 69 69 ASP H H 69 7.122 7.122 7.701 -0.579 17890 6734 1 9 . 1 1 70 70 SER N N 70 122.869 122.869 120.226 2.643 17890 6735 1 9 . 1 1 70 70 SER HA H 70 4.270 4.270 4.161 0.109 17890 6736 1 9 . 1 1 70 70 SER C C 70 177.010 177.010 176.144 0.866 17890 6737 1 9 . 1 1 70 70 SER CA C 70 60.837 60.837 60.992 -0.155 17890 6738 1 9 . 1 1 70 70 SER CB C 70 62.722 62.722 63.129 -0.407 17890 6739 1 9 . 1 1 70 70 SER H H 70 8.757 8.757 8.822 -0.065 17890 6740 1 9 . 1 1 71 71 ASN N N 71 119.873 119.873 119.578 0.295 17890 6741 1 9 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.601 -0.030 17890 6742 1 9 . 1 1 71 71 ASN C C 71 176.226 176.226 175.958 0.268 17890 6743 1 9 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.394 0.320 17890 6744 1 9 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.497 0.144 17890 6745 1 9 . 1 1 71 71 ASN H H 71 8.342 8.342 8.646 -0.304 17890 6746 1 9 . 1 1 72 72 SER N N 72 112.202 112.202 113.461 -1.259 17890 6747 1 9 . 1 1 72 72 SER HA H 72 4.567 4.567 4.741 -0.174 17890 6748 1 9 . 1 1 72 72 SER C C 72 173.789 173.789 173.216 0.573 17890 6749 1 9 . 1 1 72 72 SER CA C 72 57.816 57.816 57.560 0.256 17890 6750 1 9 . 1 1 72 72 SER CB C 72 63.935 63.935 64.436 -0.500 17890 6751 1 9 . 1 1 72 72 SER H H 72 7.560 7.560 7.726 -0.166 17890 6752 1 9 . 1 1 73 73 ASN N N 73 117.437 117.437 118.954 -1.517 17890 6753 1 9 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.481 0.053 17890 6754 1 9 . 1 1 73 73 ASN C C 73 173.647 173.647 174.128 -0.481 17890 6755 1 9 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.580 -0.057 17890 6756 1 9 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.352 -0.139 17890 6757 1 9 . 1 1 73 73 ASN H H 73 7.940 7.940 7.861 0.079 17890 6758 1 9 . 1 1 74 74 THR N N 74 104.227 104.227 109.249 -5.022 17890 6759 1 9 . 1 1 74 74 THR HA H 74 5.477 5.477 5.120 0.357 17890 6760 1 9 . 1 1 74 74 THR C C 74 176.824 176.824 173.969 2.855 17890 6761 1 9 . 1 1 74 74 THR CA C 74 59.768 59.768 61.590 -1.822 17890 6762 1 9 . 1 1 74 74 THR CB C 74 71.985 71.985 69.878 2.107 17890 6763 1 9 . 1 1 74 74 THR H H 74 7.737 7.737 7.887 -0.150 17890 6764 1 9 . 1 1 75 75 TRP N N 75 124.636 124.636 123.735 0.901 17890 6765 1 9 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.384 -0.177 17890 6766 1 9 . 1 1 75 75 TRP C C 75 175.876 175.876 176.335 -0.459 17890 6767 1 9 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.173 1.433 17890 6768 1 9 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.426 0.090 17890 6769 1 9 . 1 1 75 75 TRP H H 75 9.442 9.442 9.286 0.156 17890 6770 1 9 . 1 1 76 76 THR N N 76 110.544 110.544 114.174 -3.630 17890 6771 1 9 . 1 1 76 76 THR HA H 76 5.129 5.129 5.060 0.069 17890 6772 1 9 . 1 1 76 76 THR C C 76 174.506 174.506 174.232 0.274 17890 6773 1 9 . 1 1 76 76 THR CA C 76 60.561 60.561 61.758 -1.197 17890 6774 1 9 . 1 1 76 76 THR CB C 76 71.688 71.688 70.194 1.494 17890 6775 1 9 . 1 1 76 76 THR H H 76 9.415 9.415 9.419 -0.004 17890 6776 1 9 . 1 1 77 77 ILE N N 77 121.567 121.567 123.155 -1.588 17890 6777 1 9 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.295 -0.156 17890 6778 1 9 . 1 1 77 77 ILE C C 77 176.148 176.148 174.987 1.161 17890 6779 1 9 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.456 2.252 17890 6780 1 9 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.841 1.146 17890 6781 1 9 . 1 1 77 77 ILE H H 77 9.255 9.255 8.434 0.821 17890 6782 1 9 . 1 1 78 78 SER N N 78 122.269 122.269 121.695 0.574 17890 6783 1 9 . 1 1 78 78 SER HA H 78 5.601 5.601 5.234 0.367 17890 6784 1 9 . 1 1 78 78 SER CA C 78 55.835 55.835 55.836 -0.001 17890 6785 1 9 . 1 1 78 78 SER CB C 78 65.858 65.858 66.291 -0.433 17890 6786 1 9 . 1 1 78 78 SER H H 78 9.226 9.226 8.677 0.549 17890 6787 1 9 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.127 -0.263 17890 6788 1 9 . 1 1 79 79 PRO C C 79 178.175 178.175 178.029 0.146 17890 6789 1 9 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.209 0.675 17890 6790 1 9 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.737 -1.465 17890 6791 1 9 . 1 1 80 80 VAL N N 80 121.906 121.906 119.479 2.427 17890 6792 1 9 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.849 -0.268 17890 6793 1 9 . 1 1 80 80 VAL C C 80 177.751 177.751 176.433 1.318 17890 6794 1 9 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.608 1.459 17890 6795 1 9 . 1 1 80 80 VAL CB C 80 31.485 31.485 30.650 0.835 17890 6796 1 9 . 1 1 80 80 VAL H H 80 7.328 7.328 7.838 -0.510 17890 6797 1 9 . 1 1 81 81 GLY N N 81 104.643 104.643 107.072 -2.429 17890 6798 1 9 . 1 1 81 81 GLY C C 81 174.979 174.979 174.031 0.948 17890 6799 1 9 . 1 1 81 81 GLY CA C 81 45.088 45.088 44.683 0.405 17890 6800 1 9 . 1 1 81 81 GLY H H 81 8.949 8.949 8.242 0.707 17890 6801 1 9 . 1 1 82 82 SER N N 82 111.865 111.865 115.523 -3.658 17890 6802 1 9 . 1 1 82 82 SER HA H 82 4.646 4.646 4.907 -0.261 17890 6803 1 9 . 1 1 82 82 SER CA C 82 55.441 55.441 55.415 0.026 17890 6804 1 9 . 1 1 82 82 SER CB C 82 62.277 62.277 63.479 -1.202 17890 6805 1 9 . 1 1 82 82 SER H H 82 6.968 6.968 7.169 -0.201 17890 6806 1 9 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.517 -0.170 17890 6807 1 9 . 1 1 83 83 PRO C C 83 176.660 176.660 177.132 -0.472 17890 6808 1 9 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.582 0.621 17890 6809 1 9 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.961 0.858 17890 6810 1 9 . 1 1 84 84 ASN N N 84 116.542 116.542 113.409 3.133 17890 6811 1 9 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.585 0.416 17890 6812 1 9 . 1 1 84 84 ASN C C 84 175.825 175.825 174.759 1.066 17890 6813 1 9 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.472 -0.581 17890 6814 1 9 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.229 0.515 17890 6815 1 9 . 1 1 84 84 ASN H H 84 8.502 8.502 8.633 -0.131 17890 6816 1 9 . 1 1 85 85 SER N N 85 114.633 114.633 114.160 0.473 17890 6817 1 9 . 1 1 85 85 SER HA H 85 4.624 4.624 4.856 -0.232 17890 6818 1 9 . 1 1 85 85 SER C C 85 172.963 172.963 172.567 0.396 17890 6819 1 9 . 1 1 85 85 SER CA C 85 59.210 59.210 57.779 1.431 17890 6820 1 9 . 1 1 85 85 SER CB C 85 64.697 64.697 66.547 -1.850 17890 6821 1 9 . 1 1 85 85 SER H H 85 7.980 7.980 7.770 0.210 17890 6822 1 9 . 1 1 86 86 GLN N N 86 119.016 119.016 117.645 1.371 17890 6823 1 9 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.284 0.162 17890 6824 1 9 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.230 0.223 17890 6825 1 9 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.305 0.093 17890 6826 1 9 . 1 1 86 86 GLN H H 86 9.399 9.399 9.020 0.379 17890 6827 1 9 . 1 1 87 87 ILE N N 87 119.691 119.691 118.851 0.840 17890 6828 1 9 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.174 -0.599 17890 6829 1 9 . 1 1 87 87 ILE C C 87 176.505 176.505 176.009 0.496 17890 6830 1 9 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.956 4.538 17890 6831 1 9 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.257 -1.060 17890 6832 1 9 . 1 1 87 87 ILE H H 87 8.970 8.970 8.305 0.665 17890 6833 1 9 . 1 1 88 88 GLY N N 88 118.378 118.378 114.592 3.786 17890 6834 1 9 . 1 1 88 88 GLY C C 88 171.397 171.397 171.660 -0.263 17890 6835 1 9 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.131 -1.527 17890 6836 1 9 . 1 1 88 88 GLY H H 88 9.752 9.752 9.146 0.606 17890 6837 1 9 . 1 1 89 89 TRP N N 89 122.749 122.749 122.268 0.481 17890 6838 1 9 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.354 -0.756 17890 6839 1 9 . 1 1 89 89 TRP C C 89 175.924 175.924 175.180 0.744 17890 6840 1 9 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.506 -0.223 17890 6841 1 9 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.647 -2.561 17890 6842 1 9 . 1 1 89 89 TRP H H 89 8.215 8.215 8.393 -0.178 17890 6843 1 9 . 1 1 90 90 GLY N N 90 116.305 116.305 111.030 5.275 17890 6844 1 9 . 1 1 90 90 GLY C C 90 173.725 173.725 172.944 0.781 17890 6845 1 9 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.699 0.356 17890 6846 1 9 . 1 1 90 90 GLY H H 90 8.922 8.922 8.186 0.736 17890 6847 1 9 . 1 1 91 91 ALA N N 91 123.795 123.795 122.054 1.741 17890 6848 1 9 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.162 0.081 17890 6849 1 9 . 1 1 91 91 ALA C C 91 178.510 178.510 178.955 -0.445 17890 6850 1 9 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.442 0.048 17890 6851 1 9 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.807 -0.398 17890 6852 1 9 . 1 1 91 91 ALA H H 91 8.367 8.367 8.174 0.193 17890 6853 1 9 . 1 1 92 92 GLY N N 92 108.871 108.871 112.618 -3.747 17890 6854 1 9 . 1 1 92 92 GLY C C 92 174.528 174.528 174.805 -0.277 17890 6855 1 9 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.746 0.512 17890 6856 1 9 . 1 1 92 92 GLY H H 92 8.776 8.776 8.619 0.157 17890 6857 1 9 . 1 1 93 93 ASN N N 93 114.921 114.921 117.906 -2.985 17890 6858 1 9 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.812 -0.363 17890 6859 1 9 . 1 1 93 93 ASN C C 93 172.774 172.774 173.991 -1.217 17890 6860 1 9 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.438 0.535 17890 6861 1 9 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.041 -0.712 17890 6862 1 9 . 1 1 93 93 ASN H H 93 8.647 8.647 8.244 0.403 17890 6863 1 9 . 1 1 94 94 VAL N N 94 112.437 112.437 112.716 -0.279 17890 6864 1 9 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.694 0.371 17890 6865 1 9 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.329 -1.414 17890 6866 1 9 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.135 0.020 17890 6867 1 9 . 1 1 94 94 VAL H H 94 6.989 6.989 7.472 -0.483 17890 6868 1 9 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.982 -0.054 17890 6869 1 9 . 1 1 95 95 PRO C C 95 176.041 176.041 176.180 -0.139 17890 6870 1 9 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.163 -0.962 17890 6871 1 9 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.496 -0.771 17890 6872 1 9 . 1 1 96 96 VAL N N 96 113.564 113.564 117.865 -4.301 17890 6873 1 9 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.779 -0.044 17890 6874 1 9 . 1 1 96 96 VAL C C 96 173.656 173.656 175.190 -1.534 17890 6875 1 9 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.725 -0.872 17890 6876 1 9 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.293 1.860 17890 6877 1 9 . 1 1 96 96 VAL H H 96 8.199 8.199 8.865 -0.666 17890 6878 1 9 . 1 1 97 97 VAL N N 97 122.328 122.328 123.597 -1.269 17890 6879 1 9 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.616 0.015 17890 6880 1 9 . 1 1 97 97 VAL C C 97 174.776 174.776 175.816 -1.040 17890 6881 1 9 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.686 -0.029 17890 6882 1 9 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.929 -0.801 17890 6883 1 9 . 1 1 97 97 VAL H H 97 8.957 8.957 8.433 0.524 17890 6884 1 9 . 1 1 98 98 LEU N N 98 130.258 130.258 125.693 4.565 17890 6885 1 9 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.959 0.091 17890 6886 1 9 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.684 1.139 17890 6887 1 9 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.302 0.816 17890 6888 1 9 . 1 1 98 98 LEU H H 98 9.245 9.245 9.133 0.112 17890 6889 1 9 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.722 0.057 17890 6890 1 9 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.073 0.416 17890 6891 1 9 . 1 1 99 99 PRO CB C 99 30.454 30.454 30.951 -0.497 17890 6892 1 9 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.543 -0.558 17890 6893 1 9 . 1 1 100 100 PRO C C 100 177.309 177.309 175.519 1.790 17890 6894 1 9 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.233 0.591 17890 6895 1 9 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.234 -0.129 17890 6896 1 9 . 1 1 101 101 ASN N N 101 119.284 119.284 124.734 -5.450 17890 6897 1 9 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.648 -0.106 17890 6898 1 9 . 1 1 101 101 ASN C C 101 171.920 171.920 173.818 -1.898 17890 6899 1 9 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.461 -0.261 17890 6900 1 9 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.613 -1.988 17890 6901 1 9 . 1 1 101 101 ASN H H 101 7.273 7.273 9.122 -1.849 17890 6902 1 9 . 1 1 102 102 ASN N N 102 115.674 115.674 117.488 -1.814 17890 6903 1 9 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.861 -0.943 17890 6904 1 9 . 1 1 102 102 ASN C C 102 173.264 173.264 173.999 -0.735 17890 6905 1 9 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.864 1.175 17890 6906 1 9 . 1 1 102 102 ASN CB C 102 36.982 36.982 39.643 -2.661 17890 6907 1 9 . 1 1 102 102 ASN H H 102 8.197 8.197 7.731 0.466 17890 6908 1 9 . 1 1 103 103 TYR N N 103 118.775 118.775 121.449 -2.674 17890 6909 1 9 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.307 0.178 17890 6910 1 9 . 1 1 103 103 TYR C C 103 175.248 175.248 174.628 0.620 17890 6911 1 9 . 1 1 103 103 TYR CA C 103 57.490 57.490 60.020 -2.530 17890 6912 1 9 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.456 -0.924 17890 6913 1 9 . 1 1 103 103 TYR H H 103 7.745 7.745 7.588 0.157 17890 6914 1 9 . 1 1 104 104 VAL N N 104 116.205 116.205 114.993 1.212 17890 6915 1 9 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.923 0.054 17890 6916 1 9 . 1 1 104 104 VAL C C 104 174.361 174.361 173.729 0.632 17890 6917 1 9 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.751 -1.500 17890 6918 1 9 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.672 -0.129 17890 6919 1 9 . 1 1 104 104 VAL H H 104 7.498 7.498 7.942 -0.444 17890 6920 1 9 . 1 1 105 105 TRP N N 105 119.557 119.557 119.824 -0.267 17890 6921 1 9 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.086 -0.211 17890 6922 1 9 . 1 1 105 105 TRP C C 105 175.526 175.526 176.163 -0.637 17890 6923 1 9 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.315 -0.431 17890 6924 1 9 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.602 -0.063 17890 6925 1 9 . 1 1 105 105 TRP H H 105 8.926 8.926 8.874 0.052 17890 6926 1 9 . 1 1 106 106 THR N N 106 120.480 120.480 119.566 0.914 17890 6927 1 9 . 1 1 106 106 THR HA H 106 4.966 4.966 4.925 0.041 17890 6928 1 9 . 1 1 106 106 THR C C 106 174.177 174.177 173.817 0.360 17890 6929 1 9 . 1 1 106 106 THR CA C 106 62.091 62.091 64.062 -1.971 17890 6930 1 9 . 1 1 106 106 THR CB C 106 69.649 69.649 69.414 0.235 17890 6931 1 9 . 1 1 106 106 THR H H 106 9.525 9.525 9.107 0.418 17890 6932 1 9 . 1 1 107 107 LEU N N 107 127.146 127.146 128.903 -1.757 17890 6933 1 9 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.253 -0.426 17890 6934 1 9 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.193 0.516 17890 6935 1 9 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.143 -1.620 17890 6936 1 9 . 1 1 107 107 LEU H H 107 7.591 7.591 8.898 -1.307 17890 6937 1 9 . 1 1 108 108 THR N N 108 119.928 119.928 121.056 -1.128 17890 6938 1 9 . 1 1 108 108 THR HA H 108 4.411 4.411 4.575 -0.164 17890 6939 1 9 . 1 1 108 108 THR C C 108 173.319 173.319 173.053 0.266 17890 6940 1 9 . 1 1 108 108 THR CA C 108 62.243 62.243 61.261 0.982 17890 6941 1 9 . 1 1 108 108 THR CB C 108 70.138 70.138 71.139 -1.001 17890 6942 1 9 . 1 1 108 108 THR H H 108 8.141 8.141 8.666 -0.525 17890 6943 1 9 . 1 1 109 109 LEU N N 109 130.557 130.557 129.869 0.688 17890 6944 1 9 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.876 -0.331 17890 6945 1 9 . 1 1 109 109 LEU C C 109 175.217 175.217 176.392 -1.175 17890 6946 1 9 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.121 0.165 17890 6947 1 9 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.900 -2.294 17890 6948 1 9 . 1 1 109 109 LEU H H 109 8.924 8.924 8.633 0.291 17890 6949 1 9 . 1 1 110 110 THR N N 110 120.160 120.160 115.917 4.243 17890 6950 1 9 . 1 1 110 110 THR HA H 110 4.911 4.911 4.656 0.255 17890 6951 1 9 . 1 1 110 110 THR CA C 110 60.141 60.141 60.410 -0.269 17890 6952 1 9 . 1 1 110 110 THR CB C 110 72.785 72.785 70.781 2.004 17890 6953 1 9 . 1 1 110 110 THR H H 110 7.677 7.677 8.599 -0.922 17890 6954 1 9 . 1 1 111 111 SER HA H 111 4.204 4.204 4.208 -0.004 17890 6955 1 9 . 1 1 111 111 SER C C 111 174.755 174.755 174.916 -0.161 17890 6956 1 9 . 1 1 111 111 SER CA C 111 60.710 60.710 59.946 0.764 17890 6957 1 9 . 1 1 111 111 SER CB C 111 62.660 62.660 63.002 -0.342 17890 6958 1 9 . 1 1 112 112 GLY N N 112 107.313 107.313 107.830 -0.517 17890 6959 1 9 . 1 1 112 112 GLY C C 112 173.023 173.023 172.374 0.649 17890 6960 1 9 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.233 -1.083 17890 6961 1 9 . 1 1 112 112 GLY H H 112 8.249 8.249 7.489 0.760 17890 6962 1 9 . 1 1 113 113 GLY N N 113 105.618 105.618 107.639 -2.021 17890 6963 1 9 . 1 1 113 113 GLY C C 113 175.844 175.844 171.814 4.030 17890 6964 1 9 . 1 1 113 113 GLY CA C 113 42.759 42.759 46.018 -3.259 17890 6965 1 9 . 1 1 113 113 GLY H H 113 7.444 7.444 7.430 0.014 17890 6966 1 9 . 1 1 114 114 TYR N N 114 121.548 121.548 117.589 3.959 17890 6967 1 9 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.420 -0.568 17890 6968 1 9 . 1 1 114 114 TYR C C 114 175.605 175.605 174.093 1.512 17890 6969 1 9 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.828 4.435 17890 6970 1 9 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.624 -4.691 17890 6971 1 9 . 1 1 114 114 TYR H H 114 9.677 9.677 8.957 0.720 17890 6972 1 9 . 1 1 115 115 ASN N N 115 123.274 123.274 117.095 6.179 17890 6973 1 9 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.221 -0.123 17890 6974 1 9 . 1 1 115 115 ASN C C 115 174.355 174.355 173.278 1.077 17890 6975 1 9 . 1 1 115 115 ASN CA C 115 51.046 51.046 51.903 -0.857 17890 6976 1 9 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.648 -2.300 17890 6977 1 9 . 1 1 115 115 ASN H H 115 9.350 9.350 8.894 0.456 17890 6978 1 9 . 1 1 116 116 ILE N N 116 130.611 130.611 122.424 8.187 17890 6979 1 9 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.700 -0.461 17890 6980 1 9 . 1 1 116 116 ILE C C 116 173.998 173.998 173.896 0.102 17890 6981 1 9 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.194 2.005 17890 6982 1 9 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.054 -1.954 17890 6983 1 9 . 1 1 116 116 ILE H H 116 9.473 9.473 8.705 0.768 17890 6984 1 9 . 1 1 117 117 GLN N N 117 121.633 121.633 125.100 -3.467 17890 6985 1 9 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.033 0.902 17890 6986 1 9 . 1 1 117 117 GLN C C 117 177.902 177.902 176.078 1.824 17890 6987 1 9 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.814 -0.494 17890 6988 1 9 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.569 3.888 17890 6989 1 9 . 1 1 117 117 GLN H H 117 8.781 8.781 8.687 0.094 17890 6990 1 9 . 1 1 118 118 ASP N N 118 116.836 116.836 120.062 -3.226 17890 6991 1 9 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.899 0.884 17890 6992 1 9 . 1 1 118 118 ASP C C 118 178.084 178.084 176.647 1.437 17890 6993 1 9 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.071 -1.301 17890 6994 1 9 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.060 -0.692 17890 6995 1 9 . 1 1 118 118 ASP H H 118 9.330 9.330 8.539 0.791 17890 6996 1 9 . 1 1 119 119 GLY N N 119 111.037 111.037 107.658 3.379 17890 6997 1 9 . 1 1 119 119 GLY C C 119 174.196 174.196 174.973 -0.777 17890 6998 1 9 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.947 2.029 17890 6999 1 9 . 1 1 119 119 GLY H H 119 8.986 8.986 8.273 0.713 17890 7000 1 9 . 1 1 120 120 LYS N N 120 114.809 114.809 121.342 -6.533 17890 7001 1 9 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.531 -0.182 17890 7002 1 9 . 1 1 120 120 LYS C C 120 175.174 175.174 175.789 -0.615 17890 7003 1 9 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.785 1.148 17890 7004 1 9 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.927 -0.451 17890 7005 1 9 . 1 1 120 120 LYS H H 120 7.045 7.045 8.526 -1.481 17890 7006 1 9 . 1 1 121 121 ARG N N 121 116.291 116.291 113.558 2.733 17890 7007 1 9 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.084 -0.498 17890 7008 1 9 . 1 1 121 121 ARG C C 121 175.097 175.097 177.085 -1.988 17890 7009 1 9 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.955 1.114 17890 7010 1 9 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.750 -0.127 17890 7011 1 9 . 1 1 121 121 ARG H H 121 7.683 7.683 8.462 -0.779 17890 7012 1 9 . 1 1 122 122 THR N N 122 113.730 113.730 109.775 3.955 17890 7013 1 9 . 1 1 122 122 THR HA H 122 4.540 4.540 4.206 0.334 17890 7014 1 9 . 1 1 122 122 THR C C 122 175.302 175.302 174.583 0.719 17890 7015 1 9 . 1 1 122 122 THR CA C 122 62.871 62.871 64.418 -1.547 17890 7016 1 9 . 1 1 122 122 THR CB C 122 71.552 71.552 69.967 1.585 17890 7017 1 9 . 1 1 122 122 THR H H 122 11.059 11.059 8.434 2.625 17890 7018 1 9 . 1 1 123 123 VAL N N 123 118.350 118.350 114.681 3.669 17890 7019 1 9 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.621 0.189 17890 7020 1 9 . 1 1 123 123 VAL C C 123 174.730 174.730 173.649 1.081 17890 7021 1 9 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.061 0.250 17890 7022 1 9 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.863 2.219 17890 7023 1 9 . 1 1 123 123 VAL H H 123 8.181 8.181 8.219 -0.038 17890 7024 1 9 . 1 1 124 124 SER N N 124 113.053 113.053 113.936 -0.883 17890 7025 1 9 . 1 1 124 124 SER HA H 124 5.820 5.820 5.223 0.597 17890 7026 1 9 . 1 1 124 124 SER C C 124 175.521 175.521 173.618 1.903 17890 7027 1 9 . 1 1 124 124 SER CA C 124 58.087 58.087 56.469 1.618 17890 7028 1 9 . 1 1 124 124 SER CB C 124 67.405 67.405 65.535 1.869 17890 7029 1 9 . 1 1 124 124 SER H H 124 9.138 9.138 8.616 0.522 17890 7030 1 9 . 1 1 125 125 TRP N N 125 124.900 124.900 124.535 0.365 17890 7031 1 9 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.026 0.584 17890 7032 1 9 . 1 1 125 125 TRP C C 125 178.114 178.114 177.414 0.700 17890 7033 1 9 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.227 -0.753 17890 7034 1 9 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.172 0.851 17890 7035 1 9 . 1 1 125 125 TRP H H 125 8.843 8.843 8.033 0.810 17890 7036 1 9 . 1 1 126 126 SER N N 126 119.243 119.243 113.645 5.598 17890 7037 1 9 . 1 1 126 126 SER HA H 126 5.443 5.443 5.400 0.043 17890 7038 1 9 . 1 1 126 126 SER C C 126 171.668 171.668 172.884 -1.216 17890 7039 1 9 . 1 1 126 126 SER CA C 126 58.696 58.696 57.164 1.532 17890 7040 1 9 . 1 1 126 126 SER CB C 126 66.176 66.176 66.230 -0.054 17890 7041 1 9 . 1 1 126 126 SER H H 126 9.835 9.835 9.234 0.601 17890 7042 1 9 . 1 1 127 127 LEU N N 127 113.708 113.708 117.435 -3.727 17890 7043 1 9 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.685 0.470 17890 7044 1 9 . 1 1 127 127 LEU C C 127 176.563 176.563 176.452 0.111 17890 7045 1 9 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.498 -0.854 17890 7046 1 9 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.700 -2.004 17890 7047 1 9 . 1 1 127 127 LEU H H 127 6.559 6.559 8.312 -1.753 17890 7048 1 9 . 1 1 128 128 ASN N N 128 121.739 121.739 118.362 3.377 17890 7049 1 9 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.940 -0.251 17890 7050 1 9 . 1 1 128 128 ASN C C 128 175.452 175.452 175.337 0.115 17890 7051 1 9 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.821 1.186 17890 7052 1 9 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.464 -1.173 17890 7053 1 9 . 1 1 128 128 ASN H H 128 8.662 8.662 9.440 -0.778 17890 7054 1 9 . 1 1 129 129 ASN N N 129 119.586 119.586 116.088 3.498 17890 7055 1 9 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.979 0.018 17890 7056 1 9 . 1 1 129 129 ASN C C 129 175.900 175.900 174.645 1.255 17890 7057 1 9 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.340 0.893 17890 7058 1 9 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.115 0.141 17890 7059 1 9 . 1 1 129 129 ASN H H 129 10.962 10.962 8.807 2.155 17890 7060 1 9 . 1 1 130 130 ALA N N 130 128.292 128.292 121.656 6.636 17890 7061 1 9 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.034 -0.464 17890 7062 1 9 . 1 1 130 130 ALA C C 130 172.620 172.620 176.504 -3.884 17890 7063 1 9 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.386 -0.747 17890 7064 1 9 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.545 -1.445 17890 7065 1 9 . 1 1 130 130 ALA H H 130 10.629 10.629 8.621 2.008 17890 7066 1 9 . 1 1 131 131 THR N N 131 105.584 105.584 110.453 -4.869 17890 7067 1 9 . 1 1 131 131 THR HA H 131 4.462 4.462 4.195 0.267 17890 7068 1 9 . 1 1 131 131 THR C C 131 173.552 173.552 175.224 -1.672 17890 7069 1 9 . 1 1 131 131 THR CA C 131 58.338 58.338 61.536 -3.199 17890 7070 1 9 . 1 1 131 131 THR CB C 131 71.569 71.569 69.530 2.039 17890 7071 1 9 . 1 1 131 131 THR H H 131 7.092 7.092 7.432 -0.340 17890 7072 1 9 . 1 1 132 132 ALA N N 132 121.773 121.773 124.538 -2.765 17890 7073 1 9 . 1 1 132 132 ALA HA H 132 3.749 3.749 3.974 -0.225 17890 7074 1 9 . 1 1 132 132 ALA C C 132 178.819 178.819 178.109 0.710 17890 7075 1 9 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.241 1.043 17890 7076 1 9 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.569 -0.342 17890 7077 1 9 . 1 1 132 132 ALA H H 132 8.952 8.952 8.579 0.373 17890 7078 1 9 . 1 1 133 133 GLY N N 133 113.965 113.965 112.352 1.613 17890 7079 1 9 . 1 1 133 133 GLY C C 133 173.453 173.453 174.345 -0.892 17890 7080 1 9 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.826 0.340 17890 7081 1 9 . 1 1 133 133 GLY H H 133 9.016 9.016 8.644 0.372 17890 7082 1 9 . 1 1 134 134 GLU N N 134 123.460 123.460 121.385 2.075 17890 7083 1 9 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.290 -0.332 17890 7084 1 9 . 1 1 134 134 GLU C C 134 176.120 176.120 176.009 0.111 17890 7085 1 9 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.286 1.113 17890 7086 1 9 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.947 0.438 17890 7087 1 9 . 1 1 134 134 GLU H H 134 7.598 7.598 7.613 -0.015 17890 7088 1 9 . 1 1 135 135 GLU N N 135 122.633 122.633 124.115 -1.482 17890 7089 1 9 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.294 0.017 17890 7090 1 9 . 1 1 135 135 GLU C C 135 176.014 176.014 176.755 -0.741 17890 7091 1 9 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.387 -0.205 17890 7092 1 9 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.536 -1.083 17890 7093 1 9 . 1 1 135 135 GLU H H 135 8.258 8.258 8.571 -0.313 17890 7094 1 9 . 1 1 136 136 VAL N N 136 123.635 123.635 125.818 -2.183 17890 7095 1 9 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.814 -0.122 17890 7096 1 9 . 1 1 136 136 VAL C C 136 173.932 173.932 175.503 -1.571 17890 7097 1 9 . 1 1 136 136 VAL CA C 136 63.832 63.832 64.040 -0.208 17890 7098 1 9 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.172 -0.308 17890 7099 1 9 . 1 1 136 136 VAL H H 136 7.267 7.267 7.664 -0.397 17890 7100 1 9 . 1 1 137 137 SER N N 137 118.950 118.950 118.004 0.946 17890 7101 1 9 . 1 1 137 137 SER HA H 137 4.887 4.887 5.035 -0.148 17890 7102 1 9 . 1 1 137 137 SER C C 137 173.780 173.780 173.078 0.702 17890 7103 1 9 . 1 1 137 137 SER CA C 137 57.895 57.895 56.085 1.810 17890 7104 1 9 . 1 1 137 137 SER CB C 137 65.027 65.027 65.756 -0.729 17890 7105 1 9 . 1 1 137 137 SER H H 137 8.454 8.454 8.549 -0.095 17890 7106 1 9 . 1 1 138 138 ILE N N 138 123.511 123.511 120.871 2.640 17890 7107 1 9 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.105 -0.857 17890 7108 1 9 . 1 1 138 138 ILE C C 138 176.142 176.142 175.261 0.881 17890 7109 1 9 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.521 1.329 17890 7110 1 9 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.822 -3.227 17890 7111 1 9 . 1 1 138 138 ILE H H 138 7.915 7.915 8.202 -0.287 17890 7112 1 9 . 1 1 139 139 GLY N N 139 115.638 115.638 111.220 4.418 17890 7113 1 9 . 1 1 139 139 GLY C C 139 171.947 171.947 173.277 -1.330 17890 7114 1 9 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.418 1.668 17890 7115 1 9 . 1 1 139 139 GLY H H 139 8.490 8.490 8.474 0.016 17890 7116 1 9 . 1 1 140 140 ALA N N 140 128.563 128.563 121.292 7.271 17890 7117 1 9 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.361 0.035 17890 7118 1 9 . 1 1 140 140 ALA C C 140 177.956 177.956 177.148 0.808 17890 7119 1 9 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.629 -1.983 17890 7120 1 9 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.960 0.244 17890 7121 1 9 . 1 1 140 140 ALA H H 140 8.531 8.531 8.363 0.168 17890 7122 1 9 . 1 1 141 141 ASP N N 141 120.886 120.886 114.715 6.171 17890 7123 1 9 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.581 0.017 17890 7124 1 9 . 1 1 141 141 ASP C C 141 175.411 175.411 174.295 1.116 17890 7125 1 9 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.636 0.280 17890 7126 1 9 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.463 -1.771 17890 7127 1 9 . 1 1 141 141 ASP H H 141 8.507 8.507 7.674 0.833 17890 7128 1 9 . 1 1 142 142 ALA N N 142 125.604 125.604 123.394 2.210 17890 7129 1 9 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.602 -0.085 17890 7130 1 9 . 1 1 142 142 ALA C C 142 177.671 177.671 178.062 -0.391 17890 7131 1 9 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.436 0.557 17890 7132 1 9 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.436 0.099 17890 7133 1 9 . 1 1 142 142 ALA H H 142 7.894 7.894 8.186 -0.292 17890 7134 1 9 . 1 1 143 143 THR N N 143 118.085 118.085 117.202 0.883 17890 7135 1 9 . 1 1 143 143 THR HA H 143 3.744 3.744 4.126 -0.382 17890 7136 1 9 . 1 1 143 143 THR C C 143 175.464 175.464 174.882 0.582 17890 7137 1 9 . 1 1 143 143 THR CA C 143 64.548 64.548 64.881 -0.333 17890 7138 1 9 . 1 1 143 143 THR CB C 143 69.305 69.305 68.800 0.505 17890 7139 1 9 . 1 1 143 143 THR H H 143 8.268 8.268 8.837 -0.569 17890 7140 1 9 . 1 1 144 144 PHE N N 144 118.635 118.635 116.032 2.603 17890 7141 1 9 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.690 -0.344 17890 7142 1 9 . 1 1 144 144 PHE C C 144 176.209 176.209 175.240 0.969 17890 7143 1 9 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.797 3.665 17890 7144 1 9 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.138 0.466 17890 7145 1 9 . 1 1 144 144 PHE H H 144 8.719 8.719 7.873 0.846 17890 7146 1 9 . 1 1 145 145 SER N N 145 113.446 113.446 115.614 -2.168 17890 7147 1 9 . 1 1 145 145 SER HA H 145 4.866 4.866 4.363 0.503 17890 7148 1 9 . 1 1 145 145 SER C C 145 176.605 176.605 176.041 0.564 17890 7149 1 9 . 1 1 145 145 SER CA C 145 59.432 59.432 57.694 1.738 17890 7150 1 9 . 1 1 145 145 SER CB C 145 62.167 62.167 63.081 -0.915 17890 7151 1 9 . 1 1 145 145 SER H H 145 8.657 8.657 7.270 1.387 17890 7152 1 9 . 1 1 146 146 GLY N N 146 109.277 109.277 110.033 -0.756 17890 7153 1 9 . 1 1 146 146 GLY C C 146 174.293 174.293 173.084 1.209 17890 7154 1 9 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.289 -0.349 17890 7155 1 9 . 1 1 146 146 GLY H H 146 7.467 7.467 7.566 -0.099 17890 7156 1 9 . 1 1 147 147 ARG N N 147 122.863 122.863 119.180 3.683 17890 7157 1 9 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.874 0.567 17890 7158 1 9 . 1 1 147 147 ARG C C 147 173.849 173.849 174.021 -0.172 17890 7159 1 9 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.844 -2.617 17890 7160 1 9 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.313 -0.716 17890 7161 1 9 . 1 1 147 147 ARG H H 147 7.556 7.556 7.196 0.360 17890 7162 1 9 . 1 1 148 148 TRP N N 148 118.465 118.465 122.683 -4.218 17890 7163 1 9 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.207 -0.361 17890 7164 1 9 . 1 1 148 148 TRP C C 148 174.353 174.353 174.553 -0.200 17890 7165 1 9 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.650 -0.988 17890 7166 1 9 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.579 -1.580 17890 7167 1 9 . 1 1 148 148 TRP H H 148 8.709 8.709 9.204 -0.495 17890 7168 1 9 . 1 1 149 149 VAL N N 149 125.852 125.852 118.743 7.109 17890 7169 1 9 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.368 -0.225 17890 7170 1 9 . 1 1 149 149 VAL C C 149 173.613 173.613 173.966 -0.353 17890 7171 1 9 . 1 1 149 149 VAL CA C 149 61.740 61.740 61.053 0.688 17890 7172 1 9 . 1 1 149 149 VAL CB C 149 32.383 32.383 34.969 -2.586 17890 7173 1 9 . 1 1 149 149 VAL H H 149 9.700 9.700 9.064 0.636 17890 7174 1 9 . 1 1 150 150 ILE N N 150 125.140 125.140 124.114 1.026 17890 7175 1 9 . 1 1 150 150 ILE HA H 150 4.862 4.862 4.911 -0.049 17890 7176 1 9 . 1 1 150 150 ILE C C 150 175.661 175.661 175.031 0.630 17890 7177 1 9 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.069 1.752 17890 7178 1 9 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.184 -0.364 17890 7179 1 9 . 1 1 150 150 ILE H H 150 7.747 7.747 7.995 -0.248 17890 7180 1 9 . 1 1 151 151 GLU N N 151 126.762 126.762 127.964 -1.202 17890 7181 1 9 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.787 0.093 17890 7182 1 9 . 1 1 151 151 GLU C C 151 174.424 174.424 174.694 -0.270 17890 7183 1 9 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.145 0.651 17890 7184 1 9 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.964 0.287 17890 7185 1 9 . 1 1 151 151 GLU H H 151 8.892 8.892 8.812 0.081 17890 7186 1 9 . 1 1 152 152 LYS N N 152 126.299 126.299 123.387 2.912 17890 7187 1 9 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.764 0.097 17890 7188 1 9 . 1 1 152 152 LYS C C 152 176.282 176.282 176.716 -0.434 17890 7189 1 9 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.605 0.900 17890 7190 1 9 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.599 0.737 17890 7191 1 9 . 1 1 152 152 LYS H H 152 8.640 8.640 8.504 0.136 17890 7192 1 10 . 1 1 2 2 GLY CA C 2 43.294 43.294 44.520 -1.226 17890 7193 1 10 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.507 0.115 17890 7194 1 10 . 1 1 8 8 HIS CA C 8 55.661 55.661 54.969 0.692 17890 7195 1 10 . 1 1 8 8 HIS CB C 8 29.880 29.880 31.500 -1.620 17890 7196 1 10 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.644 0.002 17890 7197 1 10 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.232 0.452 17890 7198 1 10 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.156 -0.325 17890 7199 1 10 . 1 1 10 10 HIS N N 10 120.811 120.811 117.926 2.885 17890 7200 1 10 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.109 0.571 17890 7201 1 10 . 1 1 10 10 HIS C C 10 174.875 174.875 174.895 -0.020 17890 7202 1 10 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.688 -0.942 17890 7203 1 10 . 1 1 10 10 HIS CB C 10 29.889 29.889 26.502 3.387 17890 7204 1 10 . 1 1 10 10 HIS H H 10 8.583 8.583 7.424 1.159 17890 7205 1 10 . 1 1 11 11 SER N N 11 118.009 118.009 109.922 8.087 17890 7206 1 10 . 1 1 11 11 SER HA H 11 4.424 4.424 2.989 1.435 17890 7207 1 10 . 1 1 11 11 SER C C 11 174.962 174.962 173.979 0.983 17890 7208 1 10 . 1 1 11 11 SER CA C 11 58.660 58.660 58.697 -0.037 17890 7209 1 10 . 1 1 11 11 SER CB C 11 63.822 63.822 62.237 1.585 17890 7210 1 10 . 1 1 11 11 SER H H 11 8.438 8.438 7.023 1.415 17890 7211 1 10 . 1 1 12 12 GLY N N 12 111.011 111.011 107.652 3.359 17890 7212 1 10 . 1 1 12 12 GLY C C 12 173.907 173.907 171.687 2.220 17890 7213 1 10 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.306 0.115 17890 7214 1 10 . 1 1 12 12 GLY H H 12 8.433 8.433 7.527 0.906 17890 7215 1 10 . 1 1 13 13 ASP N N 13 120.291 120.291 118.469 1.822 17890 7216 1 10 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.716 -0.054 17890 7217 1 10 . 1 1 13 13 ASP C C 13 176.115 176.115 174.558 1.557 17890 7218 1 10 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.623 0.680 17890 7219 1 10 . 1 1 13 13 ASP CB C 13 41.465 41.465 42.800 -1.335 17890 7220 1 10 . 1 1 13 13 ASP H H 13 8.153 8.153 8.036 0.117 17890 7221 1 10 . 1 1 14 14 SER N N 14 116.987 116.987 117.833 -0.846 17890 7222 1 10 . 1 1 14 14 SER HA H 14 4.754 4.754 5.059 -0.305 17890 7223 1 10 . 1 1 14 14 SER CA C 14 56.469 56.469 57.005 -0.536 17890 7224 1 10 . 1 1 14 14 SER CB C 14 63.553 63.553 63.978 -0.425 17890 7225 1 10 . 1 1 14 14 SER H H 14 8.210 8.210 8.359 -0.149 17890 7226 1 10 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.412 0.030 17890 7227 1 10 . 1 1 15 15 PRO C C 15 176.424 176.424 175.804 0.620 17890 7228 1 10 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.499 -0.266 17890 7229 1 10 . 1 1 15 15 PRO CB C 15 32.148 32.148 31.934 0.214 17890 7230 1 10 . 1 1 16 16 ALA N N 16 124.219 124.219 124.982 -0.763 17890 7231 1 10 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.626 -0.276 17890 7232 1 10 . 1 1 16 16 ALA C C 16 177.552 177.552 176.382 1.170 17890 7233 1 10 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.081 0.352 17890 7234 1 10 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.428 -0.109 17890 7235 1 10 . 1 1 16 16 ALA H H 16 8.284 8.284 8.477 -0.193 17890 7236 1 10 . 1 1 17 17 VAL N N 17 119.504 119.504 117.616 1.888 17890 7237 1 10 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.380 -0.132 17890 7238 1 10 . 1 1 17 17 VAL C C 17 176.322 176.322 176.003 0.319 17890 7239 1 10 . 1 1 17 17 VAL CA C 17 62.278 62.278 61.943 0.335 17890 7240 1 10 . 1 1 17 17 VAL CB C 17 32.957 32.957 34.018 -1.061 17890 7241 1 10 . 1 1 17 17 VAL H H 17 8.046 8.046 7.795 0.251 17890 7242 1 10 . 1 1 18 18 THR N N 18 118.186 118.186 118.868 -0.682 17890 7243 1 10 . 1 1 18 18 THR HA H 18 4.473 4.473 4.564 -0.091 17890 7244 1 10 . 1 1 18 18 THR C C 18 174.248 174.248 174.744 -0.496 17890 7245 1 10 . 1 1 18 18 THR CA C 18 61.565 61.565 61.540 0.025 17890 7246 1 10 . 1 1 18 18 THR CB C 18 70.165 70.165 69.075 1.090 17890 7247 1 10 . 1 1 18 18 THR H H 18 8.276 8.276 8.459 -0.183 17890 7248 1 10 . 1 1 19 19 LEU N N 19 125.265 125.265 119.698 5.567 17890 7249 1 10 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.943 0.350 17890 7250 1 10 . 1 1 19 19 LEU C C 19 175.689 175.689 175.220 0.469 17890 7251 1 10 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.253 0.174 17890 7252 1 10 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.061 2.218 17890 7253 1 10 . 1 1 19 19 LEU H H 19 8.091 8.091 8.268 -0.177 17890 7254 1 10 . 1 1 20 20 SER N N 20 114.622 114.622 114.359 0.263 17890 7255 1 10 . 1 1 20 20 SER HA H 20 4.947 4.947 4.913 0.034 17890 7256 1 10 . 1 1 20 20 SER C C 20 174.220 174.220 172.819 1.401 17890 7257 1 10 . 1 1 20 20 SER CA C 20 56.583 56.583 57.571 -0.988 17890 7258 1 10 . 1 1 20 20 SER CB C 20 65.653 65.653 64.972 0.681 17890 7259 1 10 . 1 1 20 20 SER H H 20 7.316 7.316 7.929 -0.613 17890 7260 1 10 . 1 1 21 21 ALA N N 21 125.517 125.517 123.687 1.830 17890 7261 1 10 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.939 -0.271 17890 7262 1 10 . 1 1 21 21 ALA C C 21 177.960 177.960 177.243 0.717 17890 7263 1 10 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.450 1.560 17890 7264 1 10 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.434 -0.209 17890 7265 1 10 . 1 1 21 21 ALA H H 21 8.993 8.993 8.485 0.508 17890 7266 1 10 . 1 1 22 22 GLY N N 22 109.543 109.543 112.542 -2.999 17890 7267 1 10 . 1 1 22 22 GLY C C 22 170.422 170.422 172.049 -1.627 17890 7268 1 10 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.078 0.303 17890 7269 1 10 . 1 1 22 22 GLY H H 22 8.411 8.411 8.953 -0.542 17890 7270 1 10 . 1 1 23 23 ASN N N 23 119.649 119.649 119.968 -0.319 17890 7271 1 10 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.767 0.120 17890 7272 1 10 . 1 1 23 23 ASN C C 23 175.207 175.207 174.601 0.606 17890 7273 1 10 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.627 -0.806 17890 7274 1 10 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.818 -1.063 17890 7275 1 10 . 1 1 23 23 ASN H H 23 8.092 8.092 8.375 -0.283 17890 7276 1 10 . 1 1 24 24 TYR N N 24 120.889 120.889 121.811 -0.922 17890 7277 1 10 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.141 0.114 17890 7278 1 10 . 1 1 24 24 TYR C C 24 175.667 175.667 174.473 1.194 17890 7279 1 10 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.243 0.870 17890 7280 1 10 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.650 0.176 17890 7281 1 10 . 1 1 24 24 TYR H H 24 9.914 9.914 9.020 0.894 17890 7282 1 10 . 1 1 25 25 ILE N N 25 115.978 115.978 113.582 2.396 17890 7283 1 10 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.089 -0.003 17890 7284 1 10 . 1 1 25 25 ILE C C 25 175.200 175.200 174.305 0.895 17890 7285 1 10 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.549 0.996 17890 7286 1 10 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.989 -0.867 17890 7287 1 10 . 1 1 25 25 ILE H H 25 9.216 9.216 9.313 -0.097 17890 7288 1 10 . 1 1 26 26 ILE N N 26 123.957 123.957 122.669 1.288 17890 7289 1 10 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.253 -0.277 17890 7290 1 10 . 1 1 26 26 ILE C C 26 174.810 174.810 174.845 -0.035 17890 7291 1 10 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.246 0.363 17890 7292 1 10 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.217 0.905 17890 7293 1 10 . 1 1 26 26 ILE H H 26 9.559 9.559 9.087 0.472 17890 7294 1 10 . 1 1 27 27 TYR N N 27 121.371 121.371 124.132 -2.761 17890 7295 1 10 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.574 0.616 17890 7296 1 10 . 1 1 27 27 TYR C C 27 173.963 173.963 173.531 0.432 17890 7297 1 10 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.830 -0.161 17890 7298 1 10 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.934 0.764 17890 7299 1 10 . 1 1 27 27 TYR H H 27 9.378 9.378 9.128 0.250 17890 7300 1 10 . 1 1 28 28 ASN N N 28 121.991 121.991 119.835 2.156 17890 7301 1 10 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.042 -0.274 17890 7302 1 10 . 1 1 28 28 ASN C C 28 174.352 174.352 176.083 -1.731 17890 7303 1 10 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.255 1.865 17890 7304 1 10 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.806 1.640 17890 7305 1 10 . 1 1 28 28 ASN H H 28 8.466 8.466 8.348 0.118 17890 7306 1 10 . 1 1 29 29 ARG N N 29 121.103 121.103 121.695 -0.592 17890 7307 1 10 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.075 -0.214 17890 7308 1 10 . 1 1 29 29 ARG C C 29 173.635 173.635 177.224 -3.589 17890 7309 1 10 . 1 1 29 29 ARG CA C 29 59.293 59.293 56.674 2.619 17890 7310 1 10 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.191 0.208 17890 7311 1 10 . 1 1 29 29 ARG H H 29 7.756 7.756 7.932 -0.176 17890 7312 1 10 . 1 1 30 30 VAL N N 30 118.412 118.412 121.051 -2.639 17890 7313 1 10 . 1 1 30 30 VAL HA H 30 3.944 3.944 4.056 -0.112 17890 7314 1 10 . 1 1 30 30 VAL C C 30 176.199 176.199 175.030 1.169 17890 7315 1 10 . 1 1 30 30 VAL CA C 30 62.577 62.577 61.669 0.908 17890 7316 1 10 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.096 -1.874 17890 7317 1 10 . 1 1 30 30 VAL H H 30 8.976 8.976 7.940 1.036 17890 7318 1 10 . 1 1 31 31 LEU N N 31 125.418 125.418 128.126 -2.708 17890 7319 1 10 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.280 0.205 17890 7320 1 10 . 1 1 31 31 LEU C C 31 179.123 179.123 177.175 1.948 17890 7321 1 10 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.200 -1.175 17890 7322 1 10 . 1 1 31 31 LEU CB C 31 45.581 45.581 42.683 2.898 17890 7323 1 10 . 1 1 31 31 LEU H H 31 8.856 8.856 8.315 0.541 17890 7324 1 10 . 1 1 32 32 SER N N 32 116.890 116.890 117.194 -0.304 17890 7325 1 10 . 1 1 32 32 SER HA H 32 5.365 5.365 4.992 0.373 17890 7326 1 10 . 1 1 32 32 SER CA C 32 57.269 57.269 56.433 0.836 17890 7327 1 10 . 1 1 32 32 SER CB C 32 62.213 62.213 63.306 -1.093 17890 7328 1 10 . 1 1 32 32 SER H H 32 9.307 9.307 8.101 1.206 17890 7329 1 10 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.270 -0.390 17890 7330 1 10 . 1 1 33 33 PRO C C 33 175.137 175.137 177.788 -2.651 17890 7331 1 10 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.748 0.537 17890 7332 1 10 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.316 0.715 17890 7333 1 10 . 1 1 34 34 ARG N N 34 110.279 110.279 118.497 -8.218 17890 7334 1 10 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.181 0.311 17890 7335 1 10 . 1 1 34 34 ARG C C 34 176.844 176.844 177.152 -0.308 17890 7336 1 10 . 1 1 34 34 ARG CA C 34 54.436 54.436 56.681 -2.245 17890 7337 1 10 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.490 0.094 17890 7338 1 10 . 1 1 34 34 ARG H H 34 7.257 7.257 8.041 -0.784 17890 7339 1 10 . 1 1 35 35 GLY N N 35 110.288 110.288 108.167 2.121 17890 7340 1 10 . 1 1 35 35 GLY C C 35 173.336 173.336 173.492 -0.156 17890 7341 1 10 . 1 1 35 35 GLY CA C 35 47.030 47.030 45.061 1.969 17890 7342 1 10 . 1 1 35 35 GLY H H 35 8.589 8.589 8.119 0.470 17890 7343 1 10 . 1 1 36 36 GLU N N 36 116.838 116.838 119.440 -2.602 17890 7344 1 10 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.695 -0.347 17890 7345 1 10 . 1 1 36 36 GLU C C 36 176.915 176.915 175.054 1.861 17890 7346 1 10 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.915 0.992 17890 7347 1 10 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.960 -2.545 17890 7348 1 10 . 1 1 36 36 GLU H H 36 7.769 7.769 7.859 -0.090 17890 7349 1 10 . 1 1 37 37 LYS N N 37 123.775 123.775 121.434 2.341 17890 7350 1 10 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.180 0.243 17890 7351 1 10 . 1 1 37 37 LYS C C 37 176.067 176.067 175.740 0.327 17890 7352 1 10 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.278 -0.377 17890 7353 1 10 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.440 1.234 17890 7354 1 10 . 1 1 37 37 LYS H H 37 8.667 8.667 8.693 -0.026 17890 7355 1 10 . 1 1 38 38 LEU N N 38 126.658 126.658 126.721 -0.063 17890 7356 1 10 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.890 -0.663 17890 7357 1 10 . 1 1 38 38 LEU C C 38 174.332 174.332 175.229 -0.897 17890 7358 1 10 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.593 -0.250 17890 7359 1 10 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.799 -1.148 17890 7360 1 10 . 1 1 38 38 LEU H H 38 10.455 10.455 8.934 1.521 17890 7361 1 10 . 1 1 39 39 ALA N N 39 127.018 127.018 126.931 0.087 17890 7362 1 10 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.307 -0.078 17890 7363 1 10 . 1 1 39 39 ALA C C 39 178.694 178.694 175.991 2.703 17890 7364 1 10 . 1 1 39 39 ALA CA C 39 50.225 50.225 49.920 0.305 17890 7365 1 10 . 1 1 39 39 ALA CB C 39 21.349 21.349 21.102 0.247 17890 7366 1 10 . 1 1 39 39 ALA H H 39 8.773 8.773 8.451 0.322 17890 7367 1 10 . 1 1 40 40 LEU N N 40 126.771 126.771 123.333 3.438 17890 7368 1 10 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.533 -0.179 17890 7369 1 10 . 1 1 40 40 LEU C C 40 178.309 178.309 176.553 1.756 17890 7370 1 10 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.064 0.781 17890 7371 1 10 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.880 0.443 17890 7372 1 10 . 1 1 40 40 LEU H H 40 9.665 9.665 8.772 0.893 17890 7373 1 10 . 1 1 41 41 THR N N 41 126.578 126.578 124.724 1.854 17890 7374 1 10 . 1 1 41 41 THR HA H 41 4.916 4.916 5.220 -0.304 17890 7375 1 10 . 1 1 41 41 THR C C 41 172.547 172.547 173.364 -0.817 17890 7376 1 10 . 1 1 41 41 THR CA C 41 63.253 63.253 61.380 1.873 17890 7377 1 10 . 1 1 41 41 THR CB C 41 71.832 71.832 70.777 1.055 17890 7378 1 10 . 1 1 41 41 THR H H 41 9.802 9.802 9.082 0.720 17890 7379 1 10 . 1 1 42 42 TYR N N 42 130.506 130.506 129.211 1.295 17890 7380 1 10 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.719 0.383 17890 7381 1 10 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.695 -3.709 17890 7382 1 10 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.703 0.452 17890 7383 1 10 . 1 1 42 42 TYR H H 42 9.428 9.428 8.689 0.739 17890 7384 1 10 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.357 0.133 17890 7385 1 10 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.320 0.253 17890 7386 1 10 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.473 0.171 17890 7387 1 10 . 1 1 44 44 GLY N N 44 113.736 113.736 107.408 6.328 17890 7388 1 10 . 1 1 44 44 GLY C C 44 171.790 171.790 173.484 -1.694 17890 7389 1 10 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.823 0.893 17890 7390 1 10 . 1 1 44 44 GLY H H 44 8.337 8.337 7.356 0.981 17890 7391 1 10 . 1 1 45 45 ARG N N 45 113.899 113.899 118.688 -4.789 17890 7392 1 10 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.531 0.045 17890 7393 1 10 . 1 1 45 45 ARG C C 45 175.151 175.151 174.171 0.980 17890 7394 1 10 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.759 -0.594 17890 7395 1 10 . 1 1 45 45 ARG CB C 45 33.219 33.219 32.346 0.873 17890 7396 1 10 . 1 1 45 45 ARG H H 45 6.463 6.463 7.468 -1.005 17890 7397 1 10 . 1 1 46 46 GLN N N 46 119.000 119.000 119.840 -0.840 17890 7398 1 10 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.465 -0.016 17890 7399 1 10 . 1 1 46 46 GLN C C 46 177.282 177.282 176.478 0.804 17890 7400 1 10 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.415 1.198 17890 7401 1 10 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.538 0.958 17890 7402 1 10 . 1 1 46 46 GLN H H 46 8.683 8.683 8.477 0.206 17890 7403 1 10 . 1 1 47 47 ARG N N 47 113.526 113.526 117.297 -3.771 17890 7404 1 10 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.029 -0.499 17890 7405 1 10 . 1 1 47 47 ARG C C 47 174.130 174.130 174.971 -0.841 17890 7406 1 10 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.175 1.641 17890 7407 1 10 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.097 1.973 17890 7408 1 10 . 1 1 47 47 ARG H H 47 9.677 9.677 8.791 0.886 17890 7409 1 10 . 1 1 48 48 THR N N 48 114.672 114.672 115.064 -0.392 17890 7410 1 10 . 1 1 48 48 THR HA H 48 4.938 4.938 4.671 0.267 17890 7411 1 10 . 1 1 48 48 THR CA C 48 59.987 59.987 59.922 0.065 17890 7412 1 10 . 1 1 48 48 THR CB C 48 71.947 71.947 71.225 0.722 17890 7413 1 10 . 1 1 48 48 THR H H 48 8.104 8.104 7.479 0.625 17890 7414 1 10 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.659 -0.291 17890 7415 1 10 . 1 1 49 49 PRO C C 49 175.651 175.651 176.482 -0.831 17890 7416 1 10 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.923 1.258 17890 7417 1 10 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.126 0.571 17890 7418 1 10 . 1 1 50 50 VAL N N 50 122.562 122.562 121.425 1.137 17890 7419 1 10 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.227 -0.280 17890 7420 1 10 . 1 1 50 50 VAL C C 50 174.493 174.493 176.012 -1.519 17890 7421 1 10 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.672 2.139 17890 7422 1 10 . 1 1 50 50 VAL CB C 50 32.168 32.168 33.458 -1.290 17890 7423 1 10 . 1 1 50 50 VAL H H 50 8.123 8.123 8.532 -0.409 17890 7424 1 10 . 1 1 51 51 THR N N 51 113.549 113.549 119.505 -5.956 17890 7425 1 10 . 1 1 51 51 THR HA H 51 5.372 5.372 4.923 0.449 17890 7426 1 10 . 1 1 51 51 THR C C 51 174.841 174.841 172.803 2.038 17890 7427 1 10 . 1 1 51 51 THR CA C 51 59.196 59.196 60.911 -1.715 17890 7428 1 10 . 1 1 51 51 THR CB C 51 72.703 72.703 71.852 0.851 17890 7429 1 10 . 1 1 51 51 THR H H 51 7.057 7.057 8.252 -1.195 17890 7430 1 10 . 1 1 52 52 VAL N N 52 107.374 107.374 120.985 -13.611 17890 7431 1 10 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.013 0.500 17890 7432 1 10 . 1 1 52 52 VAL C C 52 175.697 175.697 173.872 1.825 17890 7433 1 10 . 1 1 52 52 VAL CA C 52 58.472 58.472 60.108 -1.636 17890 7434 1 10 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.900 -0.126 17890 7435 1 10 . 1 1 52 52 VAL H H 52 8.062 8.062 8.523 -0.461 17890 7436 1 10 . 1 1 53 53 SER N N 53 114.662 114.662 122.400 -7.738 17890 7437 1 10 . 1 1 53 53 SER HA H 53 4.690 4.690 4.990 -0.300 17890 7438 1 10 . 1 1 53 53 SER CA C 53 56.828 56.828 55.942 0.886 17890 7439 1 10 . 1 1 53 53 SER CB C 53 64.789 64.789 65.686 -0.897 17890 7440 1 10 . 1 1 53 53 SER H H 53 8.681 8.681 9.093 -0.412 17890 7441 1 10 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.699 0.077 17890 7442 1 10 . 1 1 54 54 PRO C C 54 177.724 177.724 175.969 1.755 17890 7443 1 10 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.275 0.150 17890 7444 1 10 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.341 -0.244 17890 7445 1 10 . 1 1 55 55 LEU N N 55 128.655 128.655 120.663 7.992 17890 7446 1 10 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.653 -0.126 17890 7447 1 10 . 1 1 55 55 LEU C C 55 178.696 178.696 175.708 2.988 17890 7448 1 10 . 1 1 55 55 LEU CA C 55 56.246 56.246 53.976 2.270 17890 7449 1 10 . 1 1 55 55 LEU CB C 55 43.606 43.606 45.204 -1.598 17890 7450 1 10 . 1 1 55 55 LEU H H 55 8.675 8.675 8.021 0.654 17890 7451 1 10 . 1 1 56 56 ASP N N 56 126.651 126.651 123.527 3.124 17890 7452 1 10 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.654 0.055 17890 7453 1 10 . 1 1 56 56 ASP C C 56 177.729 177.729 176.318 1.411 17890 7454 1 10 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.760 -1.137 17890 7455 1 10 . 1 1 56 56 ASP CB C 56 41.632 41.632 42.186 -0.554 17890 7456 1 10 . 1 1 56 56 ASP H H 56 9.683 9.683 8.700 0.983 17890 7457 1 10 . 1 1 57 57 GLY N N 57 109.299 109.299 108.029 1.270 17890 7458 1 10 . 1 1 57 57 GLY C C 57 174.558 174.558 174.450 0.108 17890 7459 1 10 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.709 1.246 17890 7460 1 10 . 1 1 57 57 GLY H H 57 8.157 8.157 8.114 0.043 17890 7461 1 10 . 1 1 58 58 SER N N 58 116.740 116.740 116.833 -0.093 17890 7462 1 10 . 1 1 58 58 SER HA H 58 4.288 4.288 4.646 -0.358 17890 7463 1 10 . 1 1 58 58 SER C C 58 177.252 177.252 175.883 1.369 17890 7464 1 10 . 1 1 58 58 SER CA C 58 58.737 58.737 57.072 1.665 17890 7465 1 10 . 1 1 58 58 SER CB C 58 64.576 64.576 64.088 0.488 17890 7466 1 10 . 1 1 58 58 SER H H 58 8.328 8.328 7.907 0.421 17890 7467 1 10 . 1 1 59 59 SER N N 59 119.768 119.768 122.670 -2.902 17890 7468 1 10 . 1 1 59 59 SER HA H 59 4.046 4.046 4.175 -0.129 17890 7469 1 10 . 1 1 59 59 SER C C 59 176.671 176.671 176.093 0.578 17890 7470 1 10 . 1 1 59 59 SER CA C 59 61.691 61.691 60.189 1.502 17890 7471 1 10 . 1 1 59 59 SER CB C 59 63.154 63.154 62.991 0.163 17890 7472 1 10 . 1 1 59 59 SER H H 59 9.020 9.020 8.917 0.103 17890 7473 1 10 . 1 1 60 60 GLU N N 60 119.133 119.133 122.001 -2.868 17890 7474 1 10 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.001 0.185 17890 7475 1 10 . 1 1 60 60 GLU C C 60 177.435 177.435 177.300 0.135 17890 7476 1 10 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.743 1.290 17890 7477 1 10 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.427 -1.201 17890 7478 1 10 . 1 1 60 60 GLU H H 60 8.832 8.832 7.595 1.237 17890 7479 1 10 . 1 1 61 61 GLN N N 61 118.818 118.818 115.636 3.182 17890 7480 1 10 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.004 0.173 17890 7481 1 10 . 1 1 61 61 GLN C C 61 173.254 173.254 175.286 -2.032 17890 7482 1 10 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.930 -0.557 17890 7483 1 10 . 1 1 61 61 GLN CB C 61 27.922 27.922 29.642 -1.720 17890 7484 1 10 . 1 1 61 61 GLN H H 61 7.648 7.648 7.601 0.047 17890 7485 1 10 . 1 1 62 62 ALA N N 62 122.562 122.562 121.961 0.601 17890 7486 1 10 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.559 0.505 17890 7487 1 10 . 1 1 62 62 ALA C C 62 176.637 176.637 175.383 1.254 17890 7488 1 10 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.087 0.092 17890 7489 1 10 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.176 -0.581 17890 7490 1 10 . 1 1 62 62 ALA H H 62 7.315 7.315 7.024 0.291 17890 7491 1 10 . 1 1 63 63 TRP N N 63 124.787 124.787 119.308 5.479 17890 7492 1 10 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.190 -0.226 17890 7493 1 10 . 1 1 63 63 TRP C C 63 174.351 174.351 175.121 -0.770 17890 7494 1 10 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.322 -0.420 17890 7495 1 10 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.781 -1.664 17890 7496 1 10 . 1 1 63 63 TRP H H 63 9.544 9.544 9.002 0.542 17890 7497 1 10 . 1 1 64 64 ILE N N 64 122.482 122.482 119.477 3.005 17890 7498 1 10 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.975 -0.281 17890 7499 1 10 . 1 1 64 64 ILE C C 64 177.078 177.078 174.381 2.697 17890 7500 1 10 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.576 0.455 17890 7501 1 10 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.022 -0.653 17890 7502 1 10 . 1 1 64 64 ILE H H 64 10.235 10.235 9.425 0.810 17890 7503 1 10 . 1 1 65 65 LEU N N 65 132.183 132.183 128.435 3.748 17890 7504 1 10 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.515 -0.050 17890 7505 1 10 . 1 1 65 65 LEU C C 65 177.048 177.048 174.483 2.565 17890 7506 1 10 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.757 0.592 17890 7507 1 10 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.176 -3.832 17890 7508 1 10 . 1 1 65 65 LEU H H 65 9.432 9.432 9.224 0.208 17890 7509 1 10 . 1 1 66 66 ARG N N 66 120.807 120.807 125.587 -4.780 17890 7510 1 10 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.940 -0.052 17890 7511 1 10 . 1 1 66 66 ARG C C 66 175.275 175.275 174.436 0.839 17890 7512 1 10 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.488 0.567 17890 7513 1 10 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.490 -1.499 17890 7514 1 10 . 1 1 66 66 ARG H H 66 8.491 8.491 8.573 -0.082 17890 7515 1 10 . 1 1 67 67 SER N N 67 119.709 119.709 116.461 3.248 17890 7516 1 10 . 1 1 67 67 SER HA H 67 3.186 3.186 3.434 -0.248 17890 7517 1 10 . 1 1 67 67 SER C C 67 174.508 174.508 173.380 1.128 17890 7518 1 10 . 1 1 67 67 SER CA C 67 58.521 58.521 59.093 -0.572 17890 7519 1 10 . 1 1 67 67 SER CB C 67 62.590 62.590 63.475 -0.885 17890 7520 1 10 . 1 1 67 67 SER H H 67 8.557 8.557 8.696 -0.139 17890 7521 1 10 . 1 1 68 68 TYR N N 68 131.011 131.011 127.125 3.886 17890 7522 1 10 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.539 -0.091 17890 7523 1 10 . 1 1 68 68 TYR C C 68 174.687 174.687 174.845 -0.158 17890 7524 1 10 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.515 0.250 17890 7525 1 10 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.252 -2.264 17890 7526 1 10 . 1 1 68 68 TYR H H 68 8.531 8.531 8.476 0.055 17890 7527 1 10 . 1 1 69 69 ASP N N 69 117.066 117.066 120.306 -3.240 17890 7528 1 10 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.841 -0.216 17890 7529 1 10 . 1 1 69 69 ASP C C 69 176.455 176.455 176.122 0.333 17890 7530 1 10 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.794 -0.703 17890 7531 1 10 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.663 -0.516 17890 7532 1 10 . 1 1 69 69 ASP H H 69 7.122 7.122 7.613 -0.491 17890 7533 1 10 . 1 1 70 70 SER N N 70 122.869 122.869 119.441 3.428 17890 7534 1 10 . 1 1 70 70 SER HA H 70 4.270 4.270 4.132 0.138 17890 7535 1 10 . 1 1 70 70 SER C C 70 177.010 177.010 176.064 0.946 17890 7536 1 10 . 1 1 70 70 SER CA C 70 60.837 60.837 61.487 -0.650 17890 7537 1 10 . 1 1 70 70 SER CB C 70 62.722 62.722 63.276 -0.554 17890 7538 1 10 . 1 1 70 70 SER H H 70 8.757 8.757 8.723 0.034 17890 7539 1 10 . 1 1 71 71 ASN N N 71 119.873 119.873 119.768 0.105 17890 7540 1 10 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.602 -0.031 17890 7541 1 10 . 1 1 71 71 ASN C C 71 176.226 176.226 176.012 0.214 17890 7542 1 10 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.327 0.387 17890 7543 1 10 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.406 0.235 17890 7544 1 10 . 1 1 71 71 ASN H H 71 8.342 8.342 8.650 -0.308 17890 7545 1 10 . 1 1 72 72 SER N N 72 112.202 112.202 112.976 -0.774 17890 7546 1 10 . 1 1 72 72 SER HA H 72 4.567 4.567 4.737 -0.170 17890 7547 1 10 . 1 1 72 72 SER C C 72 173.789 173.789 173.128 0.661 17890 7548 1 10 . 1 1 72 72 SER CA C 72 57.816 57.816 57.708 0.108 17890 7549 1 10 . 1 1 72 72 SER CB C 72 63.935 63.935 64.118 -0.183 17890 7550 1 10 . 1 1 72 72 SER H H 72 7.560 7.560 7.782 -0.222 17890 7551 1 10 . 1 1 73 73 ASN N N 73 117.437 117.437 118.180 -0.743 17890 7552 1 10 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.365 0.169 17890 7553 1 10 . 1 1 73 73 ASN C C 73 173.647 173.647 174.018 -0.371 17890 7554 1 10 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.717 -0.194 17890 7555 1 10 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.069 0.144 17890 7556 1 10 . 1 1 73 73 ASN H H 73 7.940 7.940 7.824 0.116 17890 7557 1 10 . 1 1 74 74 THR N N 74 104.227 104.227 108.394 -4.167 17890 7558 1 10 . 1 1 74 74 THR HA H 74 5.477 5.477 4.971 0.506 17890 7559 1 10 . 1 1 74 74 THR C C 74 176.824 176.824 173.753 3.071 17890 7560 1 10 . 1 1 74 74 THR CA C 74 59.768 59.768 61.242 -1.474 17890 7561 1 10 . 1 1 74 74 THR CB C 74 71.985 71.985 70.355 1.630 17890 7562 1 10 . 1 1 74 74 THR H H 74 7.737 7.737 7.811 -0.074 17890 7563 1 10 . 1 1 75 75 TRP N N 75 124.636 124.636 123.057 1.579 17890 7564 1 10 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.380 -0.173 17890 7565 1 10 . 1 1 75 75 TRP C C 75 175.876 175.876 176.220 -0.344 17890 7566 1 10 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.302 1.304 17890 7567 1 10 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.549 -0.033 17890 7568 1 10 . 1 1 75 75 TRP H H 75 9.442 9.442 9.075 0.367 17890 7569 1 10 . 1 1 76 76 THR N N 76 110.544 110.544 114.862 -4.318 17890 7570 1 10 . 1 1 76 76 THR HA H 76 5.129 5.129 4.982 0.147 17890 7571 1 10 . 1 1 76 76 THR C C 76 174.506 174.506 174.532 -0.026 17890 7572 1 10 . 1 1 76 76 THR CA C 76 60.561 60.561 61.486 -0.925 17890 7573 1 10 . 1 1 76 76 THR CB C 76 71.688 71.688 69.959 1.729 17890 7574 1 10 . 1 1 76 76 THR H H 76 9.415 9.415 9.381 0.034 17890 7575 1 10 . 1 1 77 77 ILE N N 77 121.567 121.567 124.530 -2.963 17890 7576 1 10 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.138 0.001 17890 7577 1 10 . 1 1 77 77 ILE C C 77 176.148 176.148 175.090 1.058 17890 7578 1 10 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.782 1.926 17890 7579 1 10 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.514 1.472 17890 7580 1 10 . 1 1 77 77 ILE H H 77 9.255 9.255 8.483 0.772 17890 7581 1 10 . 1 1 78 78 SER N N 78 122.269 122.269 121.875 0.394 17890 7582 1 10 . 1 1 78 78 SER HA H 78 5.601 5.601 5.191 0.410 17890 7583 1 10 . 1 1 78 78 SER CA C 78 55.835 55.835 55.700 0.135 17890 7584 1 10 . 1 1 78 78 SER CB C 78 65.858 65.858 66.239 -0.381 17890 7585 1 10 . 1 1 78 78 SER H H 78 9.226 9.226 8.788 0.438 17890 7586 1 10 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.156 -0.292 17890 7587 1 10 . 1 1 79 79 PRO C C 79 178.175 178.175 177.120 1.055 17890 7588 1 10 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.519 0.365 17890 7589 1 10 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.733 -1.461 17890 7590 1 10 . 1 1 80 80 VAL N N 80 121.906 121.906 124.046 -2.140 17890 7591 1 10 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.793 -0.212 17890 7592 1 10 . 1 1 80 80 VAL C C 80 177.751 177.751 176.689 1.062 17890 7593 1 10 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.290 1.777 17890 7594 1 10 . 1 1 80 80 VAL CB C 80 31.485 31.485 32.001 -0.516 17890 7595 1 10 . 1 1 80 80 VAL H H 80 7.328 7.328 7.784 -0.456 17890 7596 1 10 . 1 1 81 81 GLY N N 81 104.643 104.643 105.770 -1.127 17890 7597 1 10 . 1 1 81 81 GLY C C 81 174.979 174.979 174.394 0.585 17890 7598 1 10 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.355 -0.267 17890 7599 1 10 . 1 1 81 81 GLY H H 81 8.949 8.949 8.302 0.647 17890 7600 1 10 . 1 1 82 82 SER N N 82 111.865 111.865 116.187 -4.322 17890 7601 1 10 . 1 1 82 82 SER HA H 82 4.646 4.646 4.824 -0.178 17890 7602 1 10 . 1 1 82 82 SER CA C 82 55.441 55.441 55.029 0.412 17890 7603 1 10 . 1 1 82 82 SER CB C 82 62.277 62.277 63.892 -1.615 17890 7604 1 10 . 1 1 82 82 SER H H 82 6.968 6.968 7.261 -0.293 17890 7605 1 10 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.420 -0.073 17890 7606 1 10 . 1 1 83 83 PRO C C 83 176.660 176.660 176.607 0.053 17890 7607 1 10 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.548 0.655 17890 7608 1 10 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.897 0.922 17890 7609 1 10 . 1 1 84 84 ASN N N 84 116.542 116.542 114.618 1.924 17890 7610 1 10 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.601 0.400 17890 7611 1 10 . 1 1 84 84 ASN C C 84 175.825 175.825 175.200 0.625 17890 7612 1 10 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.621 -0.730 17890 7613 1 10 . 1 1 84 84 ASN CB C 84 38.744 38.744 37.748 0.996 17890 7614 1 10 . 1 1 84 84 ASN H H 84 8.502 8.502 8.521 -0.019 17890 7615 1 10 . 1 1 85 85 SER N N 85 114.633 114.633 113.327 1.306 17890 7616 1 10 . 1 1 85 85 SER HA H 85 4.624 4.624 4.821 -0.197 17890 7617 1 10 . 1 1 85 85 SER C C 85 172.963 172.963 172.233 0.730 17890 7618 1 10 . 1 1 85 85 SER CA C 85 59.210 59.210 57.758 1.452 17890 7619 1 10 . 1 1 85 85 SER CB C 85 64.697 64.697 66.389 -1.692 17890 7620 1 10 . 1 1 85 85 SER H H 85 7.980 7.980 7.770 0.210 17890 7621 1 10 . 1 1 86 86 GLN N N 86 119.016 119.016 118.041 0.975 17890 7622 1 10 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.244 0.202 17890 7623 1 10 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.325 0.127 17890 7624 1 10 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.082 0.316 17890 7625 1 10 . 1 1 86 86 GLN H H 86 9.399 9.399 9.112 0.287 17890 7626 1 10 . 1 1 87 87 ILE N N 87 119.691 119.691 119.561 0.130 17890 7627 1 10 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.112 -0.537 17890 7628 1 10 . 1 1 87 87 ILE C C 87 176.505 176.505 175.983 0.522 17890 7629 1 10 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.988 4.506 17890 7630 1 10 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.468 -0.271 17890 7631 1 10 . 1 1 87 87 ILE H H 87 8.970 8.970 8.449 0.521 17890 7632 1 10 . 1 1 88 88 GLY N N 88 118.378 118.378 114.943 3.435 17890 7633 1 10 . 1 1 88 88 GLY C C 88 171.397 171.397 171.680 -0.283 17890 7634 1 10 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.719 -1.115 17890 7635 1 10 . 1 1 88 88 GLY H H 88 9.752 9.752 9.094 0.658 17890 7636 1 10 . 1 1 89 89 TRP N N 89 122.749 122.749 122.307 0.442 17890 7637 1 10 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.363 -0.765 17890 7638 1 10 . 1 1 89 89 TRP C C 89 175.924 175.924 174.935 0.989 17890 7639 1 10 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.295 -0.012 17890 7640 1 10 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.682 -2.596 17890 7641 1 10 . 1 1 89 89 TRP H H 89 8.215 8.215 8.394 -0.179 17890 7642 1 10 . 1 1 90 90 GLY N N 90 116.305 116.305 111.207 5.098 17890 7643 1 10 . 1 1 90 90 GLY C C 90 173.725 173.725 173.000 0.725 17890 7644 1 10 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.466 0.589 17890 7645 1 10 . 1 1 90 90 GLY H H 90 8.922 8.922 8.130 0.792 17890 7646 1 10 . 1 1 91 91 ALA N N 91 123.795 123.795 121.991 1.804 17890 7647 1 10 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.158 0.085 17890 7648 1 10 . 1 1 91 91 ALA C C 91 178.510 178.510 178.952 -0.442 17890 7649 1 10 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.462 0.028 17890 7650 1 10 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.797 -0.388 17890 7651 1 10 . 1 1 91 91 ALA H H 91 8.367 8.367 8.172 0.195 17890 7652 1 10 . 1 1 92 92 GLY N N 92 108.871 108.871 112.744 -3.873 17890 7653 1 10 . 1 1 92 92 GLY C C 92 174.528 174.528 174.808 -0.280 17890 7654 1 10 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.715 0.543 17890 7655 1 10 . 1 1 92 92 GLY H H 92 8.776 8.776 8.614 0.162 17890 7656 1 10 . 1 1 93 93 ASN N N 93 114.921 114.921 117.259 -2.338 17890 7657 1 10 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.763 -0.314 17890 7658 1 10 . 1 1 93 93 ASN C C 93 172.774 172.774 174.049 -1.275 17890 7659 1 10 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.390 0.583 17890 7660 1 10 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.939 -0.610 17890 7661 1 10 . 1 1 93 93 ASN H H 93 8.647 8.647 8.283 0.364 17890 7662 1 10 . 1 1 94 94 VAL N N 94 112.437 112.437 112.782 -0.345 17890 7663 1 10 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.646 0.419 17890 7664 1 10 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.411 -1.496 17890 7665 1 10 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.478 -0.323 17890 7666 1 10 . 1 1 94 94 VAL H H 94 6.989 6.989 7.447 -0.458 17890 7667 1 10 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.993 -0.065 17890 7668 1 10 . 1 1 95 95 PRO C C 95 176.041 176.041 176.067 -0.026 17890 7669 1 10 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.335 -1.134 17890 7670 1 10 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.567 -0.842 17890 7671 1 10 . 1 1 96 96 VAL N N 96 113.564 113.564 117.388 -3.824 17890 7672 1 10 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.785 -0.050 17890 7673 1 10 . 1 1 96 96 VAL C C 96 173.656 173.656 175.298 -1.642 17890 7674 1 10 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.795 -0.942 17890 7675 1 10 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.355 1.798 17890 7676 1 10 . 1 1 96 96 VAL H H 96 8.199 8.199 8.850 -0.651 17890 7677 1 10 . 1 1 97 97 VAL N N 97 122.328 122.328 124.593 -2.265 17890 7678 1 10 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.603 0.028 17890 7679 1 10 . 1 1 97 97 VAL C C 97 174.776 174.776 175.363 -0.587 17890 7680 1 10 . 1 1 97 97 VAL CA C 97 63.657 63.657 64.051 -0.394 17890 7681 1 10 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.396 -0.268 17890 7682 1 10 . 1 1 97 97 VAL H H 97 8.957 8.957 8.475 0.482 17890 7683 1 10 . 1 1 98 98 LEU N N 98 130.258 130.258 128.869 1.389 17890 7684 1 10 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.997 0.053 17890 7685 1 10 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.356 1.467 17890 7686 1 10 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.205 0.913 17890 7687 1 10 . 1 1 98 98 LEU H H 98 9.245 9.245 9.015 0.230 17890 7688 1 10 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.832 -0.053 17890 7689 1 10 . 1 1 99 99 PRO CA C 99 61.489 61.489 60.776 0.713 17890 7690 1 10 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.186 -0.731 17890 7691 1 10 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.532 -0.547 17890 7692 1 10 . 1 1 100 100 PRO C C 100 177.309 177.309 175.837 1.472 17890 7693 1 10 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.665 0.159 17890 7694 1 10 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.017 0.088 17890 7695 1 10 . 1 1 101 101 ASN N N 101 119.284 119.284 125.285 -6.001 17890 7696 1 10 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.620 -0.078 17890 7697 1 10 . 1 1 101 101 ASN C C 101 171.920 171.920 173.819 -1.899 17890 7698 1 10 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.802 -0.602 17890 7699 1 10 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.441 -1.816 17890 7700 1 10 . 1 1 101 101 ASN H H 101 7.273 7.273 9.349 -2.076 17890 7701 1 10 . 1 1 102 102 ASN N N 102 115.674 115.674 116.241 -0.567 17890 7702 1 10 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.693 -0.775 17890 7703 1 10 . 1 1 102 102 ASN C C 102 173.264 173.264 174.287 -1.023 17890 7704 1 10 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.776 1.263 17890 7705 1 10 . 1 1 102 102 ASN CB C 102 36.982 36.982 37.942 -0.960 17890 7706 1 10 . 1 1 102 102 ASN H H 102 8.197 8.197 7.754 0.443 17890 7707 1 10 . 1 1 103 103 TYR N N 103 118.775 118.775 121.615 -2.840 17890 7708 1 10 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.328 0.157 17890 7709 1 10 . 1 1 103 103 TYR C C 103 175.248 175.248 174.868 0.380 17890 7710 1 10 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.866 -2.376 17890 7711 1 10 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.410 -0.878 17890 7712 1 10 . 1 1 103 103 TYR H H 103 7.745 7.745 7.236 0.509 17890 7713 1 10 . 1 1 104 104 VAL N N 104 116.205 116.205 116.127 0.078 17890 7714 1 10 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.935 0.042 17890 7715 1 10 . 1 1 104 104 VAL C C 104 174.361 174.361 173.493 0.868 17890 7716 1 10 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.699 -1.448 17890 7717 1 10 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.318 0.225 17890 7718 1 10 . 1 1 104 104 VAL H H 104 7.498 7.498 8.006 -0.508 17890 7719 1 10 . 1 1 105 105 TRP N N 105 119.557 119.557 119.524 0.033 17890 7720 1 10 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.101 -0.226 17890 7721 1 10 . 1 1 105 105 TRP C C 105 175.526 175.526 176.383 -0.857 17890 7722 1 10 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.373 -0.489 17890 7723 1 10 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.584 -0.045 17890 7724 1 10 . 1 1 105 105 TRP H H 105 8.926 8.926 8.956 -0.030 17890 7725 1 10 . 1 1 106 106 THR N N 106 120.480 120.480 119.662 0.818 17890 7726 1 10 . 1 1 106 106 THR HA H 106 4.966 4.966 4.775 0.191 17890 7727 1 10 . 1 1 106 106 THR C C 106 174.177 174.177 174.338 -0.161 17890 7728 1 10 . 1 1 106 106 THR CA C 106 62.091 62.091 63.770 -1.679 17890 7729 1 10 . 1 1 106 106 THR CB C 106 69.649 69.649 69.299 0.350 17890 7730 1 10 . 1 1 106 106 THR H H 106 9.525 9.525 9.241 0.284 17890 7731 1 10 . 1 1 107 107 LEU N N 107 127.146 127.146 129.912 -2.766 17890 7732 1 10 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.059 -0.232 17890 7733 1 10 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.353 0.356 17890 7734 1 10 . 1 1 107 107 LEU CB C 107 41.523 41.523 41.654 -0.131 17890 7735 1 10 . 1 1 107 107 LEU H H 107 7.591 7.591 8.658 -1.067 17890 7736 1 10 . 1 1 108 108 THR N N 108 119.928 119.928 119.670 0.258 17890 7737 1 10 . 1 1 108 108 THR HA H 108 4.411 4.411 4.323 0.088 17890 7738 1 10 . 1 1 108 108 THR C C 108 173.319 173.319 173.657 -0.338 17890 7739 1 10 . 1 1 108 108 THR CA C 108 62.243 62.243 63.234 -0.991 17890 7740 1 10 . 1 1 108 108 THR CB C 108 70.138 70.138 69.514 0.624 17890 7741 1 10 . 1 1 108 108 THR H H 108 8.141 8.141 8.002 0.139 17890 7742 1 10 . 1 1 109 109 LEU N N 109 130.557 130.557 129.758 0.799 17890 7743 1 10 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.991 -0.446 17890 7744 1 10 . 1 1 109 109 LEU C C 109 175.217 175.217 176.437 -1.220 17890 7745 1 10 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.246 0.040 17890 7746 1 10 . 1 1 109 109 LEU CB C 109 40.606 40.606 43.195 -2.589 17890 7747 1 10 . 1 1 109 109 LEU H H 109 8.924 8.924 8.648 0.276 17890 7748 1 10 . 1 1 110 110 THR N N 110 120.160 120.160 115.763 4.397 17890 7749 1 10 . 1 1 110 110 THR HA H 110 4.911 4.911 4.665 0.246 17890 7750 1 10 . 1 1 110 110 THR CA C 110 60.141 60.141 60.258 -0.117 17890 7751 1 10 . 1 1 110 110 THR CB C 110 72.785 72.785 70.912 1.873 17890 7752 1 10 . 1 1 110 110 THR H H 110 7.677 7.677 8.587 -0.910 17890 7753 1 10 . 1 1 111 111 SER HA H 111 4.204 4.204 4.149 0.055 17890 7754 1 10 . 1 1 111 111 SER C C 111 174.755 174.755 174.603 0.152 17890 7755 1 10 . 1 1 111 111 SER CA C 111 60.710 60.710 60.331 0.379 17890 7756 1 10 . 1 1 111 111 SER CB C 111 62.660 62.660 63.039 -0.379 17890 7757 1 10 . 1 1 112 112 GLY N N 112 107.313 107.313 104.413 2.900 17890 7758 1 10 . 1 1 112 112 GLY C C 112 173.023 173.023 173.271 -0.248 17890 7759 1 10 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.326 -1.176 17890 7760 1 10 . 1 1 112 112 GLY H H 112 8.249 8.249 7.402 0.847 17890 7761 1 10 . 1 1 113 113 GLY N N 113 105.618 105.618 108.073 -2.455 17890 7762 1 10 . 1 1 113 113 GLY C C 113 175.844 175.844 171.602 4.242 17890 7763 1 10 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.837 -3.078 17890 7764 1 10 . 1 1 113 113 GLY H H 113 7.444 7.444 7.359 0.085 17890 7765 1 10 . 1 1 114 114 TYR N N 114 121.548 121.548 118.328 3.220 17890 7766 1 10 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.452 -0.600 17890 7767 1 10 . 1 1 114 114 TYR C C 114 175.605 175.605 174.181 1.424 17890 7768 1 10 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.520 4.743 17890 7769 1 10 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.546 -4.613 17890 7770 1 10 . 1 1 114 114 TYR H H 114 9.677 9.677 8.947 0.730 17890 7771 1 10 . 1 1 115 115 ASN N N 115 123.274 123.274 117.802 5.472 17890 7772 1 10 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.212 -0.114 17890 7773 1 10 . 1 1 115 115 ASN C C 115 174.355 174.355 173.072 1.283 17890 7774 1 10 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.552 -1.506 17890 7775 1 10 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.650 -2.301 17890 7776 1 10 . 1 1 115 115 ASN H H 115 9.350 9.350 8.976 0.374 17890 7777 1 10 . 1 1 116 116 ILE N N 116 130.611 130.611 122.713 7.898 17890 7778 1 10 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.845 -0.606 17890 7779 1 10 . 1 1 116 116 ILE C C 116 173.998 173.998 174.359 -0.361 17890 7780 1 10 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.880 2.319 17890 7781 1 10 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.618 -2.518 17890 7782 1 10 . 1 1 116 116 ILE H H 116 9.473 9.473 8.491 0.982 17890 7783 1 10 . 1 1 117 117 GLN N N 117 121.633 121.633 125.536 -3.903 17890 7784 1 10 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.044 0.891 17890 7785 1 10 . 1 1 117 117 GLN C C 117 177.902 177.902 175.930 1.972 17890 7786 1 10 . 1 1 117 117 GLN CA C 117 53.320 53.320 54.050 -0.730 17890 7787 1 10 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.646 3.811 17890 7788 1 10 . 1 1 117 117 GLN H H 117 8.781 8.781 8.656 0.125 17890 7789 1 10 . 1 1 118 118 ASP N N 118 116.836 116.836 120.179 -3.343 17890 7790 1 10 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.869 0.914 17890 7791 1 10 . 1 1 118 118 ASP C C 118 178.084 178.084 176.742 1.342 17890 7792 1 10 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.453 -1.683 17890 7793 1 10 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.281 -0.913 17890 7794 1 10 . 1 1 118 118 ASP H H 118 9.330 9.330 8.528 0.802 17890 7795 1 10 . 1 1 119 119 GLY N N 119 111.037 111.037 107.455 3.582 17890 7796 1 10 . 1 1 119 119 GLY C C 119 174.196 174.196 175.141 -0.945 17890 7797 1 10 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.841 2.135 17890 7798 1 10 . 1 1 119 119 GLY H H 119 8.986 8.986 8.246 0.740 17890 7799 1 10 . 1 1 120 120 LYS N N 120 114.809 114.809 121.256 -6.447 17890 7800 1 10 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.353 -0.004 17890 7801 1 10 . 1 1 120 120 LYS C C 120 175.174 175.174 177.003 -1.829 17890 7802 1 10 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.463 0.470 17890 7803 1 10 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.379 0.097 17890 7804 1 10 . 1 1 120 120 LYS H H 120 7.045 7.045 8.647 -1.602 17890 7805 1 10 . 1 1 121 121 ARG N N 121 116.291 116.291 113.032 3.259 17890 7806 1 10 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.026 -0.440 17890 7807 1 10 . 1 1 121 121 ARG C C 121 175.097 175.097 176.865 -1.768 17890 7808 1 10 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.342 0.727 17890 7809 1 10 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.554 0.069 17890 7810 1 10 . 1 1 121 121 ARG H H 121 7.683 7.683 8.159 -0.476 17890 7811 1 10 . 1 1 122 122 THR N N 122 113.730 113.730 109.041 4.689 17890 7812 1 10 . 1 1 122 122 THR HA H 122 4.540 4.540 4.294 0.246 17890 7813 1 10 . 1 1 122 122 THR C C 122 175.302 175.302 174.486 0.816 17890 7814 1 10 . 1 1 122 122 THR CA C 122 62.871 62.871 64.096 -1.224 17890 7815 1 10 . 1 1 122 122 THR CB C 122 71.552 71.552 70.094 1.458 17890 7816 1 10 . 1 1 122 122 THR H H 122 11.059 11.059 8.075 2.984 17890 7817 1 10 . 1 1 123 123 VAL N N 123 118.350 118.350 115.162 3.188 17890 7818 1 10 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.568 0.242 17890 7819 1 10 . 1 1 123 123 VAL C C 123 174.730 174.730 173.657 1.073 17890 7820 1 10 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.151 0.160 17890 7821 1 10 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.873 2.208 17890 7822 1 10 . 1 1 123 123 VAL H H 123 8.181 8.181 7.455 0.726 17890 7823 1 10 . 1 1 124 124 SER N N 124 113.053 113.053 114.043 -0.990 17890 7824 1 10 . 1 1 124 124 SER HA H 124 5.820 5.820 5.211 0.609 17890 7825 1 10 . 1 1 124 124 SER C C 124 175.521 175.521 173.473 2.048 17890 7826 1 10 . 1 1 124 124 SER CA C 124 58.087 58.087 56.881 1.206 17890 7827 1 10 . 1 1 124 124 SER CB C 124 67.405 67.405 66.054 1.351 17890 7828 1 10 . 1 1 124 124 SER H H 124 9.138 9.138 8.677 0.461 17890 7829 1 10 . 1 1 125 125 TRP N N 125 124.900 124.900 124.375 0.525 17890 7830 1 10 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.034 0.576 17890 7831 1 10 . 1 1 125 125 TRP C C 125 178.114 178.114 177.522 0.592 17890 7832 1 10 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.391 -0.917 17890 7833 1 10 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.927 1.097 17890 7834 1 10 . 1 1 125 125 TRP H H 125 8.843 8.843 8.078 0.765 17890 7835 1 10 . 1 1 126 126 SER N N 126 119.243 119.243 113.902 5.341 17890 7836 1 10 . 1 1 126 126 SER HA H 126 5.443 5.443 5.319 0.124 17890 7837 1 10 . 1 1 126 126 SER C C 126 171.668 171.668 172.941 -1.273 17890 7838 1 10 . 1 1 126 126 SER CA C 126 58.696 58.696 57.142 1.554 17890 7839 1 10 . 1 1 126 126 SER CB C 126 66.176 66.176 66.421 -0.245 17890 7840 1 10 . 1 1 126 126 SER H H 126 9.835 9.835 9.185 0.650 17890 7841 1 10 . 1 1 127 127 LEU N N 127 113.708 113.708 117.665 -3.957 17890 7842 1 10 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.708 0.447 17890 7843 1 10 . 1 1 127 127 LEU C C 127 176.563 176.563 176.654 -0.091 17890 7844 1 10 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.627 -0.982 17890 7845 1 10 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.421 -1.725 17890 7846 1 10 . 1 1 127 127 LEU H H 127 6.559 6.559 8.144 -1.585 17890 7847 1 10 . 1 1 128 128 ASN N N 128 121.739 121.739 118.953 2.786 17890 7848 1 10 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.955 -0.266 17890 7849 1 10 . 1 1 128 128 ASN C C 128 175.452 175.452 175.318 0.134 17890 7850 1 10 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.876 1.131 17890 7851 1 10 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.406 -1.115 17890 7852 1 10 . 1 1 128 128 ASN H H 128 8.662 8.662 9.373 -0.711 17890 7853 1 10 . 1 1 129 129 ASN N N 129 119.586 119.586 116.299 3.287 17890 7854 1 10 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.997 -0.000 17890 7855 1 10 . 1 1 129 129 ASN C C 129 175.900 175.900 174.811 1.089 17890 7856 1 10 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.279 0.955 17890 7857 1 10 . 1 1 129 129 ASN CB C 129 41.256 41.256 40.995 0.261 17890 7858 1 10 . 1 1 129 129 ASN H H 129 10.962 10.962 8.806 2.156 17890 7859 1 10 . 1 1 130 130 ALA N N 130 128.292 128.292 121.760 6.532 17890 7860 1 10 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.030 -0.460 17890 7861 1 10 . 1 1 130 130 ALA C C 130 172.620 172.620 175.857 -3.237 17890 7862 1 10 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.212 -0.573 17890 7863 1 10 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.589 -1.489 17890 7864 1 10 . 1 1 130 130 ALA H H 130 10.629 10.629 8.630 1.999 17890 7865 1 10 . 1 1 131 131 THR N N 131 105.584 105.584 109.623 -4.039 17890 7866 1 10 . 1 1 131 131 THR HA H 131 4.462 4.462 4.291 0.171 17890 7867 1 10 . 1 1 131 131 THR C C 131 173.552 173.552 174.430 -0.878 17890 7868 1 10 . 1 1 131 131 THR CA C 131 58.338 58.338 61.227 -2.889 17890 7869 1 10 . 1 1 131 131 THR CB C 131 71.569 71.569 69.691 1.878 17890 7870 1 10 . 1 1 131 131 THR H H 131 7.092 7.092 7.813 -0.721 17890 7871 1 10 . 1 1 132 132 ALA N N 132 121.773 121.773 125.555 -3.782 17890 7872 1 10 . 1 1 132 132 ALA HA H 132 3.749 3.749 3.992 -0.243 17890 7873 1 10 . 1 1 132 132 ALA C C 132 178.819 178.819 178.573 0.246 17890 7874 1 10 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.555 1.729 17890 7875 1 10 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.818 -0.591 17890 7876 1 10 . 1 1 132 132 ALA H H 132 8.952 8.952 8.242 0.710 17890 7877 1 10 . 1 1 133 133 GLY N N 133 113.965 113.965 111.723 2.242 17890 7878 1 10 . 1 1 133 133 GLY C C 133 173.453 173.453 174.133 -0.680 17890 7879 1 10 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.908 0.258 17890 7880 1 10 . 1 1 133 133 GLY H H 133 9.016 9.016 8.770 0.246 17890 7881 1 10 . 1 1 134 134 GLU N N 134 123.460 123.460 121.418 2.042 17890 7882 1 10 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.332 -0.374 17890 7883 1 10 . 1 1 134 134 GLU C C 134 176.120 176.120 176.234 -0.114 17890 7884 1 10 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.773 1.626 17890 7885 1 10 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.965 0.420 17890 7886 1 10 . 1 1 134 134 GLU H H 134 7.598 7.598 7.591 0.007 17890 7887 1 10 . 1 1 135 135 GLU N N 135 122.633 122.633 125.308 -2.675 17890 7888 1 10 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.340 -0.029 17890 7889 1 10 . 1 1 135 135 GLU C C 135 176.014 176.014 176.589 -0.575 17890 7890 1 10 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.715 -0.533 17890 7891 1 10 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.274 -0.821 17890 7892 1 10 . 1 1 135 135 GLU H H 135 8.258 8.258 8.648 -0.390 17890 7893 1 10 . 1 1 136 136 VAL N N 136 123.635 123.635 125.930 -2.295 17890 7894 1 10 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.812 -0.120 17890 7895 1 10 . 1 1 136 136 VAL C C 136 173.932 173.932 175.769 -1.837 17890 7896 1 10 . 1 1 136 136 VAL CA C 136 63.832 63.832 64.301 -0.469 17890 7897 1 10 . 1 1 136 136 VAL CB C 136 31.864 31.864 31.841 0.023 17890 7898 1 10 . 1 1 136 136 VAL H H 136 7.267 7.267 7.699 -0.432 17890 7899 1 10 . 1 1 137 137 SER N N 137 118.950 118.950 117.819 1.131 17890 7900 1 10 . 1 1 137 137 SER HA H 137 4.887 4.887 5.107 -0.220 17890 7901 1 10 . 1 1 137 137 SER C C 137 173.780 173.780 173.430 0.350 17890 7902 1 10 . 1 1 137 137 SER CA C 137 57.895 57.895 56.217 1.678 17890 7903 1 10 . 1 1 137 137 SER CB C 137 65.027 65.027 66.614 -1.587 17890 7904 1 10 . 1 1 137 137 SER H H 137 8.454 8.454 8.643 -0.189 17890 7905 1 10 . 1 1 138 138 ILE N N 138 123.511 123.511 119.951 3.560 17890 7906 1 10 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.085 -0.837 17890 7907 1 10 . 1 1 138 138 ILE C C 138 176.142 176.142 175.733 0.409 17890 7908 1 10 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.890 0.960 17890 7909 1 10 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.905 -3.310 17890 7910 1 10 . 1 1 138 138 ILE H H 138 7.915 7.915 8.302 -0.387 17890 7911 1 10 . 1 1 139 139 GLY N N 139 115.638 115.638 111.060 4.578 17890 7912 1 10 . 1 1 139 139 GLY C C 139 171.947 171.947 173.295 -1.348 17890 7913 1 10 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.397 1.689 17890 7914 1 10 . 1 1 139 139 GLY H H 139 8.490 8.490 8.419 0.071 17890 7915 1 10 . 1 1 140 140 ALA N N 140 128.563 128.563 121.656 6.907 17890 7916 1 10 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.359 0.037 17890 7917 1 10 . 1 1 140 140 ALA C C 140 177.956 177.956 176.803 1.153 17890 7918 1 10 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.307 -1.661 17890 7919 1 10 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.780 0.424 17890 7920 1 10 . 1 1 140 140 ALA H H 140 8.531 8.531 8.488 0.043 17890 7921 1 10 . 1 1 141 141 ASP N N 141 120.886 120.886 113.250 7.636 17890 7922 1 10 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.581 0.017 17890 7923 1 10 . 1 1 141 141 ASP C C 141 175.411 175.411 173.996 1.415 17890 7924 1 10 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.161 0.755 17890 7925 1 10 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.956 -1.264 17890 7926 1 10 . 1 1 141 141 ASP H H 141 8.507 8.507 7.690 0.817 17890 7927 1 10 . 1 1 142 142 ALA N N 142 125.604 125.604 121.588 4.016 17890 7928 1 10 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.648 -0.131 17890 7929 1 10 . 1 1 142 142 ALA C C 142 177.671 177.671 178.511 -0.840 17890 7930 1 10 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.415 0.578 17890 7931 1 10 . 1 1 142 142 ALA CB C 142 21.535 21.535 22.254 -0.719 17890 7932 1 10 . 1 1 142 142 ALA H H 142 7.894 7.894 8.257 -0.363 17890 7933 1 10 . 1 1 143 143 THR N N 143 118.085 118.085 117.187 0.898 17890 7934 1 10 . 1 1 143 143 THR HA H 143 3.744 3.744 4.149 -0.405 17890 7935 1 10 . 1 1 143 143 THR C C 143 175.464 175.464 174.948 0.516 17890 7936 1 10 . 1 1 143 143 THR CA C 143 64.548 64.548 64.831 -0.283 17890 7937 1 10 . 1 1 143 143 THR CB C 143 69.305 69.305 68.902 0.403 17890 7938 1 10 . 1 1 143 143 THR H H 143 8.268 8.268 8.876 -0.608 17890 7939 1 10 . 1 1 144 144 PHE N N 144 118.635 118.635 116.083 2.552 17890 7940 1 10 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.722 -0.376 17890 7941 1 10 . 1 1 144 144 PHE C C 144 176.209 176.209 174.936 1.273 17890 7942 1 10 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.607 3.855 17890 7943 1 10 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.197 0.408 17890 7944 1 10 . 1 1 144 144 PHE H H 144 8.719 8.719 7.964 0.755 17890 7945 1 10 . 1 1 145 145 SER N N 145 113.446 113.446 115.032 -1.586 17890 7946 1 10 . 1 1 145 145 SER HA H 145 4.866 4.866 4.068 0.798 17890 7947 1 10 . 1 1 145 145 SER C C 145 176.605 176.605 175.976 0.629 17890 7948 1 10 . 1 1 145 145 SER CA C 145 59.432 59.432 57.559 1.873 17890 7949 1 10 . 1 1 145 145 SER CB C 145 62.167 62.167 63.024 -0.857 17890 7950 1 10 . 1 1 145 145 SER H H 145 8.657 8.657 7.262 1.395 17890 7951 1 10 . 1 1 146 146 GLY N N 146 109.277 109.277 111.274 -1.997 17890 7952 1 10 . 1 1 146 146 GLY C C 146 174.293 174.293 173.288 1.005 17890 7953 1 10 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.144 -0.204 17890 7954 1 10 . 1 1 146 146 GLY H H 146 7.467 7.467 7.682 -0.215 17890 7955 1 10 . 1 1 147 147 ARG N N 147 122.863 122.863 118.161 4.702 17890 7956 1 10 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.785 0.656 17890 7957 1 10 . 1 1 147 147 ARG C C 147 173.849 173.849 174.357 -0.508 17890 7958 1 10 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.864 -2.637 17890 7959 1 10 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.715 -1.118 17890 7960 1 10 . 1 1 147 147 ARG H H 147 7.556 7.556 7.076 0.480 17890 7961 1 10 . 1 1 148 148 TRP N N 148 118.465 118.465 120.974 -2.509 17890 7962 1 10 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.097 -0.251 17890 7963 1 10 . 1 1 148 148 TRP C C 148 174.353 174.353 174.194 0.159 17890 7964 1 10 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.950 -1.288 17890 7965 1 10 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.373 -1.375 17890 7966 1 10 . 1 1 148 148 TRP H H 148 8.709 8.709 9.238 -0.529 17890 7967 1 10 . 1 1 149 149 VAL N N 149 125.852 125.852 118.067 7.785 17890 7968 1 10 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.588 -0.445 17890 7969 1 10 . 1 1 149 149 VAL C C 149 173.613 173.613 173.371 0.242 17890 7970 1 10 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.907 1.833 17890 7971 1 10 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.191 -2.808 17890 7972 1 10 . 1 1 149 149 VAL H H 149 9.700 9.700 8.837 0.863 17890 7973 1 10 . 1 1 150 150 ILE N N 150 125.140 125.140 126.717 -1.577 17890 7974 1 10 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.094 -0.232 17890 7975 1 10 . 1 1 150 150 ILE C C 150 175.661 175.661 174.806 0.855 17890 7976 1 10 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.414 1.407 17890 7977 1 10 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.227 -0.408 17890 7978 1 10 . 1 1 150 150 ILE H H 150 7.747 7.747 7.884 -0.137 17890 7979 1 10 . 1 1 151 151 GLU N N 151 126.762 126.762 127.788 -1.026 17890 7980 1 10 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.819 0.061 17890 7981 1 10 . 1 1 151 151 GLU C C 151 174.424 174.424 174.807 -0.383 17890 7982 1 10 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.161 0.635 17890 7983 1 10 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.929 0.322 17890 7984 1 10 . 1 1 151 151 GLU H H 151 8.892 8.892 8.863 0.029 17890 7985 1 10 . 1 1 152 152 LYS N N 152 126.299 126.299 122.989 3.310 17890 7986 1 10 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.697 0.164 17890 7987 1 10 . 1 1 152 152 LYS C C 152 176.282 176.282 176.687 -0.405 17890 7988 1 10 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.755 0.750 17890 7989 1 10 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.527 0.809 17890 7990 1 10 . 1 1 152 152 LYS H H 152 8.640 8.640 8.425 0.215 17890 7991 1 11 . 1 1 2 2 GLY CA C 2 43.294 43.294 46.172 -2.878 17890 7992 1 11 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.116 0.506 17890 7993 1 11 . 1 1 8 8 HIS CA C 8 55.661 55.661 57.721 -2.060 17890 7994 1 11 . 1 1 8 8 HIS CB C 8 29.880 29.880 26.928 2.952 17890 7995 1 11 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.933 -0.287 17890 7996 1 11 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.111 0.573 17890 7997 1 11 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.410 -0.579 17890 7998 1 11 . 1 1 10 10 HIS N N 10 120.811 120.811 116.957 3.854 17890 7999 1 11 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.716 -0.036 17890 8000 1 11 . 1 1 10 10 HIS C C 10 174.875 174.875 175.185 -0.310 17890 8001 1 11 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.288 -0.542 17890 8002 1 11 . 1 1 10 10 HIS CB C 10 29.889 29.889 30.550 -0.661 17890 8003 1 11 . 1 1 10 10 HIS H H 10 8.583 8.583 8.202 0.381 17890 8004 1 11 . 1 1 11 11 SER N N 11 118.009 118.009 113.713 4.296 17890 8005 1 11 . 1 1 11 11 SER HA H 11 4.424 4.424 4.492 -0.068 17890 8006 1 11 . 1 1 11 11 SER C C 11 174.962 174.962 174.401 0.561 17890 8007 1 11 . 1 1 11 11 SER CA C 11 58.660 58.660 57.868 0.792 17890 8008 1 11 . 1 1 11 11 SER CB C 11 63.822 63.822 64.193 -0.371 17890 8009 1 11 . 1 1 11 11 SER H H 11 8.438 8.438 8.132 0.306 17890 8010 1 11 . 1 1 12 12 GLY N N 12 111.011 111.011 108.776 2.235 17890 8011 1 11 . 1 1 12 12 GLY C C 12 173.907 173.907 172.231 1.676 17890 8012 1 11 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.307 0.114 17890 8013 1 11 . 1 1 12 12 GLY H H 12 8.433 8.433 7.784 0.649 17890 8014 1 11 . 1 1 13 13 ASP N N 13 120.291 120.291 118.087 2.204 17890 8015 1 11 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.857 -0.195 17890 8016 1 11 . 1 1 13 13 ASP C C 13 176.115 176.115 175.127 0.988 17890 8017 1 11 . 1 1 13 13 ASP CA C 13 54.303 54.303 54.359 -0.056 17890 8018 1 11 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.560 -0.095 17890 8019 1 11 . 1 1 13 13 ASP H H 13 8.153 8.153 8.413 -0.260 17890 8020 1 11 . 1 1 14 14 SER N N 14 116.987 116.987 115.197 1.790 17890 8021 1 11 . 1 1 14 14 SER HA H 14 4.754 4.754 4.749 0.005 17890 8022 1 11 . 1 1 14 14 SER CA C 14 56.469 56.469 56.916 -0.447 17890 8023 1 11 . 1 1 14 14 SER CB C 14 63.553 63.553 63.737 -0.184 17890 8024 1 11 . 1 1 14 14 SER H H 14 8.210 8.210 7.548 0.662 17890 8025 1 11 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.438 0.004 17890 8026 1 11 . 1 1 15 15 PRO C C 15 176.424 176.424 176.110 0.314 17890 8027 1 11 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.013 0.220 17890 8028 1 11 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.193 -0.045 17890 8029 1 11 . 1 1 16 16 ALA N N 16 124.219 124.219 123.172 1.047 17890 8030 1 11 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.503 -0.153 17890 8031 1 11 . 1 1 16 16 ALA C C 16 177.552 177.552 176.450 1.102 17890 8032 1 11 . 1 1 16 16 ALA CA C 16 52.433 52.433 51.913 0.520 17890 8033 1 11 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.250 0.069 17890 8034 1 11 . 1 1 16 16 ALA H H 16 8.284 8.284 8.214 0.070 17890 8035 1 11 . 1 1 17 17 VAL N N 17 119.504 119.504 117.336 2.168 17890 8036 1 11 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.446 -0.197 17890 8037 1 11 . 1 1 17 17 VAL C C 17 176.322 176.322 174.970 1.352 17890 8038 1 11 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.276 0.002 17890 8039 1 11 . 1 1 17 17 VAL CB C 17 32.957 32.957 34.094 -1.137 17890 8040 1 11 . 1 1 17 17 VAL H H 17 8.046 8.046 7.465 0.581 17890 8041 1 11 . 1 1 18 18 THR N N 18 118.186 118.186 119.311 -1.125 17890 8042 1 11 . 1 1 18 18 THR HA H 18 4.473 4.473 4.593 -0.120 17890 8043 1 11 . 1 1 18 18 THR C C 18 174.248 174.248 174.613 -0.365 17890 8044 1 11 . 1 1 18 18 THR CA C 18 61.565 61.565 61.849 -0.284 17890 8045 1 11 . 1 1 18 18 THR CB C 18 70.165 70.165 69.418 0.747 17890 8046 1 11 . 1 1 18 18 THR H H 18 8.276 8.276 8.496 -0.220 17890 8047 1 11 . 1 1 19 19 LEU N N 19 125.265 125.265 119.186 6.079 17890 8048 1 11 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.978 0.315 17890 8049 1 11 . 1 1 19 19 LEU C C 19 175.689 175.689 175.631 0.058 17890 8050 1 11 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.734 -0.307 17890 8051 1 11 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.310 1.968 17890 8052 1 11 . 1 1 19 19 LEU H H 19 8.091 8.091 8.295 -0.204 17890 8053 1 11 . 1 1 20 20 SER N N 20 114.622 114.622 115.109 -0.487 17890 8054 1 11 . 1 1 20 20 SER HA H 20 4.947 4.947 4.905 0.042 17890 8055 1 11 . 1 1 20 20 SER C C 20 174.220 174.220 173.354 0.866 17890 8056 1 11 . 1 1 20 20 SER CA C 20 56.583 56.583 57.381 -0.798 17890 8057 1 11 . 1 1 20 20 SER CB C 20 65.653 65.653 66.096 -0.443 17890 8058 1 11 . 1 1 20 20 SER H H 20 7.316 7.316 8.191 -0.875 17890 8059 1 11 . 1 1 21 21 ALA N N 21 125.517 125.517 124.309 1.208 17890 8060 1 11 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.982 -0.314 17890 8061 1 11 . 1 1 21 21 ALA C C 21 177.960 177.960 177.701 0.259 17890 8062 1 11 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.495 1.515 17890 8063 1 11 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.287 -0.062 17890 8064 1 11 . 1 1 21 21 ALA H H 21 8.993 8.993 8.576 0.417 17890 8065 1 11 . 1 1 22 22 GLY N N 22 109.543 109.543 110.675 -1.132 17890 8066 1 11 . 1 1 22 22 GLY C C 22 170.422 170.422 171.761 -1.339 17890 8067 1 11 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.125 0.256 17890 8068 1 11 . 1 1 22 22 GLY H H 22 8.411 8.411 8.883 -0.472 17890 8069 1 11 . 1 1 23 23 ASN N N 23 119.649 119.649 118.991 0.658 17890 8070 1 11 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.596 0.291 17890 8071 1 11 . 1 1 23 23 ASN C C 23 175.207 175.207 174.587 0.620 17890 8072 1 11 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.769 -0.948 17890 8073 1 11 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.337 -0.582 17890 8074 1 11 . 1 1 23 23 ASN H H 23 8.092 8.092 8.431 -0.339 17890 8075 1 11 . 1 1 24 24 TYR N N 24 120.889 120.889 121.684 -0.795 17890 8076 1 11 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.164 0.091 17890 8077 1 11 . 1 1 24 24 TYR C C 24 175.667 175.667 174.456 1.211 17890 8078 1 11 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.247 0.866 17890 8079 1 11 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.658 0.168 17890 8080 1 11 . 1 1 24 24 TYR H H 24 9.914 9.914 8.962 0.952 17890 8081 1 11 . 1 1 25 25 ILE N N 25 115.978 115.978 113.672 2.306 17890 8082 1 11 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.021 0.065 17890 8083 1 11 . 1 1 25 25 ILE C C 25 175.200 175.200 174.057 1.143 17890 8084 1 11 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.702 0.843 17890 8085 1 11 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.566 -0.444 17890 8086 1 11 . 1 1 25 25 ILE H H 25 9.216 9.216 9.246 -0.030 17890 8087 1 11 . 1 1 26 26 ILE N N 26 123.957 123.957 122.484 1.473 17890 8088 1 11 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.223 -0.247 17890 8089 1 11 . 1 1 26 26 ILE C C 26 174.810 174.810 174.921 -0.111 17890 8090 1 11 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.342 0.267 17890 8091 1 11 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.077 1.045 17890 8092 1 11 . 1 1 26 26 ILE H H 26 9.559 9.559 8.895 0.664 17890 8093 1 11 . 1 1 27 27 TYR N N 27 121.371 121.371 124.099 -2.728 17890 8094 1 11 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.587 0.603 17890 8095 1 11 . 1 1 27 27 TYR C C 27 173.963 173.963 173.311 0.652 17890 8096 1 11 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.910 -0.241 17890 8097 1 11 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.093 0.605 17890 8098 1 11 . 1 1 27 27 TYR H H 27 9.378 9.378 9.092 0.286 17890 8099 1 11 . 1 1 28 28 ASN N N 28 121.991 121.991 119.585 2.406 17890 8100 1 11 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.413 -0.645 17890 8101 1 11 . 1 1 28 28 ASN C C 28 174.352 174.352 176.139 -1.787 17890 8102 1 11 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.192 2.928 17890 8103 1 11 . 1 1 28 28 ASN CB C 28 41.446 41.446 40.151 1.295 17890 8104 1 11 . 1 1 28 28 ASN H H 28 8.466 8.466 8.462 0.004 17890 8105 1 11 . 1 1 29 29 ARG N N 29 121.103 121.103 127.235 -6.132 17890 8106 1 11 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.100 -0.239 17890 8107 1 11 . 1 1 29 29 ARG C C 29 173.635 173.635 177.532 -3.897 17890 8108 1 11 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.150 1.143 17890 8109 1 11 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.166 0.233 17890 8110 1 11 . 1 1 29 29 ARG H H 29 7.756 7.756 8.218 -0.462 17890 8111 1 11 . 1 1 30 30 VAL N N 30 118.412 118.412 117.612 0.800 17890 8112 1 11 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.751 0.193 17890 8113 1 11 . 1 1 30 30 VAL C C 30 176.199 176.199 175.910 0.289 17890 8114 1 11 . 1 1 30 30 VAL CA C 30 62.577 62.577 64.021 -1.444 17890 8115 1 11 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.389 -2.167 17890 8116 1 11 . 1 1 30 30 VAL H H 30 8.976 8.976 7.578 1.398 17890 8117 1 11 . 1 1 31 31 LEU N N 31 125.418 125.418 114.392 11.026 17890 8118 1 11 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.025 0.460 17890 8119 1 11 . 1 1 31 31 LEU C C 31 179.123 179.123 176.141 2.982 17890 8120 1 11 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.410 -1.385 17890 8121 1 11 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.436 4.145 17890 8122 1 11 . 1 1 31 31 LEU H H 31 8.856 8.856 7.630 1.226 17890 8123 1 11 . 1 1 32 32 SER N N 32 116.890 116.890 115.432 1.458 17890 8124 1 11 . 1 1 32 32 SER HA H 32 5.365 5.365 4.995 0.370 17890 8125 1 11 . 1 1 32 32 SER CA C 32 57.269 57.269 57.004 0.265 17890 8126 1 11 . 1 1 32 32 SER CB C 32 62.213 62.213 64.373 -2.160 17890 8127 1 11 . 1 1 32 32 SER H H 32 9.307 9.307 8.541 0.766 17890 8128 1 11 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.453 -0.573 17890 8129 1 11 . 1 1 33 33 PRO C C 33 175.137 175.137 177.566 -2.429 17890 8130 1 11 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.652 0.633 17890 8131 1 11 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.599 0.432 17890 8132 1 11 . 1 1 34 34 ARG N N 34 110.279 110.279 118.604 -8.325 17890 8133 1 11 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.272 0.220 17890 8134 1 11 . 1 1 34 34 ARG C C 34 176.844 176.844 176.785 0.059 17890 8135 1 11 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.754 -1.318 17890 8136 1 11 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.108 0.476 17890 8137 1 11 . 1 1 34 34 ARG H H 34 7.257 7.257 7.889 -0.632 17890 8138 1 11 . 1 1 35 35 GLY N N 35 110.288 110.288 106.483 3.805 17890 8139 1 11 . 1 1 35 35 GLY C C 35 173.336 173.336 174.102 -0.766 17890 8140 1 11 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.790 2.240 17890 8141 1 11 . 1 1 35 35 GLY H H 35 8.589 8.589 7.639 0.950 17890 8142 1 11 . 1 1 36 36 GLU N N 36 116.838 116.838 118.990 -2.152 17890 8143 1 11 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.672 -0.324 17890 8144 1 11 . 1 1 36 36 GLU C C 36 176.915 176.915 175.695 1.220 17890 8145 1 11 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.974 0.933 17890 8146 1 11 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.364 -2.949 17890 8147 1 11 . 1 1 36 36 GLU H H 36 7.769 7.769 8.211 -0.442 17890 8148 1 11 . 1 1 37 37 LYS N N 37 123.775 123.775 120.171 3.604 17890 8149 1 11 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.167 0.256 17890 8150 1 11 . 1 1 37 37 LYS C C 37 176.067 176.067 175.360 0.707 17890 8151 1 11 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.647 -0.746 17890 8152 1 11 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.889 0.785 17890 8153 1 11 . 1 1 37 37 LYS H H 37 8.667 8.667 8.696 -0.029 17890 8154 1 11 . 1 1 38 38 LEU N N 38 126.658 126.658 124.968 1.690 17890 8155 1 11 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.972 -0.745 17890 8156 1 11 . 1 1 38 38 LEU C C 38 174.332 174.332 175.151 -0.819 17890 8157 1 11 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.702 -0.359 17890 8158 1 11 . 1 1 38 38 LEU CB C 38 41.651 41.651 43.211 -1.560 17890 8159 1 11 . 1 1 38 38 LEU H H 38 10.455 10.455 8.810 1.645 17890 8160 1 11 . 1 1 39 39 ALA N N 39 127.018 127.018 125.926 1.092 17890 8161 1 11 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.275 -0.046 17890 8162 1 11 . 1 1 39 39 ALA C C 39 178.694 178.694 176.115 2.579 17890 8163 1 11 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.397 -0.172 17890 8164 1 11 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.698 0.651 17890 8165 1 11 . 1 1 39 39 ALA H H 39 8.773 8.773 8.556 0.217 17890 8166 1 11 . 1 1 40 40 LEU N N 40 126.771 126.771 122.823 3.948 17890 8167 1 11 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.625 -0.271 17890 8168 1 11 . 1 1 40 40 LEU C C 40 178.309 178.309 176.619 1.690 17890 8169 1 11 . 1 1 40 40 LEU CA C 40 56.845 56.845 55.959 0.886 17890 8170 1 11 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.948 0.375 17890 8171 1 11 . 1 1 40 40 LEU H H 40 9.665 9.665 8.642 1.023 17890 8172 1 11 . 1 1 41 41 THR N N 41 126.578 126.578 124.321 2.257 17890 8173 1 11 . 1 1 41 41 THR HA H 41 4.916 4.916 5.223 -0.307 17890 8174 1 11 . 1 1 41 41 THR C C 41 172.547 172.547 173.533 -0.986 17890 8175 1 11 . 1 1 41 41 THR CA C 41 63.253 63.253 61.647 1.607 17890 8176 1 11 . 1 1 41 41 THR CB C 41 71.832 71.832 70.596 1.236 17890 8177 1 11 . 1 1 41 41 THR H H 41 9.802 9.802 9.093 0.709 17890 8178 1 11 . 1 1 42 42 TYR N N 42 130.506 130.506 129.031 1.475 17890 8179 1 11 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.648 0.454 17890 8180 1 11 . 1 1 42 42 TYR CA C 42 53.986 53.986 58.168 -4.182 17890 8181 1 11 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.784 0.371 17890 8182 1 11 . 1 1 42 42 TYR H H 42 9.428 9.428 9.164 0.264 17890 8183 1 11 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.428 0.062 17890 8184 1 11 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.129 0.444 17890 8185 1 11 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.699 -0.055 17890 8186 1 11 . 1 1 44 44 GLY N N 44 113.736 113.736 106.461 7.275 17890 8187 1 11 . 1 1 44 44 GLY C C 44 171.790 171.790 173.491 -1.701 17890 8188 1 11 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.002 0.714 17890 8189 1 11 . 1 1 44 44 GLY H H 44 8.337 8.337 7.320 1.017 17890 8190 1 11 . 1 1 45 45 ARG N N 45 113.899 113.899 118.776 -4.877 17890 8191 1 11 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.537 0.039 17890 8192 1 11 . 1 1 45 45 ARG C C 45 175.151 175.151 174.454 0.697 17890 8193 1 11 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.665 -0.500 17890 8194 1 11 . 1 1 45 45 ARG CB C 45 33.219 33.219 33.446 -0.227 17890 8195 1 11 . 1 1 45 45 ARG H H 45 6.463 6.463 7.470 -1.007 17890 8196 1 11 . 1 1 46 46 GLN N N 46 119.000 119.000 118.951 0.049 17890 8197 1 11 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.560 -0.111 17890 8198 1 11 . 1 1 46 46 GLN C C 46 177.282 177.282 176.465 0.817 17890 8199 1 11 . 1 1 46 46 GLN CA C 46 56.613 56.613 54.971 1.642 17890 8200 1 11 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.830 0.666 17890 8201 1 11 . 1 1 46 46 GLN H H 46 8.683 8.683 8.550 0.133 17890 8202 1 11 . 1 1 47 47 ARG N N 47 113.526 113.526 117.599 -4.073 17890 8203 1 11 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.076 -0.546 17890 8204 1 11 . 1 1 47 47 ARG C C 47 174.130 174.130 175.265 -1.135 17890 8205 1 11 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.186 1.630 17890 8206 1 11 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.209 1.861 17890 8207 1 11 . 1 1 47 47 ARG H H 47 9.677 9.677 8.796 0.881 17890 8208 1 11 . 1 1 48 48 THR N N 48 114.672 114.672 115.465 -0.793 17890 8209 1 11 . 1 1 48 48 THR HA H 48 4.938 4.938 4.762 0.176 17890 8210 1 11 . 1 1 48 48 THR CA C 48 59.987 59.987 59.622 0.365 17890 8211 1 11 . 1 1 48 48 THR CB C 48 71.947 71.947 70.650 1.297 17890 8212 1 11 . 1 1 48 48 THR H H 48 8.104 8.104 7.613 0.491 17890 8213 1 11 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.633 -0.265 17890 8214 1 11 . 1 1 49 49 PRO C C 49 175.651 175.651 176.445 -0.794 17890 8215 1 11 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.009 1.172 17890 8216 1 11 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.127 0.570 17890 8217 1 11 . 1 1 50 50 VAL N N 50 122.562 122.562 121.740 0.822 17890 8218 1 11 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.223 -0.276 17890 8219 1 11 . 1 1 50 50 VAL C C 50 174.493 174.493 175.969 -1.476 17890 8220 1 11 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.761 2.050 17890 8221 1 11 . 1 1 50 50 VAL CB C 50 32.168 32.168 33.452 -1.284 17890 8222 1 11 . 1 1 50 50 VAL H H 50 8.123 8.123 8.647 -0.524 17890 8223 1 11 . 1 1 51 51 THR N N 51 113.549 113.549 118.409 -4.860 17890 8224 1 11 . 1 1 51 51 THR HA H 51 5.372 5.372 4.983 0.389 17890 8225 1 11 . 1 1 51 51 THR C C 51 174.841 174.841 172.829 2.012 17890 8226 1 11 . 1 1 51 51 THR CA C 51 59.196 59.196 60.601 -1.405 17890 8227 1 11 . 1 1 51 51 THR CB C 51 72.703 72.703 71.798 0.905 17890 8228 1 11 . 1 1 51 51 THR H H 51 7.057 7.057 8.305 -1.248 17890 8229 1 11 . 1 1 52 52 VAL N N 52 107.374 107.374 120.477 -13.103 17890 8230 1 11 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.002 0.512 17890 8231 1 11 . 1 1 52 52 VAL C C 52 175.697 175.697 173.606 2.091 17890 8232 1 11 . 1 1 52 52 VAL CA C 52 58.472 58.472 60.130 -1.658 17890 8233 1 11 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.575 0.199 17890 8234 1 11 . 1 1 52 52 VAL H H 52 8.062 8.062 8.534 -0.472 17890 8235 1 11 . 1 1 53 53 SER N N 53 114.662 114.662 122.291 -7.629 17890 8236 1 11 . 1 1 53 53 SER HA H 53 4.690 4.690 4.990 -0.300 17890 8237 1 11 . 1 1 53 53 SER CA C 53 56.828 56.828 56.000 0.828 17890 8238 1 11 . 1 1 53 53 SER CB C 53 64.789 64.789 65.360 -0.571 17890 8239 1 11 . 1 1 53 53 SER H H 53 8.681 8.681 9.221 -0.540 17890 8240 1 11 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.891 -0.115 17890 8241 1 11 . 1 1 54 54 PRO C C 54 177.724 177.724 176.179 1.545 17890 8242 1 11 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.146 0.279 17890 8243 1 11 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.356 -0.259 17890 8244 1 11 . 1 1 55 55 LEU N N 55 128.655 128.655 121.114 7.541 17890 8245 1 11 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.624 -0.097 17890 8246 1 11 . 1 1 55 55 LEU C C 55 178.696 178.696 175.610 3.086 17890 8247 1 11 . 1 1 55 55 LEU CA C 55 56.246 56.246 54.200 2.046 17890 8248 1 11 . 1 1 55 55 LEU CB C 55 43.606 43.606 44.752 -1.145 17890 8249 1 11 . 1 1 55 55 LEU H H 55 8.675 8.675 8.071 0.604 17890 8250 1 11 . 1 1 56 56 ASP N N 56 126.651 126.651 124.320 2.331 17890 8251 1 11 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.771 -0.062 17890 8252 1 11 . 1 1 56 56 ASP C C 56 177.729 177.729 176.837 0.892 17890 8253 1 11 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.346 -0.723 17890 8254 1 11 . 1 1 56 56 ASP CB C 56 41.632 41.632 44.387 -2.755 17890 8255 1 11 . 1 1 56 56 ASP H H 56 9.683 9.683 9.593 0.090 17890 8256 1 11 . 1 1 57 57 GLY N N 57 109.299 109.299 108.528 0.771 17890 8257 1 11 . 1 1 57 57 GLY C C 57 174.558 174.558 174.120 0.438 17890 8258 1 11 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.939 1.016 17890 8259 1 11 . 1 1 57 57 GLY H H 57 8.157 8.157 8.552 -0.395 17890 8260 1 11 . 1 1 58 58 SER N N 58 116.740 116.740 115.814 0.926 17890 8261 1 11 . 1 1 58 58 SER HA H 58 4.288 4.288 4.478 -0.190 17890 8262 1 11 . 1 1 58 58 SER C C 58 177.252 177.252 176.207 1.045 17890 8263 1 11 . 1 1 58 58 SER CA C 58 58.737 58.737 57.281 1.456 17890 8264 1 11 . 1 1 58 58 SER CB C 58 64.576 64.576 64.239 0.337 17890 8265 1 11 . 1 1 58 58 SER H H 58 8.328 8.328 7.979 0.349 17890 8266 1 11 . 1 1 59 59 SER N N 59 119.768 119.768 120.361 -0.593 17890 8267 1 11 . 1 1 59 59 SER HA H 59 4.046 4.046 4.215 -0.170 17890 8268 1 11 . 1 1 59 59 SER C C 59 176.671 176.671 175.640 1.031 17890 8269 1 11 . 1 1 59 59 SER CA C 59 61.691 61.691 59.932 1.759 17890 8270 1 11 . 1 1 59 59 SER CB C 59 63.154 63.154 62.951 0.203 17890 8271 1 11 . 1 1 59 59 SER H H 59 9.020 9.020 8.849 0.171 17890 8272 1 11 . 1 1 60 60 GLU N N 60 119.133 119.133 120.650 -1.517 17890 8273 1 11 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.039 0.147 17890 8274 1 11 . 1 1 60 60 GLU C C 60 177.435 177.435 177.134 0.301 17890 8275 1 11 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.425 1.608 17890 8276 1 11 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.939 -1.713 17890 8277 1 11 . 1 1 60 60 GLU H H 60 8.832 8.832 7.646 1.186 17890 8278 1 11 . 1 1 61 61 GLN N N 61 118.818 118.818 115.341 3.477 17890 8279 1 11 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.050 0.127 17890 8280 1 11 . 1 1 61 61 GLN C C 61 173.254 173.254 175.188 -1.934 17890 8281 1 11 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.958 -0.585 17890 8282 1 11 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.207 -2.285 17890 8283 1 11 . 1 1 61 61 GLN H H 61 7.648 7.648 7.500 0.148 17890 8284 1 11 . 1 1 62 62 ALA N N 62 122.562 122.562 122.455 0.107 17890 8285 1 11 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.606 0.458 17890 8286 1 11 . 1 1 62 62 ALA C C 62 176.637 176.637 174.983 1.654 17890 8287 1 11 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.060 0.119 17890 8288 1 11 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.468 -0.873 17890 8289 1 11 . 1 1 62 62 ALA H H 62 7.315 7.315 7.085 0.230 17890 8290 1 11 . 1 1 63 63 TRP N N 63 124.787 124.787 119.240 5.547 17890 8291 1 11 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.413 -0.449 17890 8292 1 11 . 1 1 63 63 TRP C C 63 174.351 174.351 175.433 -1.082 17890 8293 1 11 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.091 -0.189 17890 8294 1 11 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.911 -1.794 17890 8295 1 11 . 1 1 63 63 TRP H H 63 9.544 9.544 9.037 0.507 17890 8296 1 11 . 1 1 64 64 ILE N N 64 122.482 122.482 119.007 3.475 17890 8297 1 11 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.991 -0.297 17890 8298 1 11 . 1 1 64 64 ILE C C 64 177.078 177.078 174.118 2.960 17890 8299 1 11 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.625 0.406 17890 8300 1 11 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.639 -1.270 17890 8301 1 11 . 1 1 64 64 ILE H H 64 10.235 10.235 9.349 0.886 17890 8302 1 11 . 1 1 65 65 LEU N N 65 132.183 132.183 128.557 3.626 17890 8303 1 11 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.570 -0.105 17890 8304 1 11 . 1 1 65 65 LEU C C 65 177.048 177.048 174.482 2.566 17890 8305 1 11 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.626 0.723 17890 8306 1 11 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.315 -3.971 17890 8307 1 11 . 1 1 65 65 LEU H H 65 9.432 9.432 9.387 0.045 17890 8308 1 11 . 1 1 66 66 ARG N N 66 120.807 120.807 125.173 -4.366 17890 8309 1 11 . 1 1 66 66 ARG HA H 66 4.888 4.888 5.000 -0.112 17890 8310 1 11 . 1 1 66 66 ARG C C 66 175.275 175.275 174.790 0.485 17890 8311 1 11 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.551 0.504 17890 8312 1 11 . 1 1 66 66 ARG CB C 66 32.991 32.991 33.795 -0.805 17890 8313 1 11 . 1 1 66 66 ARG H H 66 8.491 8.491 8.442 0.049 17890 8314 1 11 . 1 1 67 67 SER N N 67 119.709 119.709 118.706 1.003 17890 8315 1 11 . 1 1 67 67 SER HA H 67 3.186 3.186 3.324 -0.138 17890 8316 1 11 . 1 1 67 67 SER C C 67 174.508 174.508 173.543 0.965 17890 8317 1 11 . 1 1 67 67 SER CA C 67 58.521 58.521 58.900 -0.379 17890 8318 1 11 . 1 1 67 67 SER CB C 67 62.590 62.590 63.224 -0.634 17890 8319 1 11 . 1 1 67 67 SER H H 67 8.557 8.557 8.744 -0.187 17890 8320 1 11 . 1 1 68 68 TYR N N 68 131.011 131.011 127.698 3.313 17890 8321 1 11 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.648 -0.200 17890 8322 1 11 . 1 1 68 68 TYR C C 68 174.687 174.687 174.757 -0.070 17890 8323 1 11 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.742 1.023 17890 8324 1 11 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.013 -2.025 17890 8325 1 11 . 1 1 68 68 TYR H H 68 8.531 8.531 8.624 -0.093 17890 8326 1 11 . 1 1 69 69 ASP N N 69 117.066 117.066 119.956 -2.890 17890 8327 1 11 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.814 -0.189 17890 8328 1 11 . 1 1 69 69 ASP C C 69 176.455 176.455 176.555 -0.100 17890 8329 1 11 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.858 -0.767 17890 8330 1 11 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.874 -0.727 17890 8331 1 11 . 1 1 69 69 ASP H H 69 7.122 7.122 7.650 -0.528 17890 8332 1 11 . 1 1 70 70 SER N N 70 122.869 122.869 119.708 3.161 17890 8333 1 11 . 1 1 70 70 SER HA H 70 4.270 4.270 4.130 0.140 17890 8334 1 11 . 1 1 70 70 SER C C 70 177.010 177.010 176.271 0.739 17890 8335 1 11 . 1 1 70 70 SER CA C 70 60.837 60.837 61.913 -1.075 17890 8336 1 11 . 1 1 70 70 SER CB C 70 62.722 62.722 63.122 -0.400 17890 8337 1 11 . 1 1 70 70 SER H H 70 8.757 8.757 8.829 -0.072 17890 8338 1 11 . 1 1 71 71 ASN N N 71 119.873 119.873 119.497 0.376 17890 8339 1 11 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.603 -0.032 17890 8340 1 11 . 1 1 71 71 ASN C C 71 176.226 176.226 176.130 0.096 17890 8341 1 11 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.334 0.381 17890 8342 1 11 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.332 0.309 17890 8343 1 11 . 1 1 71 71 ASN H H 71 8.342 8.342 8.485 -0.143 17890 8344 1 11 . 1 1 72 72 SER N N 72 112.202 112.202 112.672 -0.470 17890 8345 1 11 . 1 1 72 72 SER HA H 72 4.567 4.567 4.699 -0.132 17890 8346 1 11 . 1 1 72 72 SER C C 72 173.789 173.789 173.578 0.211 17890 8347 1 11 . 1 1 72 72 SER CA C 72 57.816 57.816 57.293 0.523 17890 8348 1 11 . 1 1 72 72 SER CB C 72 63.935 63.935 63.755 0.180 17890 8349 1 11 . 1 1 72 72 SER H H 72 7.560 7.560 7.750 -0.190 17890 8350 1 11 . 1 1 73 73 ASN N N 73 117.437 117.437 119.906 -2.469 17890 8351 1 11 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.456 0.078 17890 8352 1 11 . 1 1 73 73 ASN C C 73 173.647 173.647 174.151 -0.504 17890 8353 1 11 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.607 -0.084 17890 8354 1 11 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.035 0.178 17890 8355 1 11 . 1 1 73 73 ASN H H 73 7.940 7.940 7.894 0.046 17890 8356 1 11 . 1 1 74 74 THR N N 74 104.227 104.227 109.271 -5.044 17890 8357 1 11 . 1 1 74 74 THR HA H 74 5.477 5.477 5.159 0.318 17890 8358 1 11 . 1 1 74 74 THR C C 74 176.824 176.824 173.888 2.936 17890 8359 1 11 . 1 1 74 74 THR CA C 74 59.768 59.768 61.560 -1.792 17890 8360 1 11 . 1 1 74 74 THR CB C 74 71.985 71.985 69.857 2.128 17890 8361 1 11 . 1 1 74 74 THR H H 74 7.737 7.737 7.837 -0.100 17890 8362 1 11 . 1 1 75 75 TRP N N 75 124.636 124.636 123.435 1.201 17890 8363 1 11 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.368 -0.161 17890 8364 1 11 . 1 1 75 75 TRP C C 75 175.876 175.876 176.261 -0.385 17890 8365 1 11 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.166 1.440 17890 8366 1 11 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.456 0.060 17890 8367 1 11 . 1 1 75 75 TRP H H 75 9.442 9.442 9.402 0.040 17890 8368 1 11 . 1 1 76 76 THR N N 76 110.544 110.544 114.860 -4.316 17890 8369 1 11 . 1 1 76 76 THR HA H 76 5.129 5.129 5.073 0.056 17890 8370 1 11 . 1 1 76 76 THR C C 76 174.506 174.506 174.251 0.255 17890 8371 1 11 . 1 1 76 76 THR CA C 76 60.561 60.561 61.612 -1.052 17890 8372 1 11 . 1 1 76 76 THR CB C 76 71.688 71.688 70.335 1.353 17890 8373 1 11 . 1 1 76 76 THR H H 76 9.415 9.415 9.385 0.030 17890 8374 1 11 . 1 1 77 77 ILE N N 77 121.567 121.567 123.870 -2.303 17890 8375 1 11 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.176 -0.037 17890 8376 1 11 . 1 1 77 77 ILE C C 77 176.148 176.148 175.148 1.000 17890 8377 1 11 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.583 2.125 17890 8378 1 11 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.776 1.210 17890 8379 1 11 . 1 1 77 77 ILE H H 77 9.255 9.255 8.415 0.840 17890 8380 1 11 . 1 1 78 78 SER N N 78 122.269 122.269 121.707 0.562 17890 8381 1 11 . 1 1 78 78 SER HA H 78 5.601 5.601 5.409 0.193 17890 8382 1 11 . 1 1 78 78 SER CA C 78 55.835 55.835 55.939 -0.104 17890 8383 1 11 . 1 1 78 78 SER CB C 78 65.858 65.858 66.474 -0.616 17890 8384 1 11 . 1 1 78 78 SER H H 78 9.226 9.226 8.803 0.423 17890 8385 1 11 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.089 -0.225 17890 8386 1 11 . 1 1 79 79 PRO C C 79 178.175 178.175 176.630 1.545 17890 8387 1 11 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.259 0.625 17890 8388 1 11 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.117 -1.845 17890 8389 1 11 . 1 1 80 80 VAL N N 80 121.906 121.906 120.859 1.047 17890 8390 1 11 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.704 -0.123 17890 8391 1 11 . 1 1 80 80 VAL C C 80 177.751 177.751 177.378 0.373 17890 8392 1 11 . 1 1 80 80 VAL CA C 80 66.067 66.067 65.019 1.048 17890 8393 1 11 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.434 0.051 17890 8394 1 11 . 1 1 80 80 VAL H H 80 7.328 7.328 8.062 -0.734 17890 8395 1 11 . 1 1 81 81 GLY N N 81 104.643 104.643 106.120 -1.477 17890 8396 1 11 . 1 1 81 81 GLY C C 81 174.979 174.979 174.523 0.456 17890 8397 1 11 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.641 -0.553 17890 8398 1 11 . 1 1 81 81 GLY H H 81 8.949 8.949 7.475 1.474 17890 8399 1 11 . 1 1 82 82 SER N N 82 111.865 111.865 115.922 -4.057 17890 8400 1 11 . 1 1 82 82 SER HA H 82 4.646 4.646 4.828 -0.182 17890 8401 1 11 . 1 1 82 82 SER CA C 82 55.441 55.441 55.571 -0.130 17890 8402 1 11 . 1 1 82 82 SER CB C 82 62.277 62.277 63.761 -1.484 17890 8403 1 11 . 1 1 82 82 SER H H 82 6.968 6.968 6.976 -0.008 17890 8404 1 11 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.565 -0.218 17890 8405 1 11 . 1 1 83 83 PRO C C 83 176.660 176.660 176.572 0.088 17890 8406 1 11 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.392 0.811 17890 8407 1 11 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.830 0.989 17890 8408 1 11 . 1 1 84 84 ASN N N 84 116.542 116.542 115.259 1.283 17890 8409 1 11 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.634 0.367 17890 8410 1 11 . 1 1 84 84 ASN C C 84 175.825 175.825 175.014 0.811 17890 8411 1 11 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.827 -0.936 17890 8412 1 11 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.321 0.423 17890 8413 1 11 . 1 1 84 84 ASN H H 84 8.502 8.502 8.434 0.068 17890 8414 1 11 . 1 1 85 85 SER N N 85 114.633 114.633 112.692 1.941 17890 8415 1 11 . 1 1 85 85 SER HA H 85 4.624 4.624 4.900 -0.276 17890 8416 1 11 . 1 1 85 85 SER C C 85 172.963 172.963 172.483 0.480 17890 8417 1 11 . 1 1 85 85 SER CA C 85 59.210 59.210 57.342 1.868 17890 8418 1 11 . 1 1 85 85 SER CB C 85 64.697 64.697 66.248 -1.551 17890 8419 1 11 . 1 1 85 85 SER H H 85 7.980 7.980 7.720 0.260 17890 8420 1 11 . 1 1 86 86 GLN N N 86 119.016 119.016 117.130 1.886 17890 8421 1 11 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.594 -0.148 17890 8422 1 11 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.641 -0.189 17890 8423 1 11 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.454 -0.056 17890 8424 1 11 . 1 1 86 86 GLN H H 86 9.399 9.399 8.891 0.508 17890 8425 1 11 . 1 1 87 87 ILE N N 87 119.691 119.691 119.362 0.329 17890 8426 1 11 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.222 -0.647 17890 8427 1 11 . 1 1 87 87 ILE C C 87 176.505 176.505 176.188 0.317 17890 8428 1 11 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.940 4.554 17890 8429 1 11 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.047 -0.850 17890 8430 1 11 . 1 1 87 87 ILE H H 87 8.970 8.970 8.310 0.660 17890 8431 1 11 . 1 1 88 88 GLY N N 88 118.378 118.378 114.636 3.742 17890 8432 1 11 . 1 1 88 88 GLY C C 88 171.397 171.397 171.711 -0.314 17890 8433 1 11 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.982 -1.378 17890 8434 1 11 . 1 1 88 88 GLY H H 88 9.752 9.752 9.193 0.559 17890 8435 1 11 . 1 1 89 89 TRP N N 89 122.749 122.749 122.098 0.651 17890 8436 1 11 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.457 -0.859 17890 8437 1 11 . 1 1 89 89 TRP C C 89 175.924 175.924 174.795 1.129 17890 8438 1 11 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.908 0.374 17890 8439 1 11 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.364 -2.278 17890 8440 1 11 . 1 1 89 89 TRP H H 89 8.215 8.215 8.199 0.016 17890 8441 1 11 . 1 1 90 90 GLY N N 90 116.305 116.305 111.099 5.206 17890 8442 1 11 . 1 1 90 90 GLY C C 90 173.725 173.725 172.460 1.265 17890 8443 1 11 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.448 0.607 17890 8444 1 11 . 1 1 90 90 GLY H H 90 8.922 8.922 8.236 0.686 17890 8445 1 11 . 1 1 91 91 ALA N N 91 123.795 123.795 122.003 1.792 17890 8446 1 11 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.155 0.088 17890 8447 1 11 . 1 1 91 91 ALA C C 91 178.510 178.510 178.946 -0.436 17890 8448 1 11 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.446 0.044 17890 8449 1 11 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.801 -0.392 17890 8450 1 11 . 1 1 91 91 ALA H H 91 8.367 8.367 8.164 0.203 17890 8451 1 11 . 1 1 92 92 GLY N N 92 108.871 108.871 112.745 -3.874 17890 8452 1 11 . 1 1 92 92 GLY C C 92 174.528 174.528 174.820 -0.292 17890 8453 1 11 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.717 0.541 17890 8454 1 11 . 1 1 92 92 GLY H H 92 8.776 8.776 8.614 0.162 17890 8455 1 11 . 1 1 93 93 ASN N N 93 114.921 114.921 117.939 -3.018 17890 8456 1 11 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.813 -0.364 17890 8457 1 11 . 1 1 93 93 ASN C C 93 172.774 172.774 174.025 -1.251 17890 8458 1 11 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.435 0.538 17890 8459 1 11 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.002 -0.673 17890 8460 1 11 . 1 1 93 93 ASN H H 93 8.647 8.647 8.247 0.400 17890 8461 1 11 . 1 1 94 94 VAL N N 94 112.437 112.437 112.858 -0.421 17890 8462 1 11 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.688 0.377 17890 8463 1 11 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.398 -1.483 17890 8464 1 11 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.142 0.013 17890 8465 1 11 . 1 1 94 94 VAL H H 94 6.989 6.989 7.482 -0.493 17890 8466 1 11 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.995 -0.067 17890 8467 1 11 . 1 1 95 95 PRO C C 95 176.041 176.041 176.078 -0.037 17890 8468 1 11 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.418 -1.217 17890 8469 1 11 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.669 -0.944 17890 8470 1 11 . 1 1 96 96 VAL N N 96 113.564 113.564 116.802 -3.238 17890 8471 1 11 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.878 -0.143 17890 8472 1 11 . 1 1 96 96 VAL C C 96 173.656 173.656 174.915 -1.259 17890 8473 1 11 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.138 -0.285 17890 8474 1 11 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.451 1.702 17890 8475 1 11 . 1 1 96 96 VAL H H 96 8.199 8.199 8.927 -0.728 17890 8476 1 11 . 1 1 97 97 VAL N N 97 122.328 122.328 123.646 -1.318 17890 8477 1 11 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.621 0.010 17890 8478 1 11 . 1 1 97 97 VAL C C 97 174.776 174.776 175.676 -0.900 17890 8479 1 11 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.579 0.078 17890 8480 1 11 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.919 -0.791 17890 8481 1 11 . 1 1 97 97 VAL H H 97 8.957 8.957 8.212 0.745 17890 8482 1 11 . 1 1 98 98 LEU N N 98 130.258 130.258 126.301 3.957 17890 8483 1 11 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.957 0.093 17890 8484 1 11 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.590 1.233 17890 8485 1 11 . 1 1 98 98 LEU CB C 98 46.118 46.118 44.595 1.523 17890 8486 1 11 . 1 1 98 98 LEU H H 98 9.245 9.245 9.110 0.135 17890 8487 1 11 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.685 0.094 17890 8488 1 11 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.722 -0.233 17890 8489 1 11 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.103 -0.649 17890 8490 1 11 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.484 -0.499 17890 8491 1 11 . 1 1 100 100 PRO C C 100 177.309 177.309 175.530 1.779 17890 8492 1 11 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.339 0.485 17890 8493 1 11 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.131 -0.026 17890 8494 1 11 . 1 1 101 101 ASN N N 101 119.284 119.284 125.775 -6.491 17890 8495 1 11 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.620 -0.078 17890 8496 1 11 . 1 1 101 101 ASN C C 101 171.920 171.920 173.774 -1.854 17890 8497 1 11 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.684 -0.484 17890 8498 1 11 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.354 -1.729 17890 8499 1 11 . 1 1 101 101 ASN H H 101 7.273 7.273 9.257 -1.984 17890 8500 1 11 . 1 1 102 102 ASN N N 102 115.674 115.674 116.391 -0.717 17890 8501 1 11 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.741 -0.823 17890 8502 1 11 . 1 1 102 102 ASN C C 102 173.264 173.264 174.300 -1.036 17890 8503 1 11 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.771 1.268 17890 8504 1 11 . 1 1 102 102 ASN CB C 102 36.982 36.982 37.983 -1.000 17890 8505 1 11 . 1 1 102 102 ASN H H 102 8.197 8.197 7.727 0.470 17890 8506 1 11 . 1 1 103 103 TYR N N 103 118.775 118.775 121.458 -2.683 17890 8507 1 11 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.285 0.200 17890 8508 1 11 . 1 1 103 103 TYR C C 103 175.248 175.248 174.890 0.358 17890 8509 1 11 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.311 -1.821 17890 8510 1 11 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.697 -1.165 17890 8511 1 11 . 1 1 103 103 TYR H H 103 7.745 7.745 7.684 0.061 17890 8512 1 11 . 1 1 104 104 VAL N N 104 116.205 116.205 115.711 0.494 17890 8513 1 11 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.887 0.090 17890 8514 1 11 . 1 1 104 104 VAL C C 104 174.361 174.361 173.613 0.748 17890 8515 1 11 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.942 -1.691 17890 8516 1 11 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.288 0.255 17890 8517 1 11 . 1 1 104 104 VAL H H 104 7.498 7.498 8.073 -0.575 17890 8518 1 11 . 1 1 105 105 TRP N N 105 119.557 119.557 119.540 0.017 17890 8519 1 11 . 1 1 105 105 TRP HA H 105 4.875 4.875 4.993 -0.118 17890 8520 1 11 . 1 1 105 105 TRP C C 105 175.526 175.526 176.102 -0.576 17890 8521 1 11 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.312 -0.428 17890 8522 1 11 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.703 -0.163 17890 8523 1 11 . 1 1 105 105 TRP H H 105 8.926 8.926 8.977 -0.051 17890 8524 1 11 . 1 1 106 106 THR N N 106 120.480 120.480 119.405 1.075 17890 8525 1 11 . 1 1 106 106 THR HA H 106 4.966 4.966 4.913 0.053 17890 8526 1 11 . 1 1 106 106 THR C C 106 174.177 174.177 173.850 0.327 17890 8527 1 11 . 1 1 106 106 THR CA C 106 62.091 62.091 63.944 -1.853 17890 8528 1 11 . 1 1 106 106 THR CB C 106 69.649 69.649 69.280 0.369 17890 8529 1 11 . 1 1 106 106 THR H H 106 9.525 9.525 9.115 0.410 17890 8530 1 11 . 1 1 107 107 LEU N N 107 127.146 127.146 129.548 -2.402 17890 8531 1 11 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.164 -0.337 17890 8532 1 11 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.567 0.142 17890 8533 1 11 . 1 1 107 107 LEU CB C 107 41.523 41.523 42.860 -1.337 17890 8534 1 11 . 1 1 107 107 LEU H H 107 7.591 7.591 8.960 -1.369 17890 8535 1 11 . 1 1 108 108 THR N N 108 119.928 119.928 120.482 -0.554 17890 8536 1 11 . 1 1 108 108 THR HA H 108 4.411 4.411 4.706 -0.295 17890 8537 1 11 . 1 1 108 108 THR C C 108 173.319 173.319 173.361 -0.042 17890 8538 1 11 . 1 1 108 108 THR CA C 108 62.243 62.243 61.259 0.984 17890 8539 1 11 . 1 1 108 108 THR CB C 108 70.138 70.138 71.566 -1.427 17890 8540 1 11 . 1 1 108 108 THR H H 108 8.141 8.141 8.581 -0.440 17890 8541 1 11 . 1 1 109 109 LEU N N 109 130.557 130.557 127.624 2.933 17890 8542 1 11 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.043 -0.498 17890 8543 1 11 . 1 1 109 109 LEU C C 109 175.217 175.217 177.327 -2.110 17890 8544 1 11 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.615 -0.329 17890 8545 1 11 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.524 -1.918 17890 8546 1 11 . 1 1 109 109 LEU H H 109 8.924 8.924 8.645 0.279 17890 8547 1 11 . 1 1 110 110 THR N N 110 120.160 120.160 113.700 6.460 17890 8548 1 11 . 1 1 110 110 THR HA H 110 4.911 4.911 4.607 0.304 17890 8549 1 11 . 1 1 110 110 THR CA C 110 60.141 60.141 60.485 -0.344 17890 8550 1 11 . 1 1 110 110 THR CB C 110 72.785 72.785 70.963 1.822 17890 8551 1 11 . 1 1 110 110 THR H H 110 7.677 7.677 8.414 -0.737 17890 8552 1 11 . 1 1 111 111 SER HA H 111 4.204 4.204 4.291 -0.087 17890 8553 1 11 . 1 1 111 111 SER C C 111 174.755 174.755 175.165 -0.410 17890 8554 1 11 . 1 1 111 111 SER CA C 111 60.710 60.710 60.429 0.281 17890 8555 1 11 . 1 1 111 111 SER CB C 111 62.660 62.660 62.889 -0.229 17890 8556 1 11 . 1 1 112 112 GLY N N 112 107.313 107.313 106.296 1.017 17890 8557 1 11 . 1 1 112 112 GLY C C 112 173.023 173.023 173.117 -0.094 17890 8558 1 11 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.296 -1.146 17890 8559 1 11 . 1 1 112 112 GLY H H 112 8.249 8.249 7.382 0.867 17890 8560 1 11 . 1 1 113 113 GLY N N 113 105.618 105.618 108.203 -2.585 17890 8561 1 11 . 1 1 113 113 GLY C C 113 175.844 175.844 171.804 4.040 17890 8562 1 11 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.980 -3.221 17890 8563 1 11 . 1 1 113 113 GLY H H 113 7.444 7.444 7.424 0.020 17890 8564 1 11 . 1 1 114 114 TYR N N 114 121.548 121.548 117.504 4.044 17890 8565 1 11 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.390 -0.538 17890 8566 1 11 . 1 1 114 114 TYR C C 114 175.605 175.605 174.118 1.487 17890 8567 1 11 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.899 4.364 17890 8568 1 11 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.566 -4.633 17890 8569 1 11 . 1 1 114 114 TYR H H 114 9.677 9.677 9.005 0.672 17890 8570 1 11 . 1 1 115 115 ASN N N 115 123.274 123.274 117.296 5.978 17890 8571 1 11 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.211 -0.113 17890 8572 1 11 . 1 1 115 115 ASN C C 115 174.355 174.355 173.326 1.029 17890 8573 1 11 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.157 -1.111 17890 8574 1 11 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.729 -2.380 17890 8575 1 11 . 1 1 115 115 ASN H H 115 9.350 9.350 9.042 0.308 17890 8576 1 11 . 1 1 116 116 ILE N N 116 130.611 130.611 122.501 8.110 17890 8577 1 11 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.731 -0.492 17890 8578 1 11 . 1 1 116 116 ILE C C 116 173.998 173.998 173.943 0.055 17890 8579 1 11 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.135 2.064 17890 8580 1 11 . 1 1 116 116 ILE CB C 116 37.100 37.100 38.979 -1.879 17890 8581 1 11 . 1 1 116 116 ILE H H 116 9.473 9.473 8.545 0.928 17890 8582 1 11 . 1 1 117 117 GLN N N 117 121.633 121.633 125.320 -3.687 17890 8583 1 11 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.007 0.928 17890 8584 1 11 . 1 1 117 117 GLN C C 117 177.902 177.902 175.960 1.942 17890 8585 1 11 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.874 -0.554 17890 8586 1 11 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.495 3.962 17890 8587 1 11 . 1 1 117 117 GLN H H 117 8.781 8.781 8.473 0.308 17890 8588 1 11 . 1 1 118 118 ASP N N 118 116.836 116.836 120.639 -3.803 17890 8589 1 11 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.910 0.873 17890 8590 1 11 . 1 1 118 118 ASP C C 118 178.084 178.084 176.967 1.117 17890 8591 1 11 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.339 -1.569 17890 8592 1 11 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.123 -0.755 17890 8593 1 11 . 1 1 118 118 ASP H H 118 9.330 9.330 8.740 0.590 17890 8594 1 11 . 1 1 119 119 GLY N N 119 111.037 111.037 108.264 2.773 17890 8595 1 11 . 1 1 119 119 GLY C C 119 174.196 174.196 175.461 -1.265 17890 8596 1 11 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.144 1.833 17890 8597 1 11 . 1 1 119 119 GLY H H 119 8.986 8.986 8.422 0.564 17890 8598 1 11 . 1 1 120 120 LYS N N 120 114.809 114.809 122.031 -7.222 17890 8599 1 11 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.470 -0.121 17890 8600 1 11 . 1 1 120 120 LYS C C 120 175.174 175.174 176.785 -1.611 17890 8601 1 11 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.247 0.686 17890 8602 1 11 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.370 0.106 17890 8603 1 11 . 1 1 120 120 LYS H H 120 7.045 7.045 8.668 -1.623 17890 8604 1 11 . 1 1 121 121 ARG N N 121 116.291 116.291 114.504 1.787 17890 8605 1 11 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.071 -0.485 17890 8606 1 11 . 1 1 121 121 ARG C C 121 175.097 175.097 177.260 -2.163 17890 8607 1 11 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.143 0.926 17890 8608 1 11 . 1 1 121 121 ARG CB C 121 26.623 26.623 27.286 -0.663 17890 8609 1 11 . 1 1 121 121 ARG H H 121 7.683 7.683 7.918 -0.235 17890 8610 1 11 . 1 1 122 122 THR N N 122 113.730 113.730 108.842 4.888 17890 8611 1 11 . 1 1 122 122 THR HA H 122 4.540 4.540 4.203 0.337 17890 8612 1 11 . 1 1 122 122 THR C C 122 175.302 175.302 174.559 0.743 17890 8613 1 11 . 1 1 122 122 THR CA C 122 62.871 62.871 64.281 -1.410 17890 8614 1 11 . 1 1 122 122 THR CB C 122 71.552 71.552 69.874 1.678 17890 8615 1 11 . 1 1 122 122 THR H H 122 11.059 11.059 8.046 3.013 17890 8616 1 11 . 1 1 123 123 VAL N N 123 118.350 118.350 114.130 4.220 17890 8617 1 11 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.584 0.226 17890 8618 1 11 . 1 1 123 123 VAL C C 123 174.730 174.730 173.626 1.104 17890 8619 1 11 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.581 0.730 17890 8620 1 11 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.504 2.578 17890 8621 1 11 . 1 1 123 123 VAL H H 123 8.181 8.181 7.491 0.690 17890 8622 1 11 . 1 1 124 124 SER N N 124 113.053 113.053 114.179 -1.126 17890 8623 1 11 . 1 1 124 124 SER HA H 124 5.820 5.820 5.201 0.619 17890 8624 1 11 . 1 1 124 124 SER C C 124 175.521 175.521 173.635 1.886 17890 8625 1 11 . 1 1 124 124 SER CA C 124 58.087 58.087 56.624 1.463 17890 8626 1 11 . 1 1 124 124 SER CB C 124 67.405 67.405 65.823 1.582 17890 8627 1 11 . 1 1 124 124 SER H H 124 9.138 9.138 8.665 0.473 17890 8628 1 11 . 1 1 125 125 TRP N N 125 124.900 124.900 124.440 0.460 17890 8629 1 11 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.995 0.615 17890 8630 1 11 . 1 1 125 125 TRP C C 125 178.114 178.114 177.350 0.764 17890 8631 1 11 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.420 -0.946 17890 8632 1 11 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.173 0.850 17890 8633 1 11 . 1 1 125 125 TRP H H 125 8.843 8.843 8.290 0.553 17890 8634 1 11 . 1 1 126 126 SER N N 126 119.243 119.243 114.185 5.058 17890 8635 1 11 . 1 1 126 126 SER HA H 126 5.443 5.443 5.240 0.203 17890 8636 1 11 . 1 1 126 126 SER C C 126 171.668 171.668 172.610 -0.942 17890 8637 1 11 . 1 1 126 126 SER CA C 126 58.696 58.696 57.356 1.340 17890 8638 1 11 . 1 1 126 126 SER CB C 126 66.176 66.176 66.297 -0.121 17890 8639 1 11 . 1 1 126 126 SER H H 126 9.835 9.835 9.343 0.492 17890 8640 1 11 . 1 1 127 127 LEU N N 127 113.708 113.708 118.421 -4.713 17890 8641 1 11 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.710 0.445 17890 8642 1 11 . 1 1 127 127 LEU C C 127 176.563 176.563 176.934 -0.371 17890 8643 1 11 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.581 -0.936 17890 8644 1 11 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.194 -1.498 17890 8645 1 11 . 1 1 127 127 LEU H H 127 6.559 6.559 8.280 -1.721 17890 8646 1 11 . 1 1 128 128 ASN N N 128 121.739 121.739 118.213 3.526 17890 8647 1 11 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.848 -0.159 17890 8648 1 11 . 1 1 128 128 ASN C C 128 175.452 175.452 175.399 0.053 17890 8649 1 11 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.937 1.070 17890 8650 1 11 . 1 1 128 128 ASN CB C 128 39.291 39.291 39.614 -0.323 17890 8651 1 11 . 1 1 128 128 ASN H H 128 8.662 8.662 9.068 -0.406 17890 8652 1 11 . 1 1 129 129 ASN N N 129 119.586 119.586 115.383 4.203 17890 8653 1 11 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.699 0.298 17890 8654 1 11 . 1 1 129 129 ASN C C 129 175.900 175.900 174.707 1.193 17890 8655 1 11 . 1 1 129 129 ASN CA C 129 54.233 54.233 52.761 1.472 17890 8656 1 11 . 1 1 129 129 ASN CB C 129 41.256 41.256 38.335 2.921 17890 8657 1 11 . 1 1 129 129 ASN H H 129 10.962 10.962 7.970 2.992 17890 8658 1 11 . 1 1 130 130 ALA N N 130 128.292 128.292 121.528 6.764 17890 8659 1 11 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.056 -0.486 17890 8660 1 11 . 1 1 130 130 ALA C C 130 172.620 172.620 177.733 -5.113 17890 8661 1 11 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.273 -0.634 17890 8662 1 11 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.230 -1.130 17890 8663 1 11 . 1 1 130 130 ALA H H 130 10.629 10.629 8.271 2.358 17890 8664 1 11 . 1 1 131 131 THR N N 131 105.584 105.584 111.922 -6.338 17890 8665 1 11 . 1 1 131 131 THR HA H 131 4.462 4.462 4.301 0.161 17890 8666 1 11 . 1 1 131 131 THR C C 131 173.552 173.552 174.831 -1.279 17890 8667 1 11 . 1 1 131 131 THR CA C 131 58.338 58.338 61.694 -3.356 17890 8668 1 11 . 1 1 131 131 THR CB C 131 71.569 71.569 70.115 1.454 17890 8669 1 11 . 1 1 131 131 THR H H 131 7.092 7.092 8.330 -1.238 17890 8670 1 11 . 1 1 132 132 ALA N N 132 121.773 121.773 124.433 -2.660 17890 8671 1 11 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.052 -0.303 17890 8672 1 11 . 1 1 132 132 ALA C C 132 178.819 178.819 178.405 0.414 17890 8673 1 11 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.707 1.577 17890 8674 1 11 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.827 -0.600 17890 8675 1 11 . 1 1 132 132 ALA H H 132 8.952 8.952 8.288 0.664 17890 8676 1 11 . 1 1 133 133 GLY N N 133 113.965 113.965 111.954 2.011 17890 8677 1 11 . 1 1 133 133 GLY C C 133 173.453 173.453 174.149 -0.696 17890 8678 1 11 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.936 0.230 17890 8679 1 11 . 1 1 133 133 GLY H H 133 9.016 9.016 8.862 0.154 17890 8680 1 11 . 1 1 134 134 GLU N N 134 123.460 123.460 121.226 2.234 17890 8681 1 11 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.430 -0.472 17890 8682 1 11 . 1 1 134 134 GLU C C 134 176.120 176.120 175.986 0.134 17890 8683 1 11 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.257 2.142 17890 8684 1 11 . 1 1 134 134 GLU CB C 134 31.385 31.385 31.294 0.091 17890 8685 1 11 . 1 1 134 134 GLU H H 134 7.598 7.598 7.612 -0.014 17890 8686 1 11 . 1 1 135 135 GLU N N 135 122.633 122.633 123.564 -0.931 17890 8687 1 11 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.372 -0.061 17890 8688 1 11 . 1 1 135 135 GLU C C 135 176.014 176.014 176.554 -0.540 17890 8689 1 11 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.702 -0.520 17890 8690 1 11 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.507 -1.054 17890 8691 1 11 . 1 1 135 135 GLU H H 135 8.258 8.258 8.562 -0.304 17890 8692 1 11 . 1 1 136 136 VAL N N 136 123.635 123.635 125.760 -2.125 17890 8693 1 11 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.853 -0.161 17890 8694 1 11 . 1 1 136 136 VAL C C 136 173.932 173.932 175.797 -1.865 17890 8695 1 11 . 1 1 136 136 VAL CA C 136 63.832 63.832 64.127 -0.295 17890 8696 1 11 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.005 -0.141 17890 8697 1 11 . 1 1 136 136 VAL H H 136 7.267 7.267 7.740 -0.473 17890 8698 1 11 . 1 1 137 137 SER N N 137 118.950 118.950 118.409 0.541 17890 8699 1 11 . 1 1 137 137 SER HA H 137 4.887 4.887 4.988 -0.101 17890 8700 1 11 . 1 1 137 137 SER C C 137 173.780 173.780 172.897 0.883 17890 8701 1 11 . 1 1 137 137 SER CA C 137 57.895 57.895 57.125 0.770 17890 8702 1 11 . 1 1 137 137 SER CB C 137 65.027 65.027 66.236 -1.209 17890 8703 1 11 . 1 1 137 137 SER H H 137 8.454 8.454 8.528 -0.074 17890 8704 1 11 . 1 1 138 138 ILE N N 138 123.511 123.511 119.745 3.766 17890 8705 1 11 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.025 -0.777 17890 8706 1 11 . 1 1 138 138 ILE C C 138 176.142 176.142 175.497 0.645 17890 8707 1 11 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.389 1.461 17890 8708 1 11 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.699 -3.104 17890 8709 1 11 . 1 1 138 138 ILE H H 138 7.915 7.915 8.466 -0.551 17890 8710 1 11 . 1 1 139 139 GLY N N 139 115.638 115.638 110.989 4.649 17890 8711 1 11 . 1 1 139 139 GLY C C 139 171.947 171.947 173.273 -1.326 17890 8712 1 11 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.401 1.685 17890 8713 1 11 . 1 1 139 139 GLY H H 139 8.490 8.490 8.397 0.093 17890 8714 1 11 . 1 1 140 140 ALA N N 140 128.563 128.563 121.218 7.345 17890 8715 1 11 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.344 0.052 17890 8716 1 11 . 1 1 140 140 ALA C C 140 177.956 177.956 177.265 0.691 17890 8717 1 11 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.659 -2.013 17890 8718 1 11 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.867 0.337 17890 8719 1 11 . 1 1 140 140 ALA H H 140 8.531 8.531 8.421 0.110 17890 8720 1 11 . 1 1 141 141 ASP N N 141 120.886 120.886 114.570 6.316 17890 8721 1 11 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.567 0.031 17890 8722 1 11 . 1 1 141 141 ASP C C 141 175.411 175.411 174.350 1.061 17890 8723 1 11 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.657 0.259 17890 8724 1 11 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.494 -1.802 17890 8725 1 11 . 1 1 141 141 ASP H H 141 8.507 8.507 7.697 0.810 17890 8726 1 11 . 1 1 142 142 ALA N N 142 125.604 125.604 123.311 2.293 17890 8727 1 11 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.639 -0.122 17890 8728 1 11 . 1 1 142 142 ALA C C 142 177.671 177.671 177.842 -0.171 17890 8729 1 11 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.500 0.493 17890 8730 1 11 . 1 1 142 142 ALA CB C 142 21.535 21.535 20.956 0.579 17890 8731 1 11 . 1 1 142 142 ALA H H 142 7.894 7.894 8.224 -0.330 17890 8732 1 11 . 1 1 143 143 THR N N 143 118.085 118.085 118.535 -0.450 17890 8733 1 11 . 1 1 143 143 THR HA H 143 3.744 3.744 4.051 -0.307 17890 8734 1 11 . 1 1 143 143 THR C C 143 175.464 175.464 175.225 0.239 17890 8735 1 11 . 1 1 143 143 THR CA C 143 64.548 64.548 65.061 -0.513 17890 8736 1 11 . 1 1 143 143 THR CB C 143 69.305 69.305 69.066 0.239 17890 8737 1 11 . 1 1 143 143 THR H H 143 8.268 8.268 8.831 -0.563 17890 8738 1 11 . 1 1 144 144 PHE N N 144 118.635 118.635 115.090 3.545 17890 8739 1 11 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.698 -0.352 17890 8740 1 11 . 1 1 144 144 PHE C C 144 176.209 176.209 174.986 1.223 17890 8741 1 11 . 1 1 144 144 PHE CA C 144 61.462 61.462 58.028 3.434 17890 8742 1 11 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.435 0.169 17890 8743 1 11 . 1 1 144 144 PHE H H 144 8.719 8.719 7.979 0.740 17890 8744 1 11 . 1 1 145 145 SER N N 145 113.446 113.446 114.090 -0.644 17890 8745 1 11 . 1 1 145 145 SER HA H 145 4.866 4.866 4.224 0.642 17890 8746 1 11 . 1 1 145 145 SER C C 145 176.605 176.605 175.959 0.646 17890 8747 1 11 . 1 1 145 145 SER CA C 145 59.432 59.432 57.507 1.925 17890 8748 1 11 . 1 1 145 145 SER CB C 145 62.167 62.167 63.171 -1.004 17890 8749 1 11 . 1 1 145 145 SER H H 145 8.657 8.657 7.220 1.437 17890 8750 1 11 . 1 1 146 146 GLY N N 146 109.277 109.277 112.576 -3.299 17890 8751 1 11 . 1 1 146 146 GLY C C 146 174.293 174.293 173.199 1.094 17890 8752 1 11 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.076 -0.136 17890 8753 1 11 . 1 1 146 146 GLY H H 146 7.467 7.467 7.969 -0.502 17890 8754 1 11 . 1 1 147 147 ARG N N 147 122.863 122.863 117.510 5.353 17890 8755 1 11 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.865 0.576 17890 8756 1 11 . 1 1 147 147 ARG C C 147 173.849 173.849 173.626 0.223 17890 8757 1 11 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.267 -2.040 17890 8758 1 11 . 1 1 147 147 ARG CB C 147 32.597 32.597 31.848 0.749 17890 8759 1 11 . 1 1 147 147 ARG H H 147 7.556 7.556 7.432 0.124 17890 8760 1 11 . 1 1 148 148 TRP N N 148 118.465 118.465 120.230 -1.765 17890 8761 1 11 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.051 -0.205 17890 8762 1 11 . 1 1 148 148 TRP C C 148 174.353 174.353 174.128 0.225 17890 8763 1 11 . 1 1 148 148 TRP CA C 148 55.662 55.662 57.009 -1.347 17890 8764 1 11 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.285 -1.286 17890 8765 1 11 . 1 1 148 148 TRP H H 148 8.709 8.709 9.201 -0.492 17890 8766 1 11 . 1 1 149 149 VAL N N 149 125.852 125.852 118.295 7.557 17890 8767 1 11 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.576 -0.433 17890 8768 1 11 . 1 1 149 149 VAL C C 149 173.613 173.613 173.372 0.241 17890 8769 1 11 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.880 1.860 17890 8770 1 11 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.179 -2.796 17890 8771 1 11 . 1 1 149 149 VAL H H 149 9.700 9.700 8.793 0.907 17890 8772 1 11 . 1 1 150 150 ILE N N 150 125.140 125.140 128.060 -2.920 17890 8773 1 11 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.133 -0.271 17890 8774 1 11 . 1 1 150 150 ILE C C 150 175.661 175.661 174.913 0.748 17890 8775 1 11 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.411 1.409 17890 8776 1 11 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.946 -1.126 17890 8777 1 11 . 1 1 150 150 ILE H H 150 7.747 7.747 7.991 -0.244 17890 8778 1 11 . 1 1 151 151 GLU N N 151 126.762 126.762 128.250 -1.488 17890 8779 1 11 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.851 0.029 17890 8780 1 11 . 1 1 151 151 GLU C C 151 174.424 174.424 174.735 -0.311 17890 8781 1 11 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.838 0.958 17890 8782 1 11 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.980 0.271 17890 8783 1 11 . 1 1 151 151 GLU H H 151 8.892 8.892 8.792 0.100 17890 8784 1 11 . 1 1 152 152 LYS N N 152 126.299 126.299 122.283 4.016 17890 8785 1 11 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.792 0.069 17890 8786 1 11 . 1 1 152 152 LYS C C 152 176.282 176.282 176.605 -0.323 17890 8787 1 11 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.869 0.636 17890 8788 1 11 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.584 0.752 17890 8789 1 11 . 1 1 152 152 LYS H H 152 8.640 8.640 8.313 0.327 17890 8790 1 12 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.356 -2.062 17890 8791 1 12 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.398 0.224 17890 8792 1 12 . 1 1 8 8 HIS CA C 8 55.661 55.661 57.691 -2.030 17890 8793 1 12 . 1 1 8 8 HIS CB C 8 29.880 29.880 30.302 -0.423 17890 8794 1 12 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.586 0.060 17890 8795 1 12 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.226 -0.542 17890 8796 1 12 . 1 1 9 9 HIS CB C 9 29.831 29.831 32.189 -2.358 17890 8797 1 12 . 1 1 10 10 HIS N N 10 120.811 120.811 117.791 3.020 17890 8798 1 12 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.734 -0.055 17890 8799 1 12 . 1 1 10 10 HIS C C 10 174.875 174.875 174.245 0.630 17890 8800 1 12 . 1 1 10 10 HIS CA C 10 55.746 55.746 54.524 1.222 17890 8801 1 12 . 1 1 10 10 HIS CB C 10 29.889 29.889 32.608 -2.719 17890 8802 1 12 . 1 1 10 10 HIS H H 10 8.583 8.583 7.860 0.723 17890 8803 1 12 . 1 1 11 11 SER N N 11 118.009 118.009 114.886 3.123 17890 8804 1 12 . 1 1 11 11 SER HA H 11 4.424 4.424 3.897 0.527 17890 8805 1 12 . 1 1 11 11 SER C C 11 174.962 174.962 174.065 0.897 17890 8806 1 12 . 1 1 11 11 SER CA C 11 58.660 58.660 59.388 -0.728 17890 8807 1 12 . 1 1 11 11 SER CB C 11 63.822 63.822 61.940 1.882 17890 8808 1 12 . 1 1 11 11 SER H H 11 8.438 8.438 8.278 0.160 17890 8809 1 12 . 1 1 12 12 GLY N N 12 111.011 111.011 105.905 5.106 17890 8810 1 12 . 1 1 12 12 GLY C C 12 173.907 173.907 173.553 0.354 17890 8811 1 12 . 1 1 12 12 GLY CA C 12 45.421 45.421 46.243 -0.822 17890 8812 1 12 . 1 1 12 12 GLY H H 12 8.433 8.433 7.875 0.558 17890 8813 1 12 . 1 1 13 13 ASP N N 13 120.291 120.291 119.407 0.884 17890 8814 1 12 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.672 -0.010 17890 8815 1 12 . 1 1 13 13 ASP C C 13 176.115 176.115 175.820 0.295 17890 8816 1 12 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.263 1.040 17890 8817 1 12 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.774 -0.309 17890 8818 1 12 . 1 1 13 13 ASP H H 13 8.153 8.153 8.284 -0.131 17890 8819 1 12 . 1 1 14 14 SER N N 14 116.987 116.987 115.707 1.280 17890 8820 1 12 . 1 1 14 14 SER HA H 14 4.754 4.754 4.522 0.232 17890 8821 1 12 . 1 1 14 14 SER CA C 14 56.469 56.469 57.277 -0.808 17890 8822 1 12 . 1 1 14 14 SER CB C 14 63.553 63.553 63.331 0.222 17890 8823 1 12 . 1 1 14 14 SER H H 14 8.210 8.210 7.826 0.384 17890 8824 1 12 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.374 0.068 17890 8825 1 12 . 1 1 15 15 PRO C C 15 176.424 176.424 175.860 0.564 17890 8826 1 12 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.259 -0.026 17890 8827 1 12 . 1 1 15 15 PRO CB C 15 32.148 32.148 31.978 0.170 17890 8828 1 12 . 1 1 16 16 ALA N N 16 124.219 124.219 124.764 -0.545 17890 8829 1 12 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.461 -0.111 17890 8830 1 12 . 1 1 16 16 ALA C C 16 177.552 177.552 177.108 0.444 17890 8831 1 12 . 1 1 16 16 ALA CA C 16 52.433 52.433 51.894 0.539 17890 8832 1 12 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.018 0.301 17890 8833 1 12 . 1 1 16 16 ALA H H 16 8.284 8.284 8.521 -0.237 17890 8834 1 12 . 1 1 17 17 VAL N N 17 119.504 119.504 118.393 1.111 17890 8835 1 12 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.136 0.113 17890 8836 1 12 . 1 1 17 17 VAL C C 17 176.322 176.322 175.780 0.542 17890 8837 1 12 . 1 1 17 17 VAL CA C 17 62.278 62.278 63.291 -1.013 17890 8838 1 12 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.783 0.174 17890 8839 1 12 . 1 1 17 17 VAL H H 17 8.046 8.046 7.729 0.317 17890 8840 1 12 . 1 1 18 18 THR N N 18 118.186 118.186 121.101 -2.915 17890 8841 1 12 . 1 1 18 18 THR HA H 18 4.473 4.473 4.466 0.007 17890 8842 1 12 . 1 1 18 18 THR C C 18 174.248 174.248 174.296 -0.048 17890 8843 1 12 . 1 1 18 18 THR CA C 18 61.565 61.565 61.919 -0.354 17890 8844 1 12 . 1 1 18 18 THR CB C 18 70.165 70.165 69.253 0.912 17890 8845 1 12 . 1 1 18 18 THR H H 18 8.276 8.276 8.479 -0.203 17890 8846 1 12 . 1 1 19 19 LEU N N 19 125.265 125.265 119.497 5.768 17890 8847 1 12 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.957 0.336 17890 8848 1 12 . 1 1 19 19 LEU C C 19 175.689 175.689 175.368 0.321 17890 8849 1 12 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.598 -0.171 17890 8850 1 12 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.180 2.099 17890 8851 1 12 . 1 1 19 19 LEU H H 19 8.091 8.091 8.230 -0.139 17890 8852 1 12 . 1 1 20 20 SER N N 20 114.622 114.622 115.835 -1.213 17890 8853 1 12 . 1 1 20 20 SER HA H 20 4.947 4.947 4.850 0.097 17890 8854 1 12 . 1 1 20 20 SER C C 20 174.220 174.220 173.128 1.092 17890 8855 1 12 . 1 1 20 20 SER CA C 20 56.583 56.583 57.197 -0.614 17890 8856 1 12 . 1 1 20 20 SER CB C 20 65.653 65.653 66.171 -0.518 17890 8857 1 12 . 1 1 20 20 SER H H 20 7.316 7.316 7.926 -0.610 17890 8858 1 12 . 1 1 21 21 ALA N N 21 125.517 125.517 123.767 1.750 17890 8859 1 12 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.839 -0.171 17890 8860 1 12 . 1 1 21 21 ALA C C 21 177.960 177.960 177.552 0.408 17890 8861 1 12 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.418 1.592 17890 8862 1 12 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.353 -0.128 17890 8863 1 12 . 1 1 21 21 ALA H H 21 8.993 8.993 8.447 0.546 17890 8864 1 12 . 1 1 22 22 GLY N N 22 109.543 109.543 112.603 -3.060 17890 8865 1 12 . 1 1 22 22 GLY C C 22 170.422 170.422 172.085 -1.663 17890 8866 1 12 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.041 0.340 17890 8867 1 12 . 1 1 22 22 GLY H H 22 8.411 8.411 8.950 -0.539 17890 8868 1 12 . 1 1 23 23 ASN N N 23 119.649 119.649 120.016 -0.367 17890 8869 1 12 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.690 0.197 17890 8870 1 12 . 1 1 23 23 ASN C C 23 175.207 175.207 174.664 0.543 17890 8871 1 12 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.731 -0.910 17890 8872 1 12 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.610 -0.855 17890 8873 1 12 . 1 1 23 23 ASN H H 23 8.092 8.092 8.411 -0.319 17890 8874 1 12 . 1 1 24 24 TYR N N 24 120.889 120.889 121.950 -1.061 17890 8875 1 12 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.182 0.073 17890 8876 1 12 . 1 1 24 24 TYR C C 24 175.667 175.667 174.441 1.226 17890 8877 1 12 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.252 0.862 17890 8878 1 12 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.620 0.206 17890 8879 1 12 . 1 1 24 24 TYR H H 24 9.914 9.914 8.896 1.018 17890 8880 1 12 . 1 1 25 25 ILE N N 25 115.978 115.978 113.242 2.736 17890 8881 1 12 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.047 0.039 17890 8882 1 12 . 1 1 25 25 ILE C C 25 175.200 175.200 174.049 1.151 17890 8883 1 12 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.703 0.842 17890 8884 1 12 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.979 -0.857 17890 8885 1 12 . 1 1 25 25 ILE H H 25 9.216 9.216 9.249 -0.033 17890 8886 1 12 . 1 1 26 26 ILE N N 26 123.957 123.957 121.900 2.057 17890 8887 1 12 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.286 -0.310 17890 8888 1 12 . 1 1 26 26 ILE C C 26 174.810 174.810 174.973 -0.163 17890 8889 1 12 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.060 0.549 17890 8890 1 12 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.565 0.557 17890 8891 1 12 . 1 1 26 26 ILE H H 26 9.559 9.559 8.940 0.619 17890 8892 1 12 . 1 1 27 27 TYR N N 27 121.371 121.371 123.491 -2.120 17890 8893 1 12 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.541 0.649 17890 8894 1 12 . 1 1 27 27 TYR C C 27 173.963 173.963 173.487 0.476 17890 8895 1 12 . 1 1 27 27 TYR CA C 27 54.669 54.669 55.082 -0.413 17890 8896 1 12 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.969 0.729 17890 8897 1 12 . 1 1 27 27 TYR H H 27 9.378 9.378 9.018 0.360 17890 8898 1 12 . 1 1 28 28 ASN N N 28 121.991 121.991 120.237 1.754 17890 8899 1 12 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.023 -0.255 17890 8900 1 12 . 1 1 28 28 ASN C C 28 174.352 174.352 176.077 -1.725 17890 8901 1 12 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.110 2.010 17890 8902 1 12 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.819 1.627 17890 8903 1 12 . 1 1 28 28 ASN H H 28 8.466 8.466 8.426 0.040 17890 8904 1 12 . 1 1 29 29 ARG N N 29 121.103 121.103 126.946 -5.843 17890 8905 1 12 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.089 -0.228 17890 8906 1 12 . 1 1 29 29 ARG C C 29 173.635 173.635 177.516 -3.881 17890 8907 1 12 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.431 0.862 17890 8908 1 12 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.180 0.218 17890 8909 1 12 . 1 1 29 29 ARG H H 29 7.756 7.756 8.238 -0.482 17890 8910 1 12 . 1 1 30 30 VAL N N 30 118.412 118.412 117.380 1.032 17890 8911 1 12 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.828 0.116 17890 8912 1 12 . 1 1 30 30 VAL C C 30 176.199 176.199 176.363 -0.164 17890 8913 1 12 . 1 1 30 30 VAL CA C 30 62.577 62.577 64.077 -1.500 17890 8914 1 12 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.152 -1.930 17890 8915 1 12 . 1 1 30 30 VAL H H 30 8.976 8.976 7.682 1.294 17890 8916 1 12 . 1 1 31 31 LEU N N 31 125.418 125.418 116.554 8.864 17890 8917 1 12 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.039 0.446 17890 8918 1 12 . 1 1 31 31 LEU C C 31 179.123 179.123 175.881 3.242 17890 8919 1 12 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.707 -1.682 17890 8920 1 12 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.970 3.611 17890 8921 1 12 . 1 1 31 31 LEU H H 31 8.856 8.856 7.518 1.338 17890 8922 1 12 . 1 1 32 32 SER N N 32 116.890 116.890 115.992 0.898 17890 8923 1 12 . 1 1 32 32 SER HA H 32 5.365 5.365 4.885 0.480 17890 8924 1 12 . 1 1 32 32 SER CA C 32 57.269 57.269 55.266 2.003 17890 8925 1 12 . 1 1 32 32 SER CB C 32 62.213 62.213 64.245 -2.031 17890 8926 1 12 . 1 1 32 32 SER H H 32 9.307 9.307 8.023 1.284 17890 8927 1 12 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.354 -0.474 17890 8928 1 12 . 1 1 33 33 PRO C C 33 175.137 175.137 177.613 -2.476 17890 8929 1 12 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.368 0.917 17890 8930 1 12 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.670 0.361 17890 8931 1 12 . 1 1 34 34 ARG N N 34 110.279 110.279 119.018 -8.739 17890 8932 1 12 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.220 0.272 17890 8933 1 12 . 1 1 34 34 ARG C C 34 176.844 176.844 177.265 -0.421 17890 8934 1 12 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.989 -1.553 17890 8935 1 12 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.391 0.193 17890 8936 1 12 . 1 1 34 34 ARG H H 34 7.257 7.257 7.746 -0.489 17890 8937 1 12 . 1 1 35 35 GLY N N 35 110.288 110.288 106.151 4.137 17890 8938 1 12 . 1 1 35 35 GLY C C 35 173.336 173.336 173.821 -0.485 17890 8939 1 12 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.833 2.197 17890 8940 1 12 . 1 1 35 35 GLY H H 35 8.589 8.589 7.839 0.750 17890 8941 1 12 . 1 1 36 36 GLU N N 36 116.838 116.838 119.255 -2.417 17890 8942 1 12 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.615 -0.267 17890 8943 1 12 . 1 1 36 36 GLU C C 36 176.915 176.915 174.973 1.942 17890 8944 1 12 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.541 0.366 17890 8945 1 12 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.507 -2.092 17890 8946 1 12 . 1 1 36 36 GLU H H 36 7.769 7.769 7.738 0.031 17890 8947 1 12 . 1 1 37 37 LYS N N 37 123.775 123.775 122.596 1.179 17890 8948 1 12 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.178 0.245 17890 8949 1 12 . 1 1 37 37 LYS C C 37 176.067 176.067 175.876 0.191 17890 8950 1 12 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.243 -0.342 17890 8951 1 12 . 1 1 37 37 LYS CB C 37 33.674 33.674 33.096 0.578 17890 8952 1 12 . 1 1 37 37 LYS H H 37 8.667 8.667 8.626 0.041 17890 8953 1 12 . 1 1 38 38 LEU N N 38 126.658 126.658 124.850 1.808 17890 8954 1 12 . 1 1 38 38 LEU HA H 38 4.227 4.227 5.090 -0.863 17890 8955 1 12 . 1 1 38 38 LEU C C 38 174.332 174.332 175.811 -1.479 17890 8956 1 12 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.574 -0.231 17890 8957 1 12 . 1 1 38 38 LEU CB C 38 41.651 41.651 41.748 -0.097 17890 8958 1 12 . 1 1 38 38 LEU H H 38 10.455 10.455 8.846 1.609 17890 8959 1 12 . 1 1 39 39 ALA N N 39 127.018 127.018 124.567 2.451 17890 8960 1 12 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.204 0.025 17890 8961 1 12 . 1 1 39 39 ALA C C 39 178.694 178.694 176.433 2.261 17890 8962 1 12 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.694 -0.469 17890 8963 1 12 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.842 0.507 17890 8964 1 12 . 1 1 39 39 ALA H H 39 8.773 8.773 8.217 0.556 17890 8965 1 12 . 1 1 40 40 LEU N N 40 126.771 126.771 123.191 3.580 17890 8966 1 12 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.576 -0.222 17890 8967 1 12 . 1 1 40 40 LEU C C 40 178.309 178.309 176.614 1.695 17890 8968 1 12 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.102 0.744 17890 8969 1 12 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.898 0.425 17890 8970 1 12 . 1 1 40 40 LEU H H 40 9.665 9.665 8.831 0.834 17890 8971 1 12 . 1 1 41 41 THR N N 41 126.578 126.578 124.486 2.092 17890 8972 1 12 . 1 1 41 41 THR HA H 41 4.916 4.916 5.200 -0.284 17890 8973 1 12 . 1 1 41 41 THR C C 41 172.547 172.547 173.490 -0.943 17890 8974 1 12 . 1 1 41 41 THR CA C 41 63.253 63.253 61.363 1.890 17890 8975 1 12 . 1 1 41 41 THR CB C 41 71.832 71.832 70.628 1.204 17890 8976 1 12 . 1 1 41 41 THR H H 41 9.802 9.802 9.114 0.688 17890 8977 1 12 . 1 1 42 42 TYR N N 42 130.506 130.506 129.474 1.032 17890 8978 1 12 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.544 0.558 17890 8979 1 12 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.619 -3.633 17890 8980 1 12 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.212 -0.057 17890 8981 1 12 . 1 1 42 42 TYR H H 42 9.428 9.428 8.674 0.754 17890 8982 1 12 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.439 0.051 17890 8983 1 12 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.055 0.518 17890 8984 1 12 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.690 -0.046 17890 8985 1 12 . 1 1 44 44 GLY N N 44 113.736 113.736 106.777 6.959 17890 8986 1 12 . 1 1 44 44 GLY C C 44 171.790 171.790 173.582 -1.792 17890 8987 1 12 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.219 0.497 17890 8988 1 12 . 1 1 44 44 GLY H H 44 8.337 8.337 8.148 0.189 17890 8989 1 12 . 1 1 45 45 ARG N N 45 113.899 113.899 116.606 -2.707 17890 8990 1 12 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.576 0.000 17890 8991 1 12 . 1 1 45 45 ARG C C 45 175.151 175.151 173.533 1.618 17890 8992 1 12 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.291 -0.126 17890 8993 1 12 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.393 1.826 17890 8994 1 12 . 1 1 45 45 ARG H H 45 6.463 6.463 7.557 -1.094 17890 8995 1 12 . 1 1 46 46 GLN N N 46 119.000 119.000 117.252 1.748 17890 8996 1 12 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.513 -0.064 17890 8997 1 12 . 1 1 46 46 GLN C C 46 177.282 177.282 176.068 1.214 17890 8998 1 12 . 1 1 46 46 GLN CA C 46 56.613 56.613 54.755 1.858 17890 8999 1 12 . 1 1 46 46 GLN CB C 46 30.496 30.496 30.117 0.379 17890 9000 1 12 . 1 1 46 46 GLN H H 46 8.683 8.683 8.403 0.280 17890 9001 1 12 . 1 1 47 47 ARG N N 47 113.526 113.526 120.305 -6.779 17890 9002 1 12 . 1 1 47 47 ARG HA H 47 3.530 3.530 3.988 -0.458 17890 9003 1 12 . 1 1 47 47 ARG C C 47 174.130 174.130 174.838 -0.708 17890 9004 1 12 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.323 1.493 17890 9005 1 12 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.568 0.502 17890 9006 1 12 . 1 1 47 47 ARG H H 47 9.677 9.677 8.762 0.915 17890 9007 1 12 . 1 1 48 48 THR N N 48 114.672 114.672 114.948 -0.276 17890 9008 1 12 . 1 1 48 48 THR HA H 48 4.938 4.938 4.712 0.226 17890 9009 1 12 . 1 1 48 48 THR CA C 48 59.987 59.987 60.414 -0.427 17890 9010 1 12 . 1 1 48 48 THR CB C 48 71.947 71.947 71.467 0.480 17890 9011 1 12 . 1 1 48 48 THR H H 48 8.104 8.104 7.525 0.579 17890 9012 1 12 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.644 -0.276 17890 9013 1 12 . 1 1 49 49 PRO C C 49 175.651 175.651 176.200 -0.549 17890 9014 1 12 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.851 1.330 17890 9015 1 12 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.340 0.357 17890 9016 1 12 . 1 1 50 50 VAL N N 50 122.562 122.562 119.069 3.493 17890 9017 1 12 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.238 -0.291 17890 9018 1 12 . 1 1 50 50 VAL C C 50 174.493 174.493 175.518 -1.025 17890 9019 1 12 . 1 1 50 50 VAL CA C 50 63.811 63.811 60.407 3.404 17890 9020 1 12 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.198 -2.030 17890 9021 1 12 . 1 1 50 50 VAL H H 50 8.123 8.123 8.412 -0.289 17890 9022 1 12 . 1 1 51 51 THR N N 51 113.549 113.549 118.656 -5.107 17890 9023 1 12 . 1 1 51 51 THR HA H 51 5.372 5.372 5.004 0.368 17890 9024 1 12 . 1 1 51 51 THR C C 51 174.841 174.841 173.327 1.514 17890 9025 1 12 . 1 1 51 51 THR CA C 51 59.196 59.196 60.672 -1.476 17890 9026 1 12 . 1 1 51 51 THR CB C 51 72.703 72.703 72.040 0.663 17890 9027 1 12 . 1 1 51 51 THR H H 51 7.057 7.057 8.167 -1.110 17890 9028 1 12 . 1 1 52 52 VAL N N 52 107.374 107.374 115.232 -7.858 17890 9029 1 12 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.336 0.178 17890 9030 1 12 . 1 1 52 52 VAL C C 52 175.697 175.697 173.938 1.759 17890 9031 1 12 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.289 -0.817 17890 9032 1 12 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.652 0.122 17890 9033 1 12 . 1 1 52 52 VAL H H 52 8.062 8.062 8.550 -0.488 17890 9034 1 12 . 1 1 53 53 SER N N 53 114.662 114.662 116.452 -1.790 17890 9035 1 12 . 1 1 53 53 SER HA H 53 4.690 4.690 4.965 -0.275 17890 9036 1 12 . 1 1 53 53 SER CA C 53 56.828 56.828 56.123 0.705 17890 9037 1 12 . 1 1 53 53 SER CB C 53 64.789 64.789 65.995 -1.206 17890 9038 1 12 . 1 1 53 53 SER H H 53 8.681 8.681 8.697 -0.016 17890 9039 1 12 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.677 0.099 17890 9040 1 12 . 1 1 54 54 PRO C C 54 177.724 177.724 176.250 1.474 17890 9041 1 12 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.165 0.260 17890 9042 1 12 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.022 0.075 17890 9043 1 12 . 1 1 55 55 LEU N N 55 128.655 128.655 126.701 1.954 17890 9044 1 12 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.384 0.143 17890 9045 1 12 . 1 1 55 55 LEU C C 55 178.696 178.696 176.679 2.017 17890 9046 1 12 . 1 1 55 55 LEU CA C 55 56.246 56.246 55.686 0.560 17890 9047 1 12 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.883 0.723 17890 9048 1 12 . 1 1 55 55 LEU H H 55 8.675 8.675 8.337 0.338 17890 9049 1 12 . 1 1 56 56 ASP N N 56 126.651 126.651 123.649 3.002 17890 9050 1 12 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.691 0.018 17890 9051 1 12 . 1 1 56 56 ASP C C 56 177.729 177.729 176.260 1.469 17890 9052 1 12 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.809 -0.187 17890 9053 1 12 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.439 0.193 17890 9054 1 12 . 1 1 56 56 ASP H H 56 9.683 9.683 8.333 1.350 17890 9055 1 12 . 1 1 57 57 GLY N N 57 109.299 109.299 108.896 0.403 17890 9056 1 12 . 1 1 57 57 GLY C C 57 174.558 174.558 174.260 0.298 17890 9057 1 12 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.982 0.973 17890 9058 1 12 . 1 1 57 57 GLY H H 57 8.157 8.157 8.130 0.027 17890 9059 1 12 . 1 1 58 58 SER N N 58 116.740 116.740 115.859 0.881 17890 9060 1 12 . 1 1 58 58 SER HA H 58 4.288 4.288 4.459 -0.171 17890 9061 1 12 . 1 1 58 58 SER C C 58 177.252 177.252 175.999 1.253 17890 9062 1 12 . 1 1 58 58 SER CA C 58 58.737 58.737 57.290 1.447 17890 9063 1 12 . 1 1 58 58 SER CB C 58 64.576 64.576 64.297 0.279 17890 9064 1 12 . 1 1 58 58 SER H H 58 8.328 8.328 8.234 0.094 17890 9065 1 12 . 1 1 59 59 SER N N 59 119.768 119.768 121.785 -2.017 17890 9066 1 12 . 1 1 59 59 SER HA H 59 4.046 4.046 4.089 -0.043 17890 9067 1 12 . 1 1 59 59 SER C C 59 176.671 176.671 175.367 1.304 17890 9068 1 12 . 1 1 59 59 SER CA C 59 61.691 61.691 60.436 1.255 17890 9069 1 12 . 1 1 59 59 SER CB C 59 63.154 63.154 62.890 0.264 17890 9070 1 12 . 1 1 59 59 SER H H 59 9.020 9.020 8.848 0.172 17890 9071 1 12 . 1 1 60 60 GLU N N 60 119.133 119.133 120.333 -1.200 17890 9072 1 12 . 1 1 60 60 GLU HA H 60 4.186 4.186 3.973 0.213 17890 9073 1 12 . 1 1 60 60 GLU C C 60 177.435 177.435 177.496 -0.061 17890 9074 1 12 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.498 1.535 17890 9075 1 12 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.756 -1.530 17890 9076 1 12 . 1 1 60 60 GLU H H 60 8.832 8.832 7.526 1.306 17890 9077 1 12 . 1 1 61 61 GLN N N 61 118.818 118.818 115.581 3.237 17890 9078 1 12 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.140 0.037 17890 9079 1 12 . 1 1 61 61 GLN C C 61 173.254 173.254 175.296 -2.042 17890 9080 1 12 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.855 -0.482 17890 9081 1 12 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.683 -2.760 17890 9082 1 12 . 1 1 61 61 GLN H H 61 7.648 7.648 7.789 -0.141 17890 9083 1 12 . 1 1 62 62 ALA N N 62 122.562 122.562 122.817 -0.255 17890 9084 1 12 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.600 0.464 17890 9085 1 12 . 1 1 62 62 ALA C C 62 176.637 176.637 175.219 1.418 17890 9086 1 12 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.257 -0.078 17890 9087 1 12 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.023 -0.428 17890 9088 1 12 . 1 1 62 62 ALA H H 62 7.315 7.315 7.178 0.137 17890 9089 1 12 . 1 1 63 63 TRP N N 63 124.787 124.787 119.823 4.964 17890 9090 1 12 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.319 -0.355 17890 9091 1 12 . 1 1 63 63 TRP C C 63 174.351 174.351 175.440 -1.089 17890 9092 1 12 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.109 -0.207 17890 9093 1 12 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.755 -1.638 17890 9094 1 12 . 1 1 63 63 TRP H H 63 9.544 9.544 9.002 0.542 17890 9095 1 12 . 1 1 64 64 ILE N N 64 122.482 122.482 119.567 2.915 17890 9096 1 12 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.980 -0.286 17890 9097 1 12 . 1 1 64 64 ILE C C 64 177.078 177.078 174.321 2.757 17890 9098 1 12 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.605 0.426 17890 9099 1 12 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.241 -0.872 17890 9100 1 12 . 1 1 64 64 ILE H H 64 10.235 10.235 9.404 0.831 17890 9101 1 12 . 1 1 65 65 LEU N N 65 132.183 132.183 128.580 3.603 17890 9102 1 12 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.531 -0.066 17890 9103 1 12 . 1 1 65 65 LEU C C 65 177.048 177.048 174.515 2.533 17890 9104 1 12 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.700 0.649 17890 9105 1 12 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.239 -3.895 17890 9106 1 12 . 1 1 65 65 LEU H H 65 9.432 9.432 9.305 0.127 17890 9107 1 12 . 1 1 66 66 ARG N N 66 120.807 120.807 125.696 -4.889 17890 9108 1 12 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.916 -0.028 17890 9109 1 12 . 1 1 66 66 ARG C C 66 175.275 175.275 174.427 0.848 17890 9110 1 12 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.583 0.472 17890 9111 1 12 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.349 -1.358 17890 9112 1 12 . 1 1 66 66 ARG H H 66 8.491 8.491 8.641 -0.150 17890 9113 1 12 . 1 1 67 67 SER N N 67 119.709 119.709 117.951 1.758 17890 9114 1 12 . 1 1 67 67 SER HA H 67 3.186 3.186 3.562 -0.376 17890 9115 1 12 . 1 1 67 67 SER C C 67 174.508 174.508 173.649 0.859 17890 9116 1 12 . 1 1 67 67 SER CA C 67 58.521 58.521 58.631 -0.110 17890 9117 1 12 . 1 1 67 67 SER CB C 67 62.590 62.590 63.233 -0.643 17890 9118 1 12 . 1 1 67 67 SER H H 67 8.557 8.557 8.646 -0.089 17890 9119 1 12 . 1 1 68 68 TYR N N 68 131.011 131.011 127.261 3.750 17890 9120 1 12 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.553 -0.105 17890 9121 1 12 . 1 1 68 68 TYR C C 68 174.687 174.687 174.821 -0.134 17890 9122 1 12 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.009 0.756 17890 9123 1 12 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.850 -1.862 17890 9124 1 12 . 1 1 68 68 TYR H H 68 8.531 8.531 8.657 -0.126 17890 9125 1 12 . 1 1 69 69 ASP N N 69 117.066 117.066 119.770 -2.704 17890 9126 1 12 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.859 -0.234 17890 9127 1 12 . 1 1 69 69 ASP C C 69 176.455 176.455 175.954 0.501 17890 9128 1 12 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.854 -0.763 17890 9129 1 12 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.839 -0.692 17890 9130 1 12 . 1 1 69 69 ASP H H 69 7.122 7.122 7.666 -0.544 17890 9131 1 12 . 1 1 70 70 SER N N 70 122.869 122.869 119.246 3.623 17890 9132 1 12 . 1 1 70 70 SER HA H 70 4.270 4.270 4.003 0.267 17890 9133 1 12 . 1 1 70 70 SER C C 70 177.010 177.010 175.909 1.101 17890 9134 1 12 . 1 1 70 70 SER CA C 70 60.837 60.837 61.272 -0.435 17890 9135 1 12 . 1 1 70 70 SER CB C 70 62.722 62.722 63.292 -0.570 17890 9136 1 12 . 1 1 70 70 SER H H 70 8.757 8.757 8.698 0.059 17890 9137 1 12 . 1 1 71 71 ASN N N 71 119.873 119.873 119.016 0.857 17890 9138 1 12 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.588 -0.017 17890 9139 1 12 . 1 1 71 71 ASN C C 71 176.226 176.226 176.090 0.136 17890 9140 1 12 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.325 0.389 17890 9141 1 12 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.336 0.305 17890 9142 1 12 . 1 1 71 71 ASN H H 71 8.342 8.342 8.439 -0.097 17890 9143 1 12 . 1 1 72 72 SER N N 72 112.202 112.202 113.415 -1.213 17890 9144 1 12 . 1 1 72 72 SER HA H 72 4.567 4.567 4.683 -0.116 17890 9145 1 12 . 1 1 72 72 SER C C 72 173.789 173.789 173.352 0.437 17890 9146 1 12 . 1 1 72 72 SER CA C 72 57.816 57.816 57.235 0.581 17890 9147 1 12 . 1 1 72 72 SER CB C 72 63.935 63.935 63.615 0.320 17890 9148 1 12 . 1 1 72 72 SER H H 72 7.560 7.560 7.888 -0.328 17890 9149 1 12 . 1 1 73 73 ASN N N 73 117.437 117.437 119.239 -1.802 17890 9150 1 12 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.364 0.170 17890 9151 1 12 . 1 1 73 73 ASN C C 73 173.647 173.647 174.231 -0.584 17890 9152 1 12 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.584 -0.061 17890 9153 1 12 . 1 1 73 73 ASN CB C 73 37.213 37.213 36.934 0.279 17890 9154 1 12 . 1 1 73 73 ASN H H 73 7.940 7.940 7.927 0.013 17890 9155 1 12 . 1 1 74 74 THR N N 74 104.227 104.227 109.418 -5.191 17890 9156 1 12 . 1 1 74 74 THR HA H 74 5.477 5.477 4.872 0.605 17890 9157 1 12 . 1 1 74 74 THR C C 74 176.824 176.824 174.046 2.778 17890 9158 1 12 . 1 1 74 74 THR CA C 74 59.768 59.768 61.745 -1.977 17890 9159 1 12 . 1 1 74 74 THR CB C 74 71.985 71.985 70.006 1.979 17890 9160 1 12 . 1 1 74 74 THR H H 74 7.737 7.737 7.784 -0.047 17890 9161 1 12 . 1 1 75 75 TRP N N 75 124.636 124.636 122.770 1.866 17890 9162 1 12 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.414 -0.207 17890 9163 1 12 . 1 1 75 75 TRP C C 75 175.876 175.876 175.915 -0.039 17890 9164 1 12 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.316 1.290 17890 9165 1 12 . 1 1 75 75 TRP CB C 75 33.516 33.516 34.038 -0.522 17890 9166 1 12 . 1 1 75 75 TRP H H 75 9.442 9.442 9.004 0.438 17890 9167 1 12 . 1 1 76 76 THR N N 76 110.544 110.544 114.785 -4.241 17890 9168 1 12 . 1 1 76 76 THR HA H 76 5.129 5.129 4.995 0.134 17890 9169 1 12 . 1 1 76 76 THR C C 76 174.506 174.506 174.217 0.289 17890 9170 1 12 . 1 1 76 76 THR CA C 76 60.561 60.561 61.160 -0.599 17890 9171 1 12 . 1 1 76 76 THR CB C 76 71.688 71.688 70.061 1.627 17890 9172 1 12 . 1 1 76 76 THR H H 76 9.415 9.415 9.411 0.004 17890 9173 1 12 . 1 1 77 77 ILE N N 77 121.567 121.567 124.771 -3.204 17890 9174 1 12 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.066 0.073 17890 9175 1 12 . 1 1 77 77 ILE C C 77 176.148 176.148 174.982 1.166 17890 9176 1 12 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.704 2.004 17890 9177 1 12 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.265 1.722 17890 9178 1 12 . 1 1 77 77 ILE H H 77 9.255 9.255 9.553 -0.298 17890 9179 1 12 . 1 1 78 78 SER N N 78 122.269 122.269 122.566 -0.297 17890 9180 1 12 . 1 1 78 78 SER HA H 78 5.601 5.601 5.368 0.233 17890 9181 1 12 . 1 1 78 78 SER CA C 78 55.835 55.835 55.906 -0.071 17890 9182 1 12 . 1 1 78 78 SER CB C 78 65.858 65.858 66.557 -0.699 17890 9183 1 12 . 1 1 78 78 SER H H 78 9.226 9.226 8.996 0.230 17890 9184 1 12 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.119 -0.255 17890 9185 1 12 . 1 1 79 79 PRO C C 79 178.175 178.175 177.440 0.735 17890 9186 1 12 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.362 0.522 17890 9187 1 12 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.878 -1.606 17890 9188 1 12 . 1 1 80 80 VAL N N 80 121.906 121.906 122.923 -1.017 17890 9189 1 12 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.852 -0.271 17890 9190 1 12 . 1 1 80 80 VAL C C 80 177.751 177.751 176.543 1.208 17890 9191 1 12 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.083 1.984 17890 9192 1 12 . 1 1 80 80 VAL CB C 80 31.485 31.485 32.089 -0.604 17890 9193 1 12 . 1 1 80 80 VAL H H 80 7.328 7.328 8.033 -0.705 17890 9194 1 12 . 1 1 81 81 GLY N N 81 104.643 104.643 107.026 -2.383 17890 9195 1 12 . 1 1 81 81 GLY C C 81 174.979 174.979 174.500 0.479 17890 9196 1 12 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.452 -0.364 17890 9197 1 12 . 1 1 81 81 GLY H H 81 8.949 8.949 8.337 0.612 17890 9198 1 12 . 1 1 82 82 SER N N 82 111.865 111.865 116.170 -4.305 17890 9199 1 12 . 1 1 82 82 SER HA H 82 4.646 4.646 4.888 -0.242 17890 9200 1 12 . 1 1 82 82 SER CA C 82 55.441 55.441 55.857 -0.416 17890 9201 1 12 . 1 1 82 82 SER CB C 82 62.277 62.277 63.801 -1.524 17890 9202 1 12 . 1 1 82 82 SER H H 82 6.968 6.968 7.370 -0.402 17890 9203 1 12 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.544 -0.197 17890 9204 1 12 . 1 1 83 83 PRO C C 83 176.660 176.660 176.522 0.138 17890 9205 1 12 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.498 0.705 17890 9206 1 12 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.832 0.987 17890 9207 1 12 . 1 1 84 84 ASN N N 84 116.542 116.542 114.585 1.957 17890 9208 1 12 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.604 0.397 17890 9209 1 12 . 1 1 84 84 ASN C C 84 175.825 175.825 174.710 1.115 17890 9210 1 12 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.550 -0.659 17890 9211 1 12 . 1 1 84 84 ASN CB C 84 38.744 38.744 37.817 0.927 17890 9212 1 12 . 1 1 84 84 ASN H H 84 8.502 8.502 8.319 0.183 17890 9213 1 12 . 1 1 85 85 SER N N 85 114.633 114.633 112.762 1.871 17890 9214 1 12 . 1 1 85 85 SER HA H 85 4.624 4.624 5.119 -0.495 17890 9215 1 12 . 1 1 85 85 SER C C 85 172.963 172.963 172.642 0.321 17890 9216 1 12 . 1 1 85 85 SER CA C 85 59.210 59.210 57.319 1.891 17890 9217 1 12 . 1 1 85 85 SER CB C 85 64.697 64.697 66.348 -1.651 17890 9218 1 12 . 1 1 85 85 SER H H 85 7.980 7.980 7.597 0.383 17890 9219 1 12 . 1 1 86 86 GLN N N 86 119.016 119.016 120.145 -1.129 17890 9220 1 12 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.537 -0.091 17890 9221 1 12 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.426 0.026 17890 9222 1 12 . 1 1 86 86 GLN CB C 86 34.398 34.398 33.025 1.373 17890 9223 1 12 . 1 1 86 86 GLN H H 86 9.399 9.399 9.184 0.215 17890 9224 1 12 . 1 1 87 87 ILE N N 87 119.691 119.691 125.806 -6.115 17890 9225 1 12 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.133 -0.558 17890 9226 1 12 . 1 1 87 87 ILE C C 87 176.505 176.505 176.776 -0.271 17890 9227 1 12 . 1 1 87 87 ILE CA C 87 63.494 63.494 59.570 3.924 17890 9228 1 12 . 1 1 87 87 ILE CB C 87 38.197 38.197 37.188 1.009 17890 9229 1 12 . 1 1 87 87 ILE H H 87 8.970 8.970 8.782 0.188 17890 9230 1 12 . 1 1 88 88 GLY N N 88 118.378 118.378 114.061 4.317 17890 9231 1 12 . 1 1 88 88 GLY C C 88 171.397 171.397 172.135 -0.738 17890 9232 1 12 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.786 -1.182 17890 9233 1 12 . 1 1 88 88 GLY H H 88 9.752 9.752 9.154 0.598 17890 9234 1 12 . 1 1 89 89 TRP N N 89 122.749 122.749 122.187 0.562 17890 9235 1 12 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.351 -0.753 17890 9236 1 12 . 1 1 89 89 TRP C C 89 175.924 175.924 174.772 1.152 17890 9237 1 12 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.842 0.441 17890 9238 1 12 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.400 -2.314 17890 9239 1 12 . 1 1 89 89 TRP H H 89 8.215 8.215 8.106 0.109 17890 9240 1 12 . 1 1 90 90 GLY N N 90 116.305 116.305 111.194 5.111 17890 9241 1 12 . 1 1 90 90 GLY C C 90 173.725 173.725 172.475 1.250 17890 9242 1 12 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.538 0.517 17890 9243 1 12 . 1 1 90 90 GLY H H 90 8.922 8.922 8.254 0.668 17890 9244 1 12 . 1 1 91 91 ALA N N 91 123.795 123.795 122.088 1.707 17890 9245 1 12 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.159 0.084 17890 9246 1 12 . 1 1 91 91 ALA C C 91 178.510 178.510 178.952 -0.442 17890 9247 1 12 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.425 0.065 17890 9248 1 12 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.823 -0.414 17890 9249 1 12 . 1 1 91 91 ALA H H 91 8.367 8.367 8.159 0.208 17890 9250 1 12 . 1 1 92 92 GLY N N 92 108.871 108.871 112.412 -3.541 17890 9251 1 12 . 1 1 92 92 GLY C C 92 174.528 174.528 174.820 -0.292 17890 9252 1 12 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.777 0.481 17890 9253 1 12 . 1 1 92 92 GLY H H 92 8.776 8.776 8.617 0.159 17890 9254 1 12 . 1 1 93 93 ASN N N 93 114.921 114.921 117.233 -2.312 17890 9255 1 12 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.754 -0.305 17890 9256 1 12 . 1 1 93 93 ASN C C 93 172.774 172.774 174.034 -1.260 17890 9257 1 12 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.382 0.591 17890 9258 1 12 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.958 -0.629 17890 9259 1 12 . 1 1 93 93 ASN H H 93 8.647 8.647 8.261 0.386 17890 9260 1 12 . 1 1 94 94 VAL N N 94 112.437 112.437 112.981 -0.544 17890 9261 1 12 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.611 0.454 17890 9262 1 12 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.347 -1.432 17890 9263 1 12 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.288 -0.133 17890 9264 1 12 . 1 1 94 94 VAL H H 94 6.989 6.989 7.449 -0.460 17890 9265 1 12 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.940 -0.012 17890 9266 1 12 . 1 1 95 95 PRO C C 95 176.041 176.041 176.367 -0.326 17890 9267 1 12 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.447 -1.246 17890 9268 1 12 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.655 -0.930 17890 9269 1 12 . 1 1 96 96 VAL N N 96 113.564 113.564 114.687 -1.123 17890 9270 1 12 . 1 1 96 96 VAL HA H 96 4.735 4.735 5.103 -0.368 17890 9271 1 12 . 1 1 96 96 VAL C C 96 173.656 173.656 174.063 -0.407 17890 9272 1 12 . 1 1 96 96 VAL CA C 96 58.853 58.853 58.669 0.184 17890 9273 1 12 . 1 1 96 96 VAL CB C 96 37.153 37.153 36.011 1.142 17890 9274 1 12 . 1 1 96 96 VAL H H 96 8.199 8.199 8.802 -0.603 17890 9275 1 12 . 1 1 97 97 VAL N N 97 122.328 122.328 120.155 2.173 17890 9276 1 12 . 1 1 97 97 VAL HA H 97 4.631 4.631 5.263 -0.632 17890 9277 1 12 . 1 1 97 97 VAL C C 97 174.776 174.776 173.884 0.892 17890 9278 1 12 . 1 1 97 97 VAL CA C 97 63.657 63.657 59.605 4.052 17890 9279 1 12 . 1 1 97 97 VAL CB C 97 31.128 31.128 34.733 -3.605 17890 9280 1 12 . 1 1 97 97 VAL H H 97 8.957 8.957 7.879 1.078 17890 9281 1 12 . 1 1 98 98 LEU N N 98 130.258 130.258 127.053 3.205 17890 9282 1 12 . 1 1 98 98 LEU HA H 98 5.050 5.050 5.132 -0.082 17890 9283 1 12 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.497 1.326 17890 9284 1 12 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.576 0.542 17890 9285 1 12 . 1 1 98 98 LEU H H 98 9.245 9.245 9.325 -0.080 17890 9286 1 12 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.975 -0.196 17890 9287 1 12 . 1 1 99 99 PRO CA C 99 61.489 61.489 60.668 0.821 17890 9288 1 12 . 1 1 99 99 PRO CB C 99 30.454 30.454 30.905 -0.451 17890 9289 1 12 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.427 -0.442 17890 9290 1 12 . 1 1 100 100 PRO C C 100 177.309 177.309 175.782 1.527 17890 9291 1 12 . 1 1 100 100 PRO CA C 100 63.824 63.824 64.372 -0.548 17890 9292 1 12 . 1 1 100 100 PRO CB C 100 32.105 32.105 31.686 0.418 17890 9293 1 12 . 1 1 101 101 ASN N N 101 119.284 119.284 122.346 -3.062 17890 9294 1 12 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.651 -0.109 17890 9295 1 12 . 1 1 101 101 ASN C C 101 171.920 171.920 174.280 -2.360 17890 9296 1 12 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.605 -0.405 17890 9297 1 12 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.347 -1.722 17890 9298 1 12 . 1 1 101 101 ASN H H 101 7.273 7.273 8.735 -1.462 17890 9299 1 12 . 1 1 102 102 ASN N N 102 115.674 115.674 117.039 -1.365 17890 9300 1 12 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.613 -0.695 17890 9301 1 12 . 1 1 102 102 ASN C C 102 173.264 173.264 174.308 -1.044 17890 9302 1 12 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.746 1.293 17890 9303 1 12 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.610 -1.628 17890 9304 1 12 . 1 1 102 102 ASN H H 102 8.197 8.197 7.695 0.502 17890 9305 1 12 . 1 1 103 103 TYR N N 103 118.775 118.775 120.490 -1.715 17890 9306 1 12 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.423 0.062 17890 9307 1 12 . 1 1 103 103 TYR C C 103 175.248 175.248 174.934 0.314 17890 9308 1 12 . 1 1 103 103 TYR CA C 103 57.490 57.490 58.688 -1.198 17890 9309 1 12 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.340 -0.808 17890 9310 1 12 . 1 1 103 103 TYR H H 103 7.745 7.745 7.001 0.744 17890 9311 1 12 . 1 1 104 104 VAL N N 104 116.205 116.205 114.630 1.575 17890 9312 1 12 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.730 0.247 17890 9313 1 12 . 1 1 104 104 VAL C C 104 174.361 174.361 173.591 0.770 17890 9314 1 12 . 1 1 104 104 VAL CA C 104 58.251 58.251 60.178 -1.927 17890 9315 1 12 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.526 0.017 17890 9316 1 12 . 1 1 104 104 VAL H H 104 7.498 7.498 7.868 -0.370 17890 9317 1 12 . 1 1 105 105 TRP N N 105 119.557 119.557 120.017 -0.460 17890 9318 1 12 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.105 -0.230 17890 9319 1 12 . 1 1 105 105 TRP C C 105 175.526 175.526 176.415 -0.889 17890 9320 1 12 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.518 -0.634 17890 9321 1 12 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.438 0.101 17890 9322 1 12 . 1 1 105 105 TRP H H 105 8.926 8.926 8.895 0.031 17890 9323 1 12 . 1 1 106 106 THR N N 106 120.480 120.480 120.306 0.174 17890 9324 1 12 . 1 1 106 106 THR HA H 106 4.966 4.966 4.916 0.050 17890 9325 1 12 . 1 1 106 106 THR C C 106 174.177 174.177 173.873 0.304 17890 9326 1 12 . 1 1 106 106 THR CA C 106 62.091 62.091 64.177 -2.086 17890 9327 1 12 . 1 1 106 106 THR CB C 106 69.649 69.649 69.260 0.389 17890 9328 1 12 . 1 1 106 106 THR H H 106 9.525 9.525 9.225 0.300 17890 9329 1 12 . 1 1 107 107 LEU N N 107 127.146 127.146 129.083 -1.937 17890 9330 1 12 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.214 -0.387 17890 9331 1 12 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.471 0.237 17890 9332 1 12 . 1 1 107 107 LEU CB C 107 41.523 41.523 44.287 -2.764 17890 9333 1 12 . 1 1 107 107 LEU H H 107 7.591 7.591 8.729 -1.138 17890 9334 1 12 . 1 1 108 108 THR N N 108 119.928 119.928 119.698 0.230 17890 9335 1 12 . 1 1 108 108 THR HA H 108 4.411 4.411 4.724 -0.313 17890 9336 1 12 . 1 1 108 108 THR C C 108 173.319 173.319 173.307 0.012 17890 9337 1 12 . 1 1 108 108 THR CA C 108 62.243 62.243 61.481 0.762 17890 9338 1 12 . 1 1 108 108 THR CB C 108 70.138 70.138 71.362 -1.224 17890 9339 1 12 . 1 1 108 108 THR H H 108 8.141 8.141 8.689 -0.548 17890 9340 1 12 . 1 1 109 109 LEU N N 109 130.557 130.557 127.911 2.646 17890 9341 1 12 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.125 -0.580 17890 9342 1 12 . 1 1 109 109 LEU C C 109 175.217 175.217 177.160 -1.943 17890 9343 1 12 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.432 -0.146 17890 9344 1 12 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.528 -1.922 17890 9345 1 12 . 1 1 109 109 LEU H H 109 8.924 8.924 8.716 0.208 17890 9346 1 12 . 1 1 110 110 THR N N 110 120.160 120.160 112.870 7.290 17890 9347 1 12 . 1 1 110 110 THR HA H 110 4.911 4.911 4.718 0.193 17890 9348 1 12 . 1 1 110 110 THR CA C 110 60.141 60.141 60.422 -0.281 17890 9349 1 12 . 1 1 110 110 THR CB C 110 72.785 72.785 70.451 2.334 17890 9350 1 12 . 1 1 110 110 THR H H 110 7.677 7.677 8.491 -0.814 17890 9351 1 12 . 1 1 111 111 SER HA H 111 4.204 4.204 4.294 -0.090 17890 9352 1 12 . 1 1 111 111 SER C C 111 174.755 174.755 175.239 -0.484 17890 9353 1 12 . 1 1 111 111 SER CA C 111 60.710 60.710 59.412 1.298 17890 9354 1 12 . 1 1 111 111 SER CB C 111 62.660 62.660 62.889 -0.229 17890 9355 1 12 . 1 1 112 112 GLY N N 112 107.313 107.313 108.680 -1.367 17890 9356 1 12 . 1 1 112 112 GLY C C 112 173.023 173.023 172.685 0.338 17890 9357 1 12 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.161 -1.011 17890 9358 1 12 . 1 1 112 112 GLY H H 112 8.249 8.249 7.596 0.653 17890 9359 1 12 . 1 1 113 113 GLY N N 113 105.618 105.618 107.896 -2.278 17890 9360 1 12 . 1 1 113 113 GLY C C 113 175.844 175.844 171.769 4.075 17890 9361 1 12 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.915 -3.156 17890 9362 1 12 . 1 1 113 113 GLY H H 113 7.444 7.444 7.377 0.067 17890 9363 1 12 . 1 1 114 114 TYR N N 114 121.548 121.548 117.401 4.147 17890 9364 1 12 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.430 -0.578 17890 9365 1 12 . 1 1 114 114 TYR C C 114 175.605 175.605 174.188 1.417 17890 9366 1 12 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.840 4.423 17890 9367 1 12 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.737 -4.804 17890 9368 1 12 . 1 1 114 114 TYR H H 114 9.677 9.677 8.972 0.705 17890 9369 1 12 . 1 1 115 115 ASN N N 115 123.274 123.274 117.062 6.212 17890 9370 1 12 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.213 -0.115 17890 9371 1 12 . 1 1 115 115 ASN C C 115 174.355 174.355 173.344 1.011 17890 9372 1 12 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.358 -1.312 17890 9373 1 12 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.832 -2.483 17890 9374 1 12 . 1 1 115 115 ASN H H 115 9.350 9.350 8.962 0.388 17890 9375 1 12 . 1 1 116 116 ILE N N 116 130.611 130.611 122.994 7.617 17890 9376 1 12 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.525 -0.286 17890 9377 1 12 . 1 1 116 116 ILE C C 116 173.998 173.998 173.718 0.280 17890 9378 1 12 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.207 1.992 17890 9379 1 12 . 1 1 116 116 ILE CB C 116 37.100 37.100 38.915 -1.815 17890 9380 1 12 . 1 1 116 116 ILE H H 116 9.473 9.473 8.306 1.167 17890 9381 1 12 . 1 1 117 117 GLN N N 117 121.633 121.633 124.738 -3.105 17890 9382 1 12 . 1 1 117 117 GLN HA H 117 5.935 5.935 4.983 0.952 17890 9383 1 12 . 1 1 117 117 GLN C C 117 177.902 177.902 175.051 2.851 17890 9384 1 12 . 1 1 117 117 GLN CA C 117 53.320 53.320 54.024 -0.704 17890 9385 1 12 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.306 4.151 17890 9386 1 12 . 1 1 117 117 GLN H H 117 8.781 8.781 8.692 0.089 17890 9387 1 12 . 1 1 118 118 ASP N N 118 116.836 116.836 121.905 -5.069 17890 9388 1 12 . 1 1 118 118 ASP HA H 118 4.783 4.783 4.062 0.721 17890 9389 1 12 . 1 1 118 118 ASP C C 118 178.084 178.084 177.175 0.909 17890 9390 1 12 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.635 -1.865 17890 9391 1 12 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.257 -0.889 17890 9392 1 12 . 1 1 118 118 ASP H H 118 9.330 9.330 9.179 0.151 17890 9393 1 12 . 1 1 119 119 GLY N N 119 111.037 111.037 105.327 5.710 17890 9394 1 12 . 1 1 119 119 GLY C C 119 174.196 174.196 175.310 -1.114 17890 9395 1 12 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.014 1.962 17890 9396 1 12 . 1 1 119 119 GLY H H 119 8.986 8.986 8.440 0.546 17890 9397 1 12 . 1 1 120 120 LYS N N 120 114.809 114.809 121.730 -6.921 17890 9398 1 12 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.286 0.063 17890 9399 1 12 . 1 1 120 120 LYS C C 120 175.174 175.174 177.130 -1.956 17890 9400 1 12 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.970 -0.037 17890 9401 1 12 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.110 0.366 17890 9402 1 12 . 1 1 120 120 LYS H H 120 7.045 7.045 7.827 -0.782 17890 9403 1 12 . 1 1 121 121 ARG N N 121 116.291 116.291 113.810 2.481 17890 9404 1 12 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.064 -0.478 17890 9405 1 12 . 1 1 121 121 ARG C C 121 175.097 175.097 176.620 -1.523 17890 9406 1 12 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.912 1.157 17890 9407 1 12 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.690 -0.067 17890 9408 1 12 . 1 1 121 121 ARG H H 121 7.683 7.683 8.496 -0.813 17890 9409 1 12 . 1 1 122 122 THR N N 122 113.730 113.730 109.739 3.991 17890 9410 1 12 . 1 1 122 122 THR HA H 122 4.540 4.540 4.226 0.314 17890 9411 1 12 . 1 1 122 122 THR C C 122 175.302 175.302 174.584 0.718 17890 9412 1 12 . 1 1 122 122 THR CA C 122 62.871 62.871 64.100 -1.229 17890 9413 1 12 . 1 1 122 122 THR CB C 122 71.552 71.552 69.500 2.052 17890 9414 1 12 . 1 1 122 122 THR H H 122 11.059 11.059 8.388 2.671 17890 9415 1 12 . 1 1 123 123 VAL N N 123 118.350 118.350 113.955 4.395 17890 9416 1 12 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.486 0.324 17890 9417 1 12 . 1 1 123 123 VAL C C 123 174.730 174.730 173.790 0.940 17890 9418 1 12 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.643 0.668 17890 9419 1 12 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.841 2.241 17890 9420 1 12 . 1 1 123 123 VAL H H 123 8.181 8.181 7.319 0.862 17890 9421 1 12 . 1 1 124 124 SER N N 124 113.053 113.053 113.892 -0.839 17890 9422 1 12 . 1 1 124 124 SER HA H 124 5.820 5.820 5.129 0.691 17890 9423 1 12 . 1 1 124 124 SER C C 124 175.521 175.521 173.406 2.115 17890 9424 1 12 . 1 1 124 124 SER CA C 124 58.087 58.087 56.712 1.375 17890 9425 1 12 . 1 1 124 124 SER CB C 124 67.405 67.405 65.433 1.972 17890 9426 1 12 . 1 1 124 124 SER H H 124 9.138 9.138 8.605 0.533 17890 9427 1 12 . 1 1 125 125 TRP N N 125 124.900 124.900 123.672 1.228 17890 9428 1 12 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.044 0.566 17890 9429 1 12 . 1 1 125 125 TRP C C 125 178.114 178.114 177.451 0.663 17890 9430 1 12 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.169 -0.695 17890 9431 1 12 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.153 0.870 17890 9432 1 12 . 1 1 125 125 TRP H H 125 8.843 8.843 8.222 0.621 17890 9433 1 12 . 1 1 126 126 SER N N 126 119.243 119.243 114.232 5.011 17890 9434 1 12 . 1 1 126 126 SER HA H 126 5.443 5.443 5.240 0.203 17890 9435 1 12 . 1 1 126 126 SER C C 126 171.668 171.668 172.668 -1.000 17890 9436 1 12 . 1 1 126 126 SER CA C 126 58.696 58.696 57.458 1.238 17890 9437 1 12 . 1 1 126 126 SER CB C 126 66.176 66.176 66.193 -0.017 17890 9438 1 12 . 1 1 126 126 SER H H 126 9.835 9.835 9.277 0.558 17890 9439 1 12 . 1 1 127 127 LEU N N 127 113.708 113.708 118.965 -5.257 17890 9440 1 12 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.742 0.413 17890 9441 1 12 . 1 1 127 127 LEU C C 127 176.563 176.563 177.505 -0.942 17890 9442 1 12 . 1 1 127 127 LEU CA C 127 52.645 52.645 52.837 -0.193 17890 9443 1 12 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.326 -1.630 17890 9444 1 12 . 1 1 127 127 LEU H H 127 6.559 6.559 8.288 -1.729 17890 9445 1 12 . 1 1 128 128 ASN N N 128 121.739 121.739 118.739 3.000 17890 9446 1 12 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.736 -0.047 17890 9447 1 12 . 1 1 128 128 ASN C C 128 175.452 175.452 175.439 0.013 17890 9448 1 12 . 1 1 128 128 ASN CA C 128 56.007 56.007 55.134 0.873 17890 9449 1 12 . 1 1 128 128 ASN CB C 128 39.291 39.291 39.339 -0.048 17890 9450 1 12 . 1 1 128 128 ASN H H 128 8.662 8.662 9.146 -0.484 17890 9451 1 12 . 1 1 129 129 ASN N N 129 119.586 119.586 114.197 5.389 17890 9452 1 12 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.669 0.328 17890 9453 1 12 . 1 1 129 129 ASN C C 129 175.900 175.900 174.445 1.455 17890 9454 1 12 . 1 1 129 129 ASN CA C 129 54.233 54.233 52.608 1.625 17890 9455 1 12 . 1 1 129 129 ASN CB C 129 41.256 41.256 38.158 3.098 17890 9456 1 12 . 1 1 129 129 ASN H H 129 10.962 10.962 8.074 2.888 17890 9457 1 12 . 1 1 130 130 ALA N N 130 128.292 128.292 121.441 6.851 17890 9458 1 12 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.043 -0.473 17890 9459 1 12 . 1 1 130 130 ALA C C 130 172.620 172.620 177.611 -4.991 17890 9460 1 12 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.228 -0.589 17890 9461 1 12 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.035 -0.935 17890 9462 1 12 . 1 1 130 130 ALA H H 130 10.629 10.629 8.272 2.357 17890 9463 1 12 . 1 1 131 131 THR N N 131 105.584 105.584 110.789 -5.205 17890 9464 1 12 . 1 1 131 131 THR HA H 131 4.462 4.462 4.376 0.086 17890 9465 1 12 . 1 1 131 131 THR C C 131 173.552 173.552 174.655 -1.103 17890 9466 1 12 . 1 1 131 131 THR CA C 131 58.338 58.338 60.330 -1.992 17890 9467 1 12 . 1 1 131 131 THR CB C 131 71.569 71.569 70.346 1.223 17890 9468 1 12 . 1 1 131 131 THR H H 131 7.092 7.092 8.169 -1.077 17890 9469 1 12 . 1 1 132 132 ALA N N 132 121.773 121.773 125.122 -3.349 17890 9470 1 12 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.050 -0.301 17890 9471 1 12 . 1 1 132 132 ALA C C 132 178.819 178.819 178.032 0.787 17890 9472 1 12 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.008 1.276 17890 9473 1 12 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.495 -0.268 17890 9474 1 12 . 1 1 132 132 ALA H H 132 8.952 8.952 8.609 0.343 17890 9475 1 12 . 1 1 133 133 GLY N N 133 113.965 113.965 111.102 2.863 17890 9476 1 12 . 1 1 133 133 GLY C C 133 173.453 173.453 174.234 -0.781 17890 9477 1 12 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.932 0.234 17890 9478 1 12 . 1 1 133 133 GLY H H 133 9.016 9.016 8.517 0.499 17890 9479 1 12 . 1 1 134 134 GLU N N 134 123.460 123.460 121.282 2.178 17890 9480 1 12 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.474 -0.516 17890 9481 1 12 . 1 1 134 134 GLU C C 134 176.120 176.120 176.020 0.100 17890 9482 1 12 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.116 2.283 17890 9483 1 12 . 1 1 134 134 GLU CB C 134 31.385 31.385 31.383 0.002 17890 9484 1 12 . 1 1 134 134 GLU H H 134 7.598 7.598 7.618 -0.020 17890 9485 1 12 . 1 1 135 135 GLU N N 135 122.633 122.633 122.924 -0.291 17890 9486 1 12 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.247 0.064 17890 9487 1 12 . 1 1 135 135 GLU C C 135 176.014 176.014 176.539 -0.525 17890 9488 1 12 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.907 -0.725 17890 9489 1 12 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.637 -1.184 17890 9490 1 12 . 1 1 135 135 GLU H H 135 8.258 8.258 8.538 -0.280 17890 9491 1 12 . 1 1 136 136 VAL N N 136 123.635 123.635 124.917 -1.282 17890 9492 1 12 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.960 -0.268 17890 9493 1 12 . 1 1 136 136 VAL C C 136 173.932 173.932 175.696 -1.764 17890 9494 1 12 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.789 0.043 17890 9495 1 12 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.135 -0.271 17890 9496 1 12 . 1 1 136 136 VAL H H 136 7.267 7.267 7.868 -0.601 17890 9497 1 12 . 1 1 137 137 SER N N 137 118.950 118.950 117.088 1.862 17890 9498 1 12 . 1 1 137 137 SER HA H 137 4.887 4.887 4.981 -0.094 17890 9499 1 12 . 1 1 137 137 SER C C 137 173.780 173.780 172.876 0.904 17890 9500 1 12 . 1 1 137 137 SER CA C 137 57.895 57.895 56.203 1.692 17890 9501 1 12 . 1 1 137 137 SER CB C 137 65.027 65.027 65.594 -0.567 17890 9502 1 12 . 1 1 137 137 SER H H 137 8.454 8.454 8.737 -0.283 17890 9503 1 12 . 1 1 138 138 ILE N N 138 123.511 123.511 120.824 2.687 17890 9504 1 12 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.071 -0.823 17890 9505 1 12 . 1 1 138 138 ILE C C 138 176.142 176.142 175.231 0.911 17890 9506 1 12 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.495 1.355 17890 9507 1 12 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.816 -3.221 17890 9508 1 12 . 1 1 138 138 ILE H H 138 7.915 7.915 8.256 -0.341 17890 9509 1 12 . 1 1 139 139 GLY N N 139 115.638 115.638 111.190 4.448 17890 9510 1 12 . 1 1 139 139 GLY C C 139 171.947 171.947 173.303 -1.356 17890 9511 1 12 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.393 1.693 17890 9512 1 12 . 1 1 139 139 GLY H H 139 8.490 8.490 8.396 0.094 17890 9513 1 12 . 1 1 140 140 ALA N N 140 128.563 128.563 121.309 7.254 17890 9514 1 12 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.360 0.036 17890 9515 1 12 . 1 1 140 140 ALA C C 140 177.956 177.956 177.169 0.787 17890 9516 1 12 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.680 -2.034 17890 9517 1 12 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.951 0.253 17890 9518 1 12 . 1 1 140 140 ALA H H 140 8.531 8.531 8.374 0.157 17890 9519 1 12 . 1 1 141 141 ASP N N 141 120.886 120.886 114.533 6.353 17890 9520 1 12 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.562 0.036 17890 9521 1 12 . 1 1 141 141 ASP C C 141 175.411 175.411 174.340 1.071 17890 9522 1 12 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.663 0.253 17890 9523 1 12 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.519 -1.827 17890 9524 1 12 . 1 1 141 141 ASP H H 141 8.507 8.507 7.658 0.849 17890 9525 1 12 . 1 1 142 142 ALA N N 142 125.604 125.604 123.656 1.948 17890 9526 1 12 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.575 -0.058 17890 9527 1 12 . 1 1 142 142 ALA C C 142 177.671 177.671 178.020 -0.349 17890 9528 1 12 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.475 0.518 17890 9529 1 12 . 1 1 142 142 ALA CB C 142 21.535 21.535 20.999 0.536 17890 9530 1 12 . 1 1 142 142 ALA H H 142 7.894 7.894 8.228 -0.334 17890 9531 1 12 . 1 1 143 143 THR N N 143 118.085 118.085 118.314 -0.229 17890 9532 1 12 . 1 1 143 143 THR HA H 143 3.744 3.744 4.104 -0.360 17890 9533 1 12 . 1 1 143 143 THR C C 143 175.464 175.464 174.644 0.820 17890 9534 1 12 . 1 1 143 143 THR CA C 143 64.548 64.548 64.757 -0.210 17890 9535 1 12 . 1 1 143 143 THR CB C 143 69.305 69.305 68.697 0.608 17890 9536 1 12 . 1 1 143 143 THR H H 143 8.268 8.268 8.825 -0.557 17890 9537 1 12 . 1 1 144 144 PHE N N 144 118.635 118.635 117.142 1.493 17890 9538 1 12 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.819 -0.473 17890 9539 1 12 . 1 1 144 144 PHE C C 144 176.209 176.209 175.088 1.121 17890 9540 1 12 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.517 3.945 17890 9541 1 12 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.550 0.054 17890 9542 1 12 . 1 1 144 144 PHE H H 144 8.719 8.719 7.719 1.000 17890 9543 1 12 . 1 1 145 145 SER N N 145 113.446 113.446 114.794 -1.348 17890 9544 1 12 . 1 1 145 145 SER HA H 145 4.866 4.866 4.287 0.579 17890 9545 1 12 . 1 1 145 145 SER C C 145 176.605 176.605 176.010 0.595 17890 9546 1 12 . 1 1 145 145 SER CA C 145 59.432 59.432 57.816 1.616 17890 9547 1 12 . 1 1 145 145 SER CB C 145 62.167 62.167 63.765 -1.598 17890 9548 1 12 . 1 1 145 145 SER H H 145 8.657 8.657 6.912 1.745 17890 9549 1 12 . 1 1 146 146 GLY N N 146 109.277 109.277 112.192 -2.915 17890 9550 1 12 . 1 1 146 146 GLY C C 146 174.293 174.293 173.033 1.260 17890 9551 1 12 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.483 -0.543 17890 9552 1 12 . 1 1 146 146 GLY H H 146 7.467 7.467 7.919 -0.452 17890 9553 1 12 . 1 1 147 147 ARG N N 147 122.863 122.863 118.009 4.854 17890 9554 1 12 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.956 0.485 17890 9555 1 12 . 1 1 147 147 ARG C C 147 173.849 173.849 174.522 -0.673 17890 9556 1 12 . 1 1 147 147 ARG CA C 147 52.227 52.227 53.726 -1.499 17890 9557 1 12 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.307 -0.710 17890 9558 1 12 . 1 1 147 147 ARG H H 147 7.556 7.556 7.301 0.255 17890 9559 1 12 . 1 1 148 148 TRP N N 148 118.465 118.465 120.372 -1.907 17890 9560 1 12 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.177 -0.331 17890 9561 1 12 . 1 1 148 148 TRP C C 148 174.353 174.353 174.485 -0.132 17890 9562 1 12 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.879 -1.217 17890 9563 1 12 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.213 -1.214 17890 9564 1 12 . 1 1 148 148 TRP H H 148 8.709 8.709 9.246 -0.537 17890 9565 1 12 . 1 1 149 149 VAL N N 149 125.852 125.852 118.202 7.650 17890 9566 1 12 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.379 -0.236 17890 9567 1 12 . 1 1 149 149 VAL C C 149 173.613 173.613 174.115 -0.502 17890 9568 1 12 . 1 1 149 149 VAL CA C 149 61.740 61.740 60.978 0.762 17890 9569 1 12 . 1 1 149 149 VAL CB C 149 32.383 32.383 34.840 -2.457 17890 9570 1 12 . 1 1 149 149 VAL H H 149 9.700 9.700 8.789 0.911 17890 9571 1 12 . 1 1 150 150 ILE N N 150 125.140 125.140 125.613 -0.473 17890 9572 1 12 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.006 -0.144 17890 9573 1 12 . 1 1 150 150 ILE C C 150 175.661 175.661 175.099 0.562 17890 9574 1 12 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.384 1.437 17890 9575 1 12 . 1 1 150 150 ILE CB C 150 38.820 38.820 40.287 -1.467 17890 9576 1 12 . 1 1 150 150 ILE H H 150 7.747 7.747 8.046 -0.299 17890 9577 1 12 . 1 1 151 151 GLU N N 151 126.762 126.762 128.113 -1.351 17890 9578 1 12 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.850 0.030 17890 9579 1 12 . 1 1 151 151 GLU C C 151 174.424 174.424 174.739 -0.315 17890 9580 1 12 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.825 0.971 17890 9581 1 12 . 1 1 151 151 GLU CB C 151 34.251 34.251 34.005 0.245 17890 9582 1 12 . 1 1 151 151 GLU H H 151 8.892 8.892 8.827 0.065 17890 9583 1 12 . 1 1 152 152 LYS N N 152 126.299 126.299 122.299 4.000 17890 9584 1 12 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.772 0.089 17890 9585 1 12 . 1 1 152 152 LYS C C 152 176.282 176.282 176.539 -0.257 17890 9586 1 12 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.898 0.607 17890 9587 1 12 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.597 0.739 17890 9588 1 12 . 1 1 152 152 LYS H H 152 8.640 8.640 8.313 0.327 17890 9589 1 13 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.632 -2.338 17890 9590 1 13 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.812 -0.190 17890 9591 1 13 . 1 1 8 8 HIS CA C 8 55.661 55.661 56.666 -1.006 17890 9592 1 13 . 1 1 8 8 HIS CB C 8 29.880 29.880 32.432 -2.552 17890 9593 1 13 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.610 0.036 17890 9594 1 13 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.640 0.044 17890 9595 1 13 . 1 1 9 9 HIS CB C 9 29.831 29.831 31.497 -1.666 17890 9596 1 13 . 1 1 10 10 HIS N N 10 120.811 120.811 116.563 4.248 17890 9597 1 13 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.740 -0.060 17890 9598 1 13 . 1 1 10 10 HIS C C 10 174.875 174.875 172.649 2.226 17890 9599 1 13 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.838 -0.092 17890 9600 1 13 . 1 1 10 10 HIS CB C 10 29.889 29.889 32.359 -2.470 17890 9601 1 13 . 1 1 10 10 HIS H H 10 8.583 8.583 8.153 0.430 17890 9602 1 13 . 1 1 11 11 SER N N 11 118.009 118.009 115.719 2.290 17890 9603 1 13 . 1 1 11 11 SER HA H 11 4.424 4.424 4.608 -0.184 17890 9604 1 13 . 1 1 11 11 SER C C 11 174.962 174.962 173.385 1.577 17890 9605 1 13 . 1 1 11 11 SER CA C 11 58.660 58.660 58.371 0.289 17890 9606 1 13 . 1 1 11 11 SER CB C 11 63.822 63.822 65.114 -1.292 17890 9607 1 13 . 1 1 11 11 SER H H 11 8.438 8.438 7.750 0.688 17890 9608 1 13 . 1 1 12 12 GLY N N 12 111.011 111.011 109.841 1.170 17890 9609 1 13 . 1 1 12 12 GLY C C 12 173.907 173.907 174.209 -0.302 17890 9610 1 13 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.501 -0.080 17890 9611 1 13 . 1 1 12 12 GLY H H 12 8.433 8.433 8.378 0.055 17890 9612 1 13 . 1 1 13 13 ASP N N 13 120.291 120.291 118.852 1.439 17890 9613 1 13 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.812 -0.150 17890 9614 1 13 . 1 1 13 13 ASP C C 13 176.115 176.115 176.203 -0.088 17890 9615 1 13 . 1 1 13 13 ASP CA C 13 54.303 54.303 54.629 -0.326 17890 9616 1 13 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.442 0.023 17890 9617 1 13 . 1 1 13 13 ASP H H 13 8.153 8.153 8.060 0.093 17890 9618 1 13 . 1 1 14 14 SER N N 14 116.987 116.987 112.803 4.184 17890 9619 1 13 . 1 1 14 14 SER HA H 14 4.754 4.754 4.717 0.037 17890 9620 1 13 . 1 1 14 14 SER CA C 14 56.469 56.469 57.899 -1.430 17890 9621 1 13 . 1 1 14 14 SER CB C 14 63.553 63.553 63.448 0.105 17890 9622 1 13 . 1 1 14 14 SER H H 14 8.210 8.210 8.059 0.151 17890 9623 1 13 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.340 0.102 17890 9624 1 13 . 1 1 15 15 PRO C C 15 176.424 176.424 175.776 0.648 17890 9625 1 13 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.618 -0.385 17890 9626 1 13 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.000 0.148 17890 9627 1 13 . 1 1 16 16 ALA N N 16 124.219 124.219 123.994 0.225 17890 9628 1 13 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.534 -0.184 17890 9629 1 13 . 1 1 16 16 ALA C C 16 177.552 177.552 176.383 1.169 17890 9630 1 13 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.056 0.377 17890 9631 1 13 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.381 -0.062 17890 9632 1 13 . 1 1 16 16 ALA H H 16 8.284 8.284 8.248 0.036 17890 9633 1 13 . 1 1 17 17 VAL N N 17 119.504 119.504 117.623 1.881 17890 9634 1 13 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.325 -0.076 17890 9635 1 13 . 1 1 17 17 VAL C C 17 176.322 176.322 175.248 1.074 17890 9636 1 13 . 1 1 17 17 VAL CA C 17 62.278 62.278 63.227 -0.949 17890 9637 1 13 . 1 1 17 17 VAL CB C 17 32.957 32.957 34.537 -1.580 17890 9638 1 13 . 1 1 17 17 VAL H H 17 8.046 8.046 7.667 0.379 17890 9639 1 13 . 1 1 18 18 THR N N 18 118.186 118.186 118.857 -0.671 17890 9640 1 13 . 1 1 18 18 THR HA H 18 4.473 4.473 4.528 -0.055 17890 9641 1 13 . 1 1 18 18 THR C C 18 174.248 174.248 174.940 -0.692 17890 9642 1 13 . 1 1 18 18 THR CA C 18 61.565 61.565 61.958 -0.393 17890 9643 1 13 . 1 1 18 18 THR CB C 18 70.165 70.165 69.071 1.094 17890 9644 1 13 . 1 1 18 18 THR H H 18 8.276 8.276 8.392 -0.116 17890 9645 1 13 . 1 1 19 19 LEU N N 19 125.265 125.265 120.118 5.147 17890 9646 1 13 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.976 0.317 17890 9647 1 13 . 1 1 19 19 LEU C C 19 175.689 175.689 175.370 0.319 17890 9648 1 13 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.620 -0.193 17890 9649 1 13 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.367 1.912 17890 9650 1 13 . 1 1 19 19 LEU H H 19 8.091 8.091 8.333 -0.242 17890 9651 1 13 . 1 1 20 20 SER N N 20 114.622 114.622 114.524 0.098 17890 9652 1 13 . 1 1 20 20 SER HA H 20 4.947 4.947 4.876 0.071 17890 9653 1 13 . 1 1 20 20 SER C C 20 174.220 174.220 173.477 0.743 17890 9654 1 13 . 1 1 20 20 SER CA C 20 56.583 56.583 57.637 -1.054 17890 9655 1 13 . 1 1 20 20 SER CB C 20 65.653 65.653 65.171 0.482 17890 9656 1 13 . 1 1 20 20 SER H H 20 7.316 7.316 7.879 -0.563 17890 9657 1 13 . 1 1 21 21 ALA N N 21 125.517 125.517 123.881 1.636 17890 9658 1 13 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.934 -0.266 17890 9659 1 13 . 1 1 21 21 ALA C C 21 177.960 177.960 178.146 -0.186 17890 9660 1 13 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.561 1.449 17890 9661 1 13 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.441 -0.216 17890 9662 1 13 . 1 1 21 21 ALA H H 21 8.993 8.993 8.605 0.388 17890 9663 1 13 . 1 1 22 22 GLY N N 22 109.543 109.543 111.844 -2.301 17890 9664 1 13 . 1 1 22 22 GLY C C 22 170.422 170.422 171.742 -1.320 17890 9665 1 13 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.416 -0.035 17890 9666 1 13 . 1 1 22 22 GLY H H 22 8.411 8.411 8.998 -0.587 17890 9667 1 13 . 1 1 23 23 ASN N N 23 119.649 119.649 119.256 0.393 17890 9668 1 13 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.601 0.286 17890 9669 1 13 . 1 1 23 23 ASN C C 23 175.207 175.207 174.459 0.748 17890 9670 1 13 . 1 1 23 23 ASN CA C 23 51.821 51.821 53.357 -1.536 17890 9671 1 13 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.867 -1.112 17890 9672 1 13 . 1 1 23 23 ASN H H 23 8.092 8.092 8.458 -0.366 17890 9673 1 13 . 1 1 24 24 TYR N N 24 120.889 120.889 121.994 -1.105 17890 9674 1 13 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.218 0.037 17890 9675 1 13 . 1 1 24 24 TYR C C 24 175.667 175.667 174.345 1.322 17890 9676 1 13 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.120 0.993 17890 9677 1 13 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.650 0.176 17890 9678 1 13 . 1 1 24 24 TYR H H 24 9.914 9.914 8.845 1.069 17890 9679 1 13 . 1 1 25 25 ILE N N 25 115.978 115.978 113.366 2.612 17890 9680 1 13 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.057 0.029 17890 9681 1 13 . 1 1 25 25 ILE C C 25 175.200 175.200 174.139 1.061 17890 9682 1 13 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.622 0.923 17890 9683 1 13 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.961 -0.839 17890 9684 1 13 . 1 1 25 25 ILE H H 25 9.216 9.216 9.291 -0.075 17890 9685 1 13 . 1 1 26 26 ILE N N 26 123.957 123.957 122.219 1.738 17890 9686 1 13 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.250 -0.274 17890 9687 1 13 . 1 1 26 26 ILE C C 26 174.810 174.810 175.011 -0.201 17890 9688 1 13 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.084 0.525 17890 9689 1 13 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.321 0.801 17890 9690 1 13 . 1 1 26 26 ILE H H 26 9.559 9.559 8.965 0.594 17890 9691 1 13 . 1 1 27 27 TYR N N 27 121.371 121.371 123.809 -2.438 17890 9692 1 13 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.602 0.588 17890 9693 1 13 . 1 1 27 27 TYR C C 27 173.963 173.963 173.511 0.452 17890 9694 1 13 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.954 -0.285 17890 9695 1 13 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.012 0.686 17890 9696 1 13 . 1 1 27 27 TYR H H 27 9.378 9.378 9.094 0.284 17890 9697 1 13 . 1 1 28 28 ASN N N 28 121.991 121.991 119.985 2.006 17890 9698 1 13 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.100 -0.332 17890 9699 1 13 . 1 1 28 28 ASN C C 28 174.352 174.352 176.118 -1.766 17890 9700 1 13 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.184 1.936 17890 9701 1 13 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.803 1.643 17890 9702 1 13 . 1 1 28 28 ASN H H 28 8.466 8.466 8.615 -0.149 17890 9703 1 13 . 1 1 29 29 ARG N N 29 121.103 121.103 127.316 -6.213 17890 9704 1 13 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.074 -0.213 17890 9705 1 13 . 1 1 29 29 ARG C C 29 173.635 173.635 177.566 -3.931 17890 9706 1 13 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.400 0.893 17890 9707 1 13 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.261 0.138 17890 9708 1 13 . 1 1 29 29 ARG H H 29 7.756 7.756 8.264 -0.508 17890 9709 1 13 . 1 1 30 30 VAL N N 30 118.412 118.412 116.821 1.591 17890 9710 1 13 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.777 0.167 17890 9711 1 13 . 1 1 30 30 VAL C C 30 176.199 176.199 175.931 0.268 17890 9712 1 13 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.852 -1.275 17890 9713 1 13 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.468 -2.246 17890 9714 1 13 . 1 1 30 30 VAL H H 30 8.976 8.976 7.690 1.286 17890 9715 1 13 . 1 1 31 31 LEU N N 31 125.418 125.418 114.454 10.964 17890 9716 1 13 . 1 1 31 31 LEU HA H 31 4.485 4.485 3.999 0.486 17890 9717 1 13 . 1 1 31 31 LEU C C 31 179.123 179.123 176.096 3.027 17890 9718 1 13 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.277 -1.252 17890 9719 1 13 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.449 4.132 17890 9720 1 13 . 1 1 31 31 LEU H H 31 8.856 8.856 7.418 1.438 17890 9721 1 13 . 1 1 32 32 SER N N 32 116.890 116.890 115.677 1.213 17890 9722 1 13 . 1 1 32 32 SER HA H 32 5.365 5.365 4.651 0.714 17890 9723 1 13 . 1 1 32 32 SER CA C 32 57.269 57.269 56.580 0.689 17890 9724 1 13 . 1 1 32 32 SER CB C 32 62.213 62.213 64.333 -2.120 17890 9725 1 13 . 1 1 32 32 SER H H 32 9.307 9.307 8.101 1.206 17890 9726 1 13 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.318 -0.438 17890 9727 1 13 . 1 1 33 33 PRO C C 33 175.137 175.137 177.394 -2.257 17890 9728 1 13 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.839 0.446 17890 9729 1 13 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.738 0.293 17890 9730 1 13 . 1 1 34 34 ARG N N 34 110.279 110.279 117.484 -7.205 17890 9731 1 13 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.355 0.137 17890 9732 1 13 . 1 1 34 34 ARG C C 34 176.844 176.844 177.143 -0.299 17890 9733 1 13 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.341 -0.905 17890 9734 1 13 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.638 -0.054 17890 9735 1 13 . 1 1 34 34 ARG H H 34 7.257 7.257 7.804 -0.547 17890 9736 1 13 . 1 1 35 35 GLY N N 35 110.288 110.288 107.149 3.139 17890 9737 1 13 . 1 1 35 35 GLY C C 35 173.336 173.336 174.172 -0.836 17890 9738 1 13 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.921 2.109 17890 9739 1 13 . 1 1 35 35 GLY H H 35 8.589 8.589 7.921 0.668 17890 9740 1 13 . 1 1 36 36 GLU N N 36 116.838 116.838 119.783 -2.945 17890 9741 1 13 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.404 -0.056 17890 9742 1 13 . 1 1 36 36 GLU C C 36 176.915 176.915 176.558 0.357 17890 9743 1 13 . 1 1 36 36 GLU CA C 36 54.907 54.907 55.707 -0.800 17890 9744 1 13 . 1 1 36 36 GLU CB C 36 30.415 30.415 30.271 0.144 17890 9745 1 13 . 1 1 36 36 GLU H H 36 7.769 7.769 8.025 -0.256 17890 9746 1 13 . 1 1 37 37 LYS N N 37 123.775 123.775 120.170 3.605 17890 9747 1 13 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.195 0.228 17890 9748 1 13 . 1 1 37 37 LYS C C 37 176.067 176.067 176.228 -0.161 17890 9749 1 13 . 1 1 37 37 LYS CA C 37 56.901 56.901 56.747 0.154 17890 9750 1 13 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.683 0.991 17890 9751 1 13 . 1 1 37 37 LYS H H 37 8.667 8.667 8.668 -0.001 17890 9752 1 13 . 1 1 38 38 LEU N N 38 126.658 126.658 122.339 4.319 17890 9753 1 13 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.825 -0.598 17890 9754 1 13 . 1 1 38 38 LEU C C 38 174.332 174.332 175.669 -1.337 17890 9755 1 13 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.839 -0.496 17890 9756 1 13 . 1 1 38 38 LEU CB C 38 41.651 41.651 41.721 -0.070 17890 9757 1 13 . 1 1 38 38 LEU H H 38 10.455 10.455 8.756 1.699 17890 9758 1 13 . 1 1 39 39 ALA N N 39 127.018 127.018 123.794 3.224 17890 9759 1 13 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.162 0.067 17890 9760 1 13 . 1 1 39 39 ALA C C 39 178.694 178.694 176.564 2.130 17890 9761 1 13 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.742 -0.517 17890 9762 1 13 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.751 0.598 17890 9763 1 13 . 1 1 39 39 ALA H H 39 8.773 8.773 8.914 -0.141 17890 9764 1 13 . 1 1 40 40 LEU N N 40 126.771 126.771 125.152 1.619 17890 9765 1 13 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.514 -0.160 17890 9766 1 13 . 1 1 40 40 LEU C C 40 178.309 178.309 176.517 1.792 17890 9767 1 13 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.058 0.787 17890 9768 1 13 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.782 0.541 17890 9769 1 13 . 1 1 40 40 LEU H H 40 9.665 9.665 8.857 0.808 17890 9770 1 13 . 1 1 41 41 THR N N 41 126.578 126.578 125.839 0.739 17890 9771 1 13 . 1 1 41 41 THR HA H 41 4.916 4.916 5.174 -0.258 17890 9772 1 13 . 1 1 41 41 THR C C 41 172.547 172.547 173.733 -1.186 17890 9773 1 13 . 1 1 41 41 THR CA C 41 63.253 63.253 61.512 1.741 17890 9774 1 13 . 1 1 41 41 THR CB C 41 71.832 71.832 70.085 1.747 17890 9775 1 13 . 1 1 41 41 THR H H 41 9.802 9.802 9.182 0.620 17890 9776 1 13 . 1 1 42 42 TYR N N 42 130.506 130.506 130.035 0.471 17890 9777 1 13 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.612 0.490 17890 9778 1 13 . 1 1 42 42 TYR CA C 42 53.986 53.986 58.228 -4.242 17890 9779 1 13 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.924 0.231 17890 9780 1 13 . 1 1 42 42 TYR H H 42 9.428 9.428 9.073 0.355 17890 9781 1 13 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.398 0.092 17890 9782 1 13 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.180 0.393 17890 9783 1 13 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.776 -0.132 17890 9784 1 13 . 1 1 44 44 GLY N N 44 113.736 113.736 106.494 7.242 17890 9785 1 13 . 1 1 44 44 GLY C C 44 171.790 171.790 173.235 -1.445 17890 9786 1 13 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.039 0.677 17890 9787 1 13 . 1 1 44 44 GLY H H 44 8.337 8.337 7.400 0.937 17890 9788 1 13 . 1 1 45 45 ARG N N 45 113.899 113.899 116.387 -2.488 17890 9789 1 13 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.513 0.063 17890 9790 1 13 . 1 1 45 45 ARG C C 45 175.151 175.151 173.785 1.366 17890 9791 1 13 . 1 1 45 45 ARG CA C 45 54.165 54.165 53.966 0.199 17890 9792 1 13 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.824 1.395 17890 9793 1 13 . 1 1 45 45 ARG H H 45 6.463 6.463 7.265 -0.802 17890 9794 1 13 . 1 1 46 46 GLN N N 46 119.000 119.000 118.591 0.409 17890 9795 1 13 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.447 0.002 17890 9796 1 13 . 1 1 46 46 GLN C C 46 177.282 177.282 176.680 0.602 17890 9797 1 13 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.309 1.304 17890 9798 1 13 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.391 1.105 17890 9799 1 13 . 1 1 46 46 GLN H H 46 8.683 8.683 8.484 0.199 17890 9800 1 13 . 1 1 47 47 ARG N N 47 113.526 113.526 116.814 -3.288 17890 9801 1 13 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.040 -0.510 17890 9802 1 13 . 1 1 47 47 ARG C C 47 174.130 174.130 175.241 -1.111 17890 9803 1 13 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.329 1.487 17890 9804 1 13 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.118 1.952 17890 9805 1 13 . 1 1 47 47 ARG H H 47 9.677 9.677 8.665 1.012 17890 9806 1 13 . 1 1 48 48 THR N N 48 114.672 114.672 114.988 -0.316 17890 9807 1 13 . 1 1 48 48 THR HA H 48 4.938 4.938 4.730 0.208 17890 9808 1 13 . 1 1 48 48 THR CA C 48 59.987 59.987 59.254 0.733 17890 9809 1 13 . 1 1 48 48 THR CB C 48 71.947 71.947 71.150 0.797 17890 9810 1 13 . 1 1 48 48 THR H H 48 8.104 8.104 7.571 0.533 17890 9811 1 13 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.684 -0.316 17890 9812 1 13 . 1 1 49 49 PRO C C 49 175.651 175.651 176.481 -0.830 17890 9813 1 13 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.971 1.210 17890 9814 1 13 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.182 0.514 17890 9815 1 13 . 1 1 50 50 VAL N N 50 122.562 122.562 120.021 2.541 17890 9816 1 13 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.299 -0.352 17890 9817 1 13 . 1 1 50 50 VAL C C 50 174.493 174.493 175.826 -1.333 17890 9818 1 13 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.415 2.396 17890 9819 1 13 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.123 -1.955 17890 9820 1 13 . 1 1 50 50 VAL H H 50 8.123 8.123 8.411 -0.288 17890 9821 1 13 . 1 1 51 51 THR N N 51 113.549 113.549 120.168 -6.619 17890 9822 1 13 . 1 1 51 51 THR HA H 51 5.372 5.372 4.885 0.487 17890 9823 1 13 . 1 1 51 51 THR C C 51 174.841 174.841 172.705 2.136 17890 9824 1 13 . 1 1 51 51 THR CA C 51 59.196 59.196 61.229 -2.033 17890 9825 1 13 . 1 1 51 51 THR CB C 51 72.703 72.703 71.712 0.991 17890 9826 1 13 . 1 1 51 51 THR H H 51 7.057 7.057 8.294 -1.237 17890 9827 1 13 . 1 1 52 52 VAL N N 52 107.374 107.374 121.630 -14.256 17890 9828 1 13 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.098 0.416 17890 9829 1 13 . 1 1 52 52 VAL C C 52 175.697 175.697 173.991 1.706 17890 9830 1 13 . 1 1 52 52 VAL CA C 52 58.472 58.472 60.099 -1.627 17890 9831 1 13 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.106 -0.332 17890 9832 1 13 . 1 1 52 52 VAL H H 52 8.062 8.062 8.678 -0.616 17890 9833 1 13 . 1 1 53 53 SER N N 53 114.662 114.662 123.026 -8.364 17890 9834 1 13 . 1 1 53 53 SER HA H 53 4.690 4.690 4.948 -0.258 17890 9835 1 13 . 1 1 53 53 SER CA C 53 56.828 56.828 55.942 0.886 17890 9836 1 13 . 1 1 53 53 SER CB C 53 64.789 64.789 65.398 -0.609 17890 9837 1 13 . 1 1 53 53 SER H H 53 8.681 8.681 9.113 -0.432 17890 9838 1 13 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.528 0.248 17890 9839 1 13 . 1 1 54 54 PRO C C 54 177.724 177.724 175.910 1.814 17890 9840 1 13 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.259 0.166 17890 9841 1 13 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.238 -0.141 17890 9842 1 13 . 1 1 55 55 LEU N N 55 128.655 128.655 121.521 7.134 17890 9843 1 13 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.554 -0.027 17890 9844 1 13 . 1 1 55 55 LEU C C 55 178.696 178.696 175.858 2.838 17890 9845 1 13 . 1 1 55 55 LEU CA C 55 56.246 56.246 54.331 1.915 17890 9846 1 13 . 1 1 55 55 LEU CB C 55 43.606 43.606 43.467 0.139 17890 9847 1 13 . 1 1 55 55 LEU H H 55 8.675 8.675 8.179 0.496 17890 9848 1 13 . 1 1 56 56 ASP N N 56 126.651 126.651 125.675 0.976 17890 9849 1 13 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.826 -0.117 17890 9850 1 13 . 1 1 56 56 ASP C C 56 177.729 177.729 176.929 0.800 17890 9851 1 13 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.135 -0.512 17890 9852 1 13 . 1 1 56 56 ASP CB C 56 41.632 41.632 43.868 -2.236 17890 9853 1 13 . 1 1 56 56 ASP H H 56 9.683 9.683 9.497 0.186 17890 9854 1 13 . 1 1 57 57 GLY N N 57 109.299 109.299 108.393 0.906 17890 9855 1 13 . 1 1 57 57 GLY C C 57 174.558 174.558 174.739 -0.181 17890 9856 1 13 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.853 1.102 17890 9857 1 13 . 1 1 57 57 GLY H H 57 8.157 8.157 8.368 -0.211 17890 9858 1 13 . 1 1 58 58 SER N N 58 116.740 116.740 116.270 0.470 17890 9859 1 13 . 1 1 58 58 SER HA H 58 4.288 4.288 4.482 -0.194 17890 9860 1 13 . 1 1 58 58 SER C C 58 177.252 177.252 175.889 1.363 17890 9861 1 13 . 1 1 58 58 SER CA C 58 58.737 58.737 57.913 0.824 17890 9862 1 13 . 1 1 58 58 SER CB C 58 64.576 64.576 64.248 0.328 17890 9863 1 13 . 1 1 58 58 SER H H 58 8.328 8.328 7.941 0.387 17890 9864 1 13 . 1 1 59 59 SER N N 59 119.768 119.768 119.269 0.499 17890 9865 1 13 . 1 1 59 59 SER HA H 59 4.046 4.046 4.061 -0.016 17890 9866 1 13 . 1 1 59 59 SER C C 59 176.671 176.671 175.818 0.853 17890 9867 1 13 . 1 1 59 59 SER CA C 59 61.691 61.691 60.505 1.185 17890 9868 1 13 . 1 1 59 59 SER CB C 59 63.154 63.154 62.951 0.203 17890 9869 1 13 . 1 1 59 59 SER H H 59 9.020 9.020 8.866 0.154 17890 9870 1 13 . 1 1 60 60 GLU N N 60 119.133 119.133 119.999 -0.866 17890 9871 1 13 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.058 0.129 17890 9872 1 13 . 1 1 60 60 GLU C C 60 177.435 177.435 178.247 -0.812 17890 9873 1 13 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.353 1.680 17890 9874 1 13 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.378 -1.152 17890 9875 1 13 . 1 1 60 60 GLU H H 60 8.832 8.832 8.533 0.299 17890 9876 1 13 . 1 1 61 61 GLN N N 61 118.818 118.818 116.927 1.891 17890 9877 1 13 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.999 0.178 17890 9878 1 13 . 1 1 61 61 GLN C C 61 173.254 173.254 175.683 -2.429 17890 9879 1 13 . 1 1 61 61 GLN CA C 61 54.373 54.373 55.700 -1.327 17890 9880 1 13 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.269 -2.347 17890 9881 1 13 . 1 1 61 61 GLN H H 61 7.648 7.648 7.819 -0.171 17890 9882 1 13 . 1 1 62 62 ALA N N 62 122.562 122.562 122.186 0.376 17890 9883 1 13 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.565 0.499 17890 9884 1 13 . 1 1 62 62 ALA C C 62 176.637 176.637 175.112 1.525 17890 9885 1 13 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.176 0.003 17890 9886 1 13 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.079 -0.485 17890 9887 1 13 . 1 1 62 62 ALA H H 62 7.315 7.315 7.102 0.213 17890 9888 1 13 . 1 1 63 63 TRP N N 63 124.787 124.787 120.380 4.407 17890 9889 1 13 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.389 -0.425 17890 9890 1 13 . 1 1 63 63 TRP C C 63 174.351 174.351 175.447 -1.096 17890 9891 1 13 . 1 1 63 63 TRP CA C 63 55.902 55.902 55.994 -0.092 17890 9892 1 13 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.817 -1.700 17890 9893 1 13 . 1 1 63 63 TRP H H 63 9.544 9.544 8.981 0.563 17890 9894 1 13 . 1 1 64 64 ILE N N 64 122.482 122.482 119.165 3.317 17890 9895 1 13 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.966 -0.272 17890 9896 1 13 . 1 1 64 64 ILE C C 64 177.078 177.078 174.206 2.872 17890 9897 1 13 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.558 0.473 17890 9898 1 13 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.578 -1.209 17890 9899 1 13 . 1 1 64 64 ILE H H 64 10.235 10.235 9.307 0.928 17890 9900 1 13 . 1 1 65 65 LEU N N 65 132.183 132.183 128.542 3.641 17890 9901 1 13 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.501 -0.036 17890 9902 1 13 . 1 1 65 65 LEU C C 65 177.048 177.048 174.470 2.578 17890 9903 1 13 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.777 0.572 17890 9904 1 13 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.192 -3.848 17890 9905 1 13 . 1 1 65 65 LEU H H 65 9.432 9.432 9.231 0.201 17890 9906 1 13 . 1 1 66 66 ARG N N 66 120.807 120.807 125.801 -4.994 17890 9907 1 13 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.926 -0.038 17890 9908 1 13 . 1 1 66 66 ARG C C 66 175.275 175.275 174.476 0.799 17890 9909 1 13 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.450 0.605 17890 9910 1 13 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.390 -1.399 17890 9911 1 13 . 1 1 66 66 ARG H H 66 8.491 8.491 8.557 -0.066 17890 9912 1 13 . 1 1 67 67 SER N N 67 119.709 119.709 117.666 2.043 17890 9913 1 13 . 1 1 67 67 SER HA H 67 3.186 3.186 3.451 -0.265 17890 9914 1 13 . 1 1 67 67 SER C C 67 174.508 174.508 173.564 0.944 17890 9915 1 13 . 1 1 67 67 SER CA C 67 58.521 58.521 58.985 -0.464 17890 9916 1 13 . 1 1 67 67 SER CB C 67 62.590 62.590 63.244 -0.654 17890 9917 1 13 . 1 1 67 67 SER H H 67 8.557 8.557 8.688 -0.131 17890 9918 1 13 . 1 1 68 68 TYR N N 68 131.011 131.011 127.327 3.684 17890 9919 1 13 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.651 -0.203 17890 9920 1 13 . 1 1 68 68 TYR C C 68 174.687 174.687 174.762 -0.075 17890 9921 1 13 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.722 1.043 17890 9922 1 13 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.006 -2.018 17890 9923 1 13 . 1 1 68 68 TYR H H 68 8.531 8.531 8.606 -0.075 17890 9924 1 13 . 1 1 69 69 ASP N N 69 117.066 117.066 119.974 -2.908 17890 9925 1 13 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.839 -0.214 17890 9926 1 13 . 1 1 69 69 ASP C C 69 176.455 176.455 176.287 0.168 17890 9927 1 13 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.956 -0.865 17890 9928 1 13 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.974 -0.827 17890 9929 1 13 . 1 1 69 69 ASP H H 69 7.122 7.122 7.630 -0.508 17890 9930 1 13 . 1 1 70 70 SER N N 70 122.869 122.869 120.211 2.658 17890 9931 1 13 . 1 1 70 70 SER HA H 70 4.270 4.270 4.084 0.186 17890 9932 1 13 . 1 1 70 70 SER C C 70 177.010 177.010 176.086 0.924 17890 9933 1 13 . 1 1 70 70 SER CA C 70 60.837 60.837 61.331 -0.494 17890 9934 1 13 . 1 1 70 70 SER CB C 70 62.722 62.722 63.254 -0.532 17890 9935 1 13 . 1 1 70 70 SER H H 70 8.757 8.757 8.799 -0.042 17890 9936 1 13 . 1 1 71 71 ASN N N 71 119.873 119.873 119.182 0.691 17890 9937 1 13 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.585 -0.014 17890 9938 1 13 . 1 1 71 71 ASN C C 71 176.226 176.226 175.930 0.296 17890 9939 1 13 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.384 0.330 17890 9940 1 13 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.486 0.155 17890 9941 1 13 . 1 1 71 71 ASN H H 71 8.342 8.342 8.666 -0.324 17890 9942 1 13 . 1 1 72 72 SER N N 72 112.202 112.202 112.793 -0.591 17890 9943 1 13 . 1 1 72 72 SER HA H 72 4.567 4.567 4.614 -0.047 17890 9944 1 13 . 1 1 72 72 SER C C 72 173.789 173.789 173.772 0.017 17890 9945 1 13 . 1 1 72 72 SER CA C 72 57.816 57.816 58.011 -0.195 17890 9946 1 13 . 1 1 72 72 SER CB C 72 63.935 63.935 64.689 -0.754 17890 9947 1 13 . 1 1 72 72 SER H H 72 7.560 7.560 7.802 -0.242 17890 9948 1 13 . 1 1 73 73 ASN N N 73 117.437 117.437 117.894 -0.457 17890 9949 1 13 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.422 0.112 17890 9950 1 13 . 1 1 73 73 ASN C C 73 173.647 173.647 173.992 -0.345 17890 9951 1 13 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.400 0.123 17890 9952 1 13 . 1 1 73 73 ASN CB C 73 37.213 37.213 36.949 0.264 17890 9953 1 13 . 1 1 73 73 ASN H H 73 7.940 7.940 8.118 -0.178 17890 9954 1 13 . 1 1 74 74 THR N N 74 104.227 104.227 109.008 -4.781 17890 9955 1 13 . 1 1 74 74 THR HA H 74 5.477 5.477 4.971 0.506 17890 9956 1 13 . 1 1 74 74 THR C C 74 176.824 176.824 173.730 3.094 17890 9957 1 13 . 1 1 74 74 THR CA C 74 59.768 59.768 61.480 -1.712 17890 9958 1 13 . 1 1 74 74 THR CB C 74 71.985 71.985 69.897 2.088 17890 9959 1 13 . 1 1 74 74 THR H H 74 7.737 7.737 7.727 0.010 17890 9960 1 13 . 1 1 75 75 TRP N N 75 124.636 124.636 122.873 1.763 17890 9961 1 13 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.320 -0.113 17890 9962 1 13 . 1 1 75 75 TRP C C 75 175.876 175.876 176.170 -0.294 17890 9963 1 13 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.249 1.357 17890 9964 1 13 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.590 -0.074 17890 9965 1 13 . 1 1 75 75 TRP H H 75 9.442 9.442 9.138 0.304 17890 9966 1 13 . 1 1 76 76 THR N N 76 110.544 110.544 114.959 -4.415 17890 9967 1 13 . 1 1 76 76 THR HA H 76 5.129 5.129 5.106 0.023 17890 9968 1 13 . 1 1 76 76 THR C C 76 174.506 174.506 174.604 -0.098 17890 9969 1 13 . 1 1 76 76 THR CA C 76 60.561 60.561 61.407 -0.846 17890 9970 1 13 . 1 1 76 76 THR CB C 76 71.688 71.688 69.965 1.723 17890 9971 1 13 . 1 1 76 76 THR H H 76 9.415 9.415 9.356 0.059 17890 9972 1 13 . 1 1 77 77 ILE N N 77 121.567 121.567 124.119 -2.552 17890 9973 1 13 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.213 -0.074 17890 9974 1 13 . 1 1 77 77 ILE C C 77 176.148 176.148 175.190 0.958 17890 9975 1 13 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.705 2.003 17890 9976 1 13 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.771 1.216 17890 9977 1 13 . 1 1 77 77 ILE H H 77 9.255 9.255 8.160 1.095 17890 9978 1 13 . 1 1 78 78 SER N N 78 122.269 122.269 121.753 0.516 17890 9979 1 13 . 1 1 78 78 SER HA H 78 5.601 5.601 5.251 0.350 17890 9980 1 13 . 1 1 78 78 SER CA C 78 55.835 55.835 55.799 0.036 17890 9981 1 13 . 1 1 78 78 SER CB C 78 65.858 65.858 66.261 -0.403 17890 9982 1 13 . 1 1 78 78 SER H H 78 9.226 9.226 8.671 0.555 17890 9983 1 13 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.099 -0.235 17890 9984 1 13 . 1 1 79 79 PRO C C 79 178.175 178.175 176.516 1.659 17890 9985 1 13 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.318 0.566 17890 9986 1 13 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.874 -1.602 17890 9987 1 13 . 1 1 80 80 VAL N N 80 121.906 121.906 121.331 0.575 17890 9988 1 13 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.663 -0.082 17890 9989 1 13 . 1 1 80 80 VAL C C 80 177.751 177.751 177.532 0.219 17890 9990 1 13 . 1 1 80 80 VAL CA C 80 66.067 66.067 65.198 0.869 17890 9991 1 13 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.298 0.187 17890 9992 1 13 . 1 1 80 80 VAL H H 80 7.328 7.328 8.146 -0.818 17890 9993 1 13 . 1 1 81 81 GLY N N 81 104.643 104.643 106.163 -1.520 17890 9994 1 13 . 1 1 81 81 GLY C C 81 174.979 174.979 174.738 0.241 17890 9995 1 13 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.558 -0.470 17890 9996 1 13 . 1 1 81 81 GLY H H 81 8.949 8.949 7.710 1.239 17890 9997 1 13 . 1 1 82 82 SER N N 82 111.865 111.865 115.269 -3.404 17890 9998 1 13 . 1 1 82 82 SER HA H 82 4.646 4.646 4.906 -0.260 17890 9999 1 13 . 1 1 82 82 SER CA C 82 55.441 55.441 56.659 -1.218 17890 10000 1 13 . 1 1 82 82 SER CB C 82 62.277 62.277 64.053 -1.776 17890 10001 1 13 . 1 1 82 82 SER H H 82 6.968 6.968 7.156 -0.188 17890 10002 1 13 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.628 -0.281 17890 10003 1 13 . 1 1 83 83 PRO C C 83 176.660 176.660 176.994 -0.334 17890 10004 1 13 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.611 0.592 17890 10005 1 13 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.918 0.901 17890 10006 1 13 . 1 1 84 84 ASN N N 84 116.542 116.542 113.678 2.864 17890 10007 1 13 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.536 0.465 17890 10008 1 13 . 1 1 84 84 ASN C C 84 175.825 175.825 175.313 0.512 17890 10009 1 13 . 1 1 84 84 ASN CA C 84 52.891 52.891 54.080 -1.189 17890 10010 1 13 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.158 0.586 17890 10011 1 13 . 1 1 84 84 ASN H H 84 8.502 8.502 8.343 0.159 17890 10012 1 13 . 1 1 85 85 SER N N 85 114.633 114.633 113.728 0.905 17890 10013 1 13 . 1 1 85 85 SER HA H 85 4.624 4.624 4.791 -0.167 17890 10014 1 13 . 1 1 85 85 SER C C 85 172.963 172.963 172.219 0.744 17890 10015 1 13 . 1 1 85 85 SER CA C 85 59.210 59.210 57.825 1.385 17890 10016 1 13 . 1 1 85 85 SER CB C 85 64.697 64.697 66.217 -1.520 17890 10017 1 13 . 1 1 85 85 SER H H 85 7.980 7.980 7.738 0.242 17890 10018 1 13 . 1 1 86 86 GLN N N 86 119.016 119.016 117.480 1.536 17890 10019 1 13 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.195 0.251 17890 10020 1 13 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.373 0.078 17890 10021 1 13 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.057 0.341 17890 10022 1 13 . 1 1 86 86 GLN H H 86 9.399 9.399 9.044 0.355 17890 10023 1 13 . 1 1 87 87 ILE N N 87 119.691 119.691 119.333 0.358 17890 10024 1 13 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.144 -0.569 17890 10025 1 13 . 1 1 87 87 ILE C C 87 176.505 176.505 176.123 0.382 17890 10026 1 13 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.949 4.545 17890 10027 1 13 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.588 -0.391 17890 10028 1 13 . 1 1 87 87 ILE H H 87 8.970 8.970 8.261 0.709 17890 10029 1 13 . 1 1 88 88 GLY N N 88 118.378 118.378 114.811 3.567 17890 10030 1 13 . 1 1 88 88 GLY C C 88 171.397 171.397 171.669 -0.272 17890 10031 1 13 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.959 -1.355 17890 10032 1 13 . 1 1 88 88 GLY H H 88 9.752 9.752 9.073 0.679 17890 10033 1 13 . 1 1 89 89 TRP N N 89 122.749 122.749 122.296 0.453 17890 10034 1 13 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.379 -0.781 17890 10035 1 13 . 1 1 89 89 TRP C C 89 175.924 175.924 174.978 0.946 17890 10036 1 13 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.442 -0.159 17890 10037 1 13 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.737 -2.651 17890 10038 1 13 . 1 1 89 89 TRP H H 89 8.215 8.215 8.441 -0.226 17890 10039 1 13 . 1 1 90 90 GLY N N 90 116.305 116.305 110.908 5.397 17890 10040 1 13 . 1 1 90 90 GLY C C 90 173.725 173.725 172.944 0.781 17890 10041 1 13 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.585 0.470 17890 10042 1 13 . 1 1 90 90 GLY H H 90 8.922 8.922 8.149 0.773 17890 10043 1 13 . 1 1 91 91 ALA N N 91 123.795 123.795 122.142 1.653 17890 10044 1 13 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.159 0.084 17890 10045 1 13 . 1 1 91 91 ALA C C 91 178.510 178.510 178.934 -0.424 17890 10046 1 13 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.492 -0.002 17890 10047 1 13 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.749 -0.340 17890 10048 1 13 . 1 1 91 91 ALA H H 91 8.367 8.367 8.179 0.188 17890 10049 1 13 . 1 1 92 92 GLY N N 92 108.871 108.871 113.068 -4.197 17890 10050 1 13 . 1 1 92 92 GLY C C 92 174.528 174.528 174.812 -0.284 17890 10051 1 13 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.693 0.565 17890 10052 1 13 . 1 1 92 92 GLY H H 92 8.776 8.776 8.609 0.167 17890 10053 1 13 . 1 1 93 93 ASN N N 93 114.921 114.921 117.969 -3.048 17890 10054 1 13 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.766 -0.317 17890 10055 1 13 . 1 1 93 93 ASN C C 93 172.774 172.774 173.986 -1.212 17890 10056 1 13 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.567 0.406 17890 10057 1 13 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.671 -0.342 17890 10058 1 13 . 1 1 93 93 ASN H H 93 8.647 8.647 8.322 0.325 17890 10059 1 13 . 1 1 94 94 VAL N N 94 112.437 112.437 111.901 0.536 17890 10060 1 13 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.706 0.359 17890 10061 1 13 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.156 -1.241 17890 10062 1 13 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.712 -0.557 17890 10063 1 13 . 1 1 94 94 VAL H H 94 6.989 6.989 7.414 -0.425 17890 10064 1 13 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.971 -0.043 17890 10065 1 13 . 1 1 95 95 PRO C C 95 176.041 176.041 176.357 -0.316 17890 10066 1 13 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.538 -1.337 17890 10067 1 13 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.554 -0.829 17890 10068 1 13 . 1 1 96 96 VAL N N 96 113.564 113.564 115.685 -2.121 17890 10069 1 13 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.943 -0.208 17890 10070 1 13 . 1 1 96 96 VAL C C 96 173.656 173.656 174.842 -1.186 17890 10071 1 13 . 1 1 96 96 VAL CA C 96 58.853 58.853 58.937 -0.084 17890 10072 1 13 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.867 1.286 17890 10073 1 13 . 1 1 96 96 VAL H H 96 8.199 8.199 8.846 -0.647 17890 10074 1 13 . 1 1 97 97 VAL N N 97 122.328 122.328 122.063 0.265 17890 10075 1 13 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.662 -0.031 17890 10076 1 13 . 1 1 97 97 VAL C C 97 174.776 174.776 175.551 -0.775 17890 10077 1 13 . 1 1 97 97 VAL CA C 97 63.657 63.657 62.575 1.082 17890 10078 1 13 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.267 -0.139 17890 10079 1 13 . 1 1 97 97 VAL H H 97 8.957 8.957 8.345 0.612 17890 10080 1 13 . 1 1 98 98 LEU N N 98 130.258 130.258 126.766 3.492 17890 10081 1 13 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.905 0.145 17890 10082 1 13 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.626 1.197 17890 10083 1 13 . 1 1 98 98 LEU CB C 98 46.118 46.118 44.694 1.424 17890 10084 1 13 . 1 1 98 98 LEU H H 98 9.245 9.245 9.143 0.102 17890 10085 1 13 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.727 0.052 17890 10086 1 13 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.370 0.119 17890 10087 1 13 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.012 -0.558 17890 10088 1 13 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.662 -0.677 17890 10089 1 13 . 1 1 100 100 PRO C C 100 177.309 177.309 175.906 1.403 17890 10090 1 13 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.376 0.448 17890 10091 1 13 . 1 1 100 100 PRO CB C 100 32.105 32.105 31.223 0.882 17890 10092 1 13 . 1 1 101 101 ASN N N 101 119.284 119.284 123.943 -4.659 17890 10093 1 13 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.657 -0.115 17890 10094 1 13 . 1 1 101 101 ASN C C 101 171.920 171.920 174.124 -2.204 17890 10095 1 13 . 1 1 101 101 ASN CA C 101 53.200 53.200 52.609 0.591 17890 10096 1 13 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.794 -2.169 17890 10097 1 13 . 1 1 101 101 ASN H H 101 7.273 7.273 8.485 -1.212 17890 10098 1 13 . 1 1 102 102 ASN N N 102 115.674 115.674 115.815 -0.141 17890 10099 1 13 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.414 -0.496 17890 10100 1 13 . 1 1 102 102 ASN C C 102 173.264 173.264 174.215 -0.951 17890 10101 1 13 . 1 1 102 102 ASN CA C 102 54.039 54.039 54.204 -0.165 17890 10102 1 13 . 1 1 102 102 ASN CB C 102 36.982 36.982 36.131 0.851 17890 10103 1 13 . 1 1 102 102 ASN H H 102 8.197 8.197 8.782 -0.585 17890 10104 1 13 . 1 1 103 103 TYR N N 103 118.775 118.775 117.845 0.930 17890 10105 1 13 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.211 0.274 17890 10106 1 13 . 1 1 103 103 TYR C C 103 175.248 175.248 175.000 0.248 17890 10107 1 13 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.910 -2.420 17890 10108 1 13 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.944 -1.412 17890 10109 1 13 . 1 1 103 103 TYR H H 103 7.745 7.745 7.565 0.180 17890 10110 1 13 . 1 1 104 104 VAL N N 104 116.205 116.205 114.695 1.510 17890 10111 1 13 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.913 0.064 17890 10112 1 13 . 1 1 104 104 VAL C C 104 174.361 174.361 173.708 0.653 17890 10113 1 13 . 1 1 104 104 VAL CA C 104 58.251 58.251 60.037 -1.786 17890 10114 1 13 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.471 0.072 17890 10115 1 13 . 1 1 104 104 VAL H H 104 7.498 7.498 8.017 -0.519 17890 10116 1 13 . 1 1 105 105 TRP N N 105 119.557 119.557 120.652 -1.095 17890 10117 1 13 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.129 -0.254 17890 10118 1 13 . 1 1 105 105 TRP C C 105 175.526 175.526 176.425 -0.899 17890 10119 1 13 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.239 -0.355 17890 10120 1 13 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.522 0.017 17890 10121 1 13 . 1 1 105 105 TRP H H 105 8.926 8.926 9.107 -0.181 17890 10122 1 13 . 1 1 106 106 THR N N 106 120.480 120.480 119.635 0.845 17890 10123 1 13 . 1 1 106 106 THR HA H 106 4.966 4.966 4.809 0.157 17890 10124 1 13 . 1 1 106 106 THR C C 106 174.177 174.177 174.489 -0.312 17890 10125 1 13 . 1 1 106 106 THR CA C 106 62.091 62.091 64.465 -2.373 17890 10126 1 13 . 1 1 106 106 THR CB C 106 69.649 69.649 69.150 0.499 17890 10127 1 13 . 1 1 106 106 THR H H 106 9.525 9.525 9.158 0.367 17890 10128 1 13 . 1 1 107 107 LEU N N 107 127.146 127.146 129.997 -2.851 17890 10129 1 13 . 1 1 107 107 LEU HA H 107 4.827 4.827 4.970 -0.143 17890 10130 1 13 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.538 0.172 17890 10131 1 13 . 1 1 107 107 LEU CB C 107 41.523 41.523 41.508 0.015 17890 10132 1 13 . 1 1 107 107 LEU H H 107 7.591 7.591 8.625 -1.034 17890 10133 1 13 . 1 1 108 108 THR N N 108 119.928 119.928 119.600 0.328 17890 10134 1 13 . 1 1 108 108 THR HA H 108 4.411 4.411 4.379 0.032 17890 10135 1 13 . 1 1 108 108 THR C C 108 173.319 173.319 173.569 -0.250 17890 10136 1 13 . 1 1 108 108 THR CA C 108 62.243 62.243 63.022 -0.779 17890 10137 1 13 . 1 1 108 108 THR CB C 108 70.138 70.138 69.700 0.438 17890 10138 1 13 . 1 1 108 108 THR H H 108 8.141 8.141 8.127 0.014 17890 10139 1 13 . 1 1 109 109 LEU N N 109 130.557 130.557 128.277 2.280 17890 10140 1 13 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.959 -0.414 17890 10141 1 13 . 1 1 109 109 LEU C C 109 175.217 175.217 176.698 -1.481 17890 10142 1 13 . 1 1 109 109 LEU CA C 109 55.286 55.286 54.996 0.290 17890 10143 1 13 . 1 1 109 109 LEU CB C 109 40.606 40.606 43.087 -2.481 17890 10144 1 13 . 1 1 109 109 LEU H H 109 8.924 8.924 8.667 0.257 17890 10145 1 13 . 1 1 110 110 THR N N 110 120.160 120.160 114.018 6.142 17890 10146 1 13 . 1 1 110 110 THR HA H 110 4.911 4.911 4.630 0.281 17890 10147 1 13 . 1 1 110 110 THR CA C 110 60.141 60.141 59.338 0.803 17890 10148 1 13 . 1 1 110 110 THR CB C 110 72.785 72.785 71.152 1.633 17890 10149 1 13 . 1 1 110 110 THR H H 110 7.677 7.677 8.236 -0.559 17890 10150 1 13 . 1 1 111 111 SER HA H 111 4.204 4.204 4.276 -0.072 17890 10151 1 13 . 1 1 111 111 SER C C 111 174.755 174.755 175.317 -0.562 17890 10152 1 13 . 1 1 111 111 SER CA C 111 60.710 60.710 59.457 1.253 17890 10153 1 13 . 1 1 111 111 SER CB C 111 62.660 62.660 63.248 -0.588 17890 10154 1 13 . 1 1 112 112 GLY N N 112 107.313 107.313 106.852 0.461 17890 10155 1 13 . 1 1 112 112 GLY C C 112 173.023 173.023 173.129 -0.106 17890 10156 1 13 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.009 -0.859 17890 10157 1 13 . 1 1 112 112 GLY H H 112 8.249 8.249 7.399 0.850 17890 10158 1 13 . 1 1 113 113 GLY N N 113 105.618 105.618 107.812 -2.194 17890 10159 1 13 . 1 1 113 113 GLY C C 113 175.844 175.844 171.775 4.069 17890 10160 1 13 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.936 -3.177 17890 10161 1 13 . 1 1 113 113 GLY H H 113 7.444 7.444 7.333 0.111 17890 10162 1 13 . 1 1 114 114 TYR N N 114 121.548 121.548 118.272 3.276 17890 10163 1 13 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.468 -0.616 17890 10164 1 13 . 1 1 114 114 TYR C C 114 175.605 175.605 174.239 1.366 17890 10165 1 13 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.442 4.821 17890 10166 1 13 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.527 -4.594 17890 10167 1 13 . 1 1 114 114 TYR H H 114 9.677 9.677 8.952 0.725 17890 10168 1 13 . 1 1 115 115 ASN N N 115 123.274 123.274 118.049 5.225 17890 10169 1 13 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.263 -0.165 17890 10170 1 13 . 1 1 115 115 ASN C C 115 174.355 174.355 173.146 1.209 17890 10171 1 13 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.370 -1.324 17890 10172 1 13 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.754 -2.405 17890 10173 1 13 . 1 1 115 115 ASN H H 115 9.350 9.350 9.092 0.258 17890 10174 1 13 . 1 1 116 116 ILE N N 116 130.611 130.611 123.515 7.096 17890 10175 1 13 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.866 -0.627 17890 10176 1 13 . 1 1 116 116 ILE C C 116 173.998 173.998 174.148 -0.150 17890 10177 1 13 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.796 2.403 17890 10178 1 13 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.430 -2.330 17890 10179 1 13 . 1 1 116 116 ILE H H 116 9.473 9.473 8.553 0.920 17890 10180 1 13 . 1 1 117 117 GLN N N 117 121.633 121.633 125.423 -3.790 17890 10181 1 13 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.188 0.747 17890 10182 1 13 . 1 1 117 117 GLN C C 117 177.902 177.902 176.306 1.596 17890 10183 1 13 . 1 1 117 117 GLN CA C 117 53.320 53.320 54.097 -0.777 17890 10184 1 13 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.692 3.765 17890 10185 1 13 . 1 1 117 117 GLN H H 117 8.781 8.781 8.552 0.229 17890 10186 1 13 . 1 1 118 118 ASP N N 118 116.836 116.836 120.385 -3.549 17890 10187 1 13 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.882 0.901 17890 10188 1 13 . 1 1 118 118 ASP C C 118 178.084 178.084 176.601 1.483 17890 10189 1 13 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.307 -1.537 17890 10190 1 13 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.109 -0.741 17890 10191 1 13 . 1 1 118 118 ASP H H 118 9.330 9.330 8.475 0.855 17890 10192 1 13 . 1 1 119 119 GLY N N 119 111.037 111.037 107.472 3.565 17890 10193 1 13 . 1 1 119 119 GLY C C 119 174.196 174.196 175.170 -0.974 17890 10194 1 13 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.068 1.908 17890 10195 1 13 . 1 1 119 119 GLY H H 119 8.986 8.986 8.517 0.469 17890 10196 1 13 . 1 1 120 120 LYS N N 120 114.809 114.809 122.173 -7.364 17890 10197 1 13 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.638 -0.289 17890 10198 1 13 . 1 1 120 120 LYS C C 120 175.174 175.174 176.432 -1.258 17890 10199 1 13 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.036 1.897 17890 10200 1 13 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.710 -0.234 17890 10201 1 13 . 1 1 120 120 LYS H H 120 7.045 7.045 8.477 -1.432 17890 10202 1 13 . 1 1 121 121 ARG N N 121 116.291 116.291 115.150 1.141 17890 10203 1 13 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.245 -0.659 17890 10204 1 13 . 1 1 121 121 ARG C C 121 175.097 175.097 177.024 -1.927 17890 10205 1 13 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.117 0.952 17890 10206 1 13 . 1 1 121 121 ARG CB C 121 26.623 26.623 27.215 -0.592 17890 10207 1 13 . 1 1 121 121 ARG H H 121 7.683 7.683 7.996 -0.313 17890 10208 1 13 . 1 1 122 122 THR N N 122 113.730 113.730 109.004 4.726 17890 10209 1 13 . 1 1 122 122 THR HA H 122 4.540 4.540 4.235 0.305 17890 10210 1 13 . 1 1 122 122 THR C C 122 175.302 175.302 174.582 0.720 17890 10211 1 13 . 1 1 122 122 THR CA C 122 62.871 62.871 63.921 -1.050 17890 10212 1 13 . 1 1 122 122 THR CB C 122 71.552 71.552 69.957 1.595 17890 10213 1 13 . 1 1 122 122 THR H H 122 11.059 11.059 7.947 3.112 17890 10214 1 13 . 1 1 123 123 VAL N N 123 118.350 118.350 113.221 5.129 17890 10215 1 13 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.767 0.043 17890 10216 1 13 . 1 1 123 123 VAL C C 123 174.730 174.730 173.417 1.313 17890 10217 1 13 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.638 -0.327 17890 10218 1 13 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.958 2.124 17890 10219 1 13 . 1 1 123 123 VAL H H 123 8.181 8.181 7.221 0.960 17890 10220 1 13 . 1 1 124 124 SER N N 124 113.053 113.053 115.038 -1.985 17890 10221 1 13 . 1 1 124 124 SER HA H 124 5.820 5.820 5.283 0.537 17890 10222 1 13 . 1 1 124 124 SER C C 124 175.521 175.521 173.781 1.740 17890 10223 1 13 . 1 1 124 124 SER CA C 124 58.087 58.087 56.263 1.825 17890 10224 1 13 . 1 1 124 124 SER CB C 124 67.405 67.405 66.152 1.253 17890 10225 1 13 . 1 1 124 124 SER H H 124 9.138 9.138 8.775 0.363 17890 10226 1 13 . 1 1 125 125 TRP N N 125 124.900 124.900 125.274 -0.374 17890 10227 1 13 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.061 0.549 17890 10228 1 13 . 1 1 125 125 TRP C C 125 178.114 178.114 177.459 0.655 17890 10229 1 13 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.235 -0.761 17890 10230 1 13 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.703 1.320 17890 10231 1 13 . 1 1 125 125 TRP H H 125 8.843 8.843 8.480 0.363 17890 10232 1 13 . 1 1 126 126 SER N N 126 119.243 119.243 114.410 4.833 17890 10233 1 13 . 1 1 126 126 SER HA H 126 5.443 5.443 5.343 0.100 17890 10234 1 13 . 1 1 126 126 SER C C 126 171.668 171.668 172.821 -1.153 17890 10235 1 13 . 1 1 126 126 SER CA C 126 58.696 58.696 56.903 1.793 17890 10236 1 13 . 1 1 126 126 SER CB C 126 66.176 66.176 66.493 -0.317 17890 10237 1 13 . 1 1 126 126 SER H H 126 9.835 9.835 9.260 0.575 17890 10238 1 13 . 1 1 127 127 LEU N N 127 113.708 113.708 118.382 -4.674 17890 10239 1 13 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.744 0.411 17890 10240 1 13 . 1 1 127 127 LEU C C 127 176.563 176.563 177.117 -0.554 17890 10241 1 13 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.172 -0.527 17890 10242 1 13 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.721 -2.025 17890 10243 1 13 . 1 1 127 127 LEU H H 127 6.559 6.559 8.086 -1.527 17890 10244 1 13 . 1 1 128 128 ASN N N 128 121.739 121.739 120.973 0.766 17890 10245 1 13 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.769 -0.080 17890 10246 1 13 . 1 1 128 128 ASN C C 128 175.452 175.452 175.610 -0.158 17890 10247 1 13 . 1 1 128 128 ASN CA C 128 56.007 56.007 55.650 0.357 17890 10248 1 13 . 1 1 128 128 ASN CB C 128 39.291 39.291 39.415 -0.124 17890 10249 1 13 . 1 1 128 128 ASN H H 128 8.662 8.662 8.995 -0.333 17890 10250 1 13 . 1 1 129 129 ASN N N 129 119.586 119.586 115.738 3.848 17890 10251 1 13 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.939 0.058 17890 10252 1 13 . 1 1 129 129 ASN C C 129 175.900 175.900 174.695 1.205 17890 10253 1 13 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.320 0.913 17890 10254 1 13 . 1 1 129 129 ASN CB C 129 41.256 41.256 40.868 0.388 17890 10255 1 13 . 1 1 129 129 ASN H H 129 10.962 10.962 8.767 2.195 17890 10256 1 13 . 1 1 130 130 ALA N N 130 128.292 128.292 122.745 5.547 17890 10257 1 13 . 1 1 130 130 ALA HA H 130 3.570 3.570 3.962 -0.392 17890 10258 1 13 . 1 1 130 130 ALA C C 130 172.620 172.620 176.297 -3.677 17890 10259 1 13 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.444 -0.805 17890 10260 1 13 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.130 -1.030 17890 10261 1 13 . 1 1 130 130 ALA H H 130 10.629 10.629 8.222 2.407 17890 10262 1 13 . 1 1 131 131 THR N N 131 105.584 105.584 110.271 -4.687 17890 10263 1 13 . 1 1 131 131 THR HA H 131 4.462 4.462 4.313 0.149 17890 10264 1 13 . 1 1 131 131 THR C C 131 173.552 173.552 174.920 -1.368 17890 10265 1 13 . 1 1 131 131 THR CA C 131 58.338 58.338 60.675 -2.337 17890 10266 1 13 . 1 1 131 131 THR CB C 131 71.569 71.569 69.767 1.802 17890 10267 1 13 . 1 1 131 131 THR H H 131 7.092 7.092 7.329 -0.237 17890 10268 1 13 . 1 1 132 132 ALA N N 132 121.773 121.773 124.023 -2.250 17890 10269 1 13 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.012 -0.263 17890 10270 1 13 . 1 1 132 132 ALA C C 132 178.819 178.819 178.157 0.662 17890 10271 1 13 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.739 1.545 17890 10272 1 13 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.799 -0.572 17890 10273 1 13 . 1 1 132 132 ALA H H 132 8.952 8.952 8.614 0.338 17890 10274 1 13 . 1 1 133 133 GLY N N 133 113.965 113.965 112.108 1.857 17890 10275 1 13 . 1 1 133 133 GLY C C 133 173.453 173.453 174.110 -0.657 17890 10276 1 13 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.818 0.348 17890 10277 1 13 . 1 1 133 133 GLY H H 133 9.016 9.016 8.720 0.296 17890 10278 1 13 . 1 1 134 134 GLU N N 134 123.460 123.460 121.169 2.291 17890 10279 1 13 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.405 -0.447 17890 10280 1 13 . 1 1 134 134 GLU C C 134 176.120 176.120 175.971 0.149 17890 10281 1 13 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.656 1.743 17890 10282 1 13 . 1 1 134 134 GLU CB C 134 31.385 31.385 31.218 0.167 17890 10283 1 13 . 1 1 134 134 GLU H H 134 7.598 7.598 7.612 -0.014 17890 10284 1 13 . 1 1 135 135 GLU N N 135 122.633 122.633 124.078 -1.445 17890 10285 1 13 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.232 0.079 17890 10286 1 13 . 1 1 135 135 GLU C C 135 176.014 176.014 176.481 -0.467 17890 10287 1 13 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.721 -0.540 17890 10288 1 13 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.457 -1.004 17890 10289 1 13 . 1 1 135 135 GLU H H 135 8.258 8.258 8.632 -0.374 17890 10290 1 13 . 1 1 136 136 VAL N N 136 123.635 123.635 125.739 -2.104 17890 10291 1 13 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.839 -0.147 17890 10292 1 13 . 1 1 136 136 VAL C C 136 173.932 173.932 175.584 -1.652 17890 10293 1 13 . 1 1 136 136 VAL CA C 136 63.832 63.832 64.066 -0.234 17890 10294 1 13 . 1 1 136 136 VAL CB C 136 31.864 31.864 31.830 0.034 17890 10295 1 13 . 1 1 136 136 VAL H H 136 7.267 7.267 7.786 -0.519 17890 10296 1 13 . 1 1 137 137 SER N N 137 118.950 118.950 117.956 0.994 17890 10297 1 13 . 1 1 137 137 SER HA H 137 4.887 4.887 4.895 -0.008 17890 10298 1 13 . 1 1 137 137 SER C C 137 173.780 173.780 173.076 0.704 17890 10299 1 13 . 1 1 137 137 SER CA C 137 57.895 57.895 56.181 1.714 17890 10300 1 13 . 1 1 137 137 SER CB C 137 65.027 65.027 65.455 -0.428 17890 10301 1 13 . 1 1 137 137 SER H H 137 8.454 8.454 8.477 -0.023 17890 10302 1 13 . 1 1 138 138 ILE N N 138 123.511 123.511 121.468 2.043 17890 10303 1 13 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.026 -0.778 17890 10304 1 13 . 1 1 138 138 ILE C C 138 176.142 176.142 175.334 0.808 17890 10305 1 13 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.538 1.312 17890 10306 1 13 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.616 -3.021 17890 10307 1 13 . 1 1 138 138 ILE H H 138 7.915 7.915 8.185 -0.270 17890 10308 1 13 . 1 1 139 139 GLY N N 139 115.638 115.638 111.451 4.187 17890 10309 1 13 . 1 1 139 139 GLY C C 139 171.947 171.947 172.172 -0.225 17890 10310 1 13 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.249 1.837 17890 10311 1 13 . 1 1 139 139 GLY H H 139 8.490 8.490 8.360 0.130 17890 10312 1 13 . 1 1 140 140 ALA N N 140 128.563 128.563 121.471 7.092 17890 10313 1 13 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.279 0.117 17890 10314 1 13 . 1 1 140 140 ALA C C 140 177.956 177.956 177.099 0.857 17890 10315 1 13 . 1 1 140 140 ALA CA C 140 52.646 52.646 52.511 0.134 17890 10316 1 13 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.343 -0.139 17890 10317 1 13 . 1 1 140 140 ALA H H 140 8.531 8.531 8.115 0.416 17890 10318 1 13 . 1 1 141 141 ASP N N 141 120.886 120.886 121.572 -0.686 17890 10319 1 13 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.439 0.159 17890 10320 1 13 . 1 1 141 141 ASP C C 141 175.411 175.411 175.972 -0.561 17890 10321 1 13 . 1 1 141 141 ASP CA C 141 53.916 53.916 54.866 -0.950 17890 10322 1 13 . 1 1 141 141 ASP CB C 141 40.692 40.692 40.813 -0.121 17890 10323 1 13 . 1 1 141 141 ASP H H 141 8.507 8.507 8.418 0.089 17890 10324 1 13 . 1 1 142 142 ALA N N 142 125.604 125.604 128.629 -3.025 17890 10325 1 13 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.374 0.143 17890 10326 1 13 . 1 1 142 142 ALA C C 142 177.671 177.671 178.047 -0.376 17890 10327 1 13 . 1 1 142 142 ALA CA C 142 51.993 51.993 52.108 -0.115 17890 10328 1 13 . 1 1 142 142 ALA CB C 142 21.535 21.535 19.816 1.719 17890 10329 1 13 . 1 1 142 142 ALA H H 142 7.894 7.894 8.417 -0.523 17890 10330 1 13 . 1 1 143 143 THR N N 143 118.085 118.085 114.616 3.469 17890 10331 1 13 . 1 1 143 143 THR HA H 143 3.744 3.744 4.284 -0.540 17890 10332 1 13 . 1 1 143 143 THR C C 143 175.464 175.464 175.093 0.371 17890 10333 1 13 . 1 1 143 143 THR CA C 143 64.548 64.548 63.727 0.821 17890 10334 1 13 . 1 1 143 143 THR CB C 143 69.305 69.305 68.692 0.613 17890 10335 1 13 . 1 1 143 143 THR H H 143 8.268 8.268 8.850 -0.582 17890 10336 1 13 . 1 1 144 144 PHE N N 144 118.635 118.635 118.411 0.224 17890 10337 1 13 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.759 -0.413 17890 10338 1 13 . 1 1 144 144 PHE C C 144 176.209 176.209 175.298 0.911 17890 10339 1 13 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.329 4.133 17890 10340 1 13 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.392 0.212 17890 10341 1 13 . 1 1 144 144 PHE H H 144 8.719 8.719 7.770 0.949 17890 10342 1 13 . 1 1 145 145 SER N N 145 113.446 113.446 116.283 -2.837 17890 10343 1 13 . 1 1 145 145 SER HA H 145 4.866 4.866 4.152 0.714 17890 10344 1 13 . 1 1 145 145 SER C C 145 176.605 176.605 175.903 0.702 17890 10345 1 13 . 1 1 145 145 SER CA C 145 59.432 59.432 57.459 1.973 17890 10346 1 13 . 1 1 145 145 SER CB C 145 62.167 62.167 62.904 -0.737 17890 10347 1 13 . 1 1 145 145 SER H H 145 8.657 8.657 7.197 1.460 17890 10348 1 13 . 1 1 146 146 GLY N N 146 109.277 109.277 109.662 -0.385 17890 10349 1 13 . 1 1 146 146 GLY C C 146 174.293 174.293 173.747 0.546 17890 10350 1 13 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.169 -0.229 17890 10351 1 13 . 1 1 146 146 GLY H H 146 7.467 7.467 8.132 -0.665 17890 10352 1 13 . 1 1 147 147 ARG N N 147 122.863 122.863 118.187 4.676 17890 10353 1 13 . 1 1 147 147 ARG HA H 147 5.441 5.441 5.169 0.272 17890 10354 1 13 . 1 1 147 147 ARG C C 147 173.849 173.849 174.774 -0.925 17890 10355 1 13 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.681 -2.454 17890 10356 1 13 . 1 1 147 147 ARG CB C 147 32.597 32.597 34.172 -1.575 17890 10357 1 13 . 1 1 147 147 ARG H H 147 7.556 7.556 7.217 0.339 17890 10358 1 13 . 1 1 148 148 TRP N N 148 118.465 118.465 120.504 -2.039 17890 10359 1 13 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.199 -0.353 17890 10360 1 13 . 1 1 148 148 TRP C C 148 174.353 174.353 174.292 0.061 17890 10361 1 13 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.965 -1.303 17890 10362 1 13 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.400 -1.401 17890 10363 1 13 . 1 1 148 148 TRP H H 148 8.709 8.709 9.265 -0.556 17890 10364 1 13 . 1 1 149 149 VAL N N 149 125.852 125.852 118.003 7.849 17890 10365 1 13 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.551 -0.408 17890 10366 1 13 . 1 1 149 149 VAL C C 149 173.613 173.613 173.322 0.291 17890 10367 1 13 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.907 1.833 17890 10368 1 13 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.254 -2.871 17890 10369 1 13 . 1 1 149 149 VAL H H 149 9.700 9.700 8.829 0.871 17890 10370 1 13 . 1 1 150 150 ILE N N 150 125.140 125.140 127.891 -2.751 17890 10371 1 13 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.086 -0.224 17890 10372 1 13 . 1 1 150 150 ILE C C 150 175.661 175.661 174.948 0.713 17890 10373 1 13 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.497 1.324 17890 10374 1 13 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.861 -1.041 17890 10375 1 13 . 1 1 150 150 ILE H H 150 7.747 7.747 7.928 -0.181 17890 10376 1 13 . 1 1 151 151 GLU N N 151 126.762 126.762 128.338 -1.576 17890 10377 1 13 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.851 0.029 17890 10378 1 13 . 1 1 151 151 GLU C C 151 174.424 174.424 174.755 -0.331 17890 10379 1 13 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.813 0.983 17890 10380 1 13 . 1 1 151 151 GLU CB C 151 34.251 34.251 34.014 0.237 17890 10381 1 13 . 1 1 151 151 GLU H H 151 8.892 8.892 8.892 -0.000 17890 10382 1 13 . 1 1 152 152 LYS N N 152 126.299 126.299 122.553 3.746 17890 10383 1 13 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.824 0.037 17890 10384 1 13 . 1 1 152 152 LYS C C 152 176.282 176.282 176.846 -0.564 17890 10385 1 13 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.805 0.700 17890 10386 1 13 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.604 0.732 17890 10387 1 13 . 1 1 152 152 LYS H H 152 8.640 8.640 8.303 0.337 17890 10388 1 14 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.367 -2.073 17890 10389 1 14 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.683 -0.061 17890 10390 1 14 . 1 1 8 8 HIS CA C 8 55.661 55.661 54.926 0.735 17890 10391 1 14 . 1 1 8 8 HIS CB C 8 29.880 29.880 32.500 -2.620 17890 10392 1 14 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.606 0.040 17890 10393 1 14 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.883 -0.199 17890 10394 1 14 . 1 1 9 9 HIS CB C 9 29.831 29.831 32.542 -2.711 17890 10395 1 14 . 1 1 10 10 HIS N N 10 120.811 120.811 121.180 -0.369 17890 10396 1 14 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.582 0.098 17890 10397 1 14 . 1 1 10 10 HIS C C 10 174.875 174.875 173.506 1.369 17890 10398 1 14 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.153 -0.407 17890 10399 1 14 . 1 1 10 10 HIS CB C 10 29.889 29.889 30.992 -1.103 17890 10400 1 14 . 1 1 10 10 HIS H H 10 8.583 8.583 8.172 0.411 17890 10401 1 14 . 1 1 11 11 SER N N 11 118.009 118.009 112.398 5.611 17890 10402 1 14 . 1 1 11 11 SER HA H 11 4.424 4.424 4.390 0.034 17890 10403 1 14 . 1 1 11 11 SER C C 11 174.962 174.962 173.602 1.360 17890 10404 1 14 . 1 1 11 11 SER CA C 11 58.660 58.660 56.739 1.921 17890 10405 1 14 . 1 1 11 11 SER CB C 11 63.822 63.822 65.506 -1.684 17890 10406 1 14 . 1 1 11 11 SER H H 11 8.438 8.438 7.509 0.929 17890 10407 1 14 . 1 1 12 12 GLY N N 12 111.011 111.011 107.442 3.569 17890 10408 1 14 . 1 1 12 12 GLY C C 12 173.907 173.907 173.564 0.343 17890 10409 1 14 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.303 0.118 17890 10410 1 14 . 1 1 12 12 GLY H H 12 8.433 8.433 8.462 -0.029 17890 10411 1 14 . 1 1 13 13 ASP N N 13 120.291 120.291 120.069 0.222 17890 10412 1 14 . 1 1 13 13 ASP HA H 13 4.662 4.662 5.059 -0.397 17890 10413 1 14 . 1 1 13 13 ASP C C 13 176.115 176.115 175.289 0.826 17890 10414 1 14 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.745 0.558 17890 10415 1 14 . 1 1 13 13 ASP CB C 13 41.465 41.465 43.026 -1.560 17890 10416 1 14 . 1 1 13 13 ASP H H 13 8.153 8.153 8.079 0.074 17890 10417 1 14 . 1 1 14 14 SER N N 14 116.987 116.987 115.676 1.311 17890 10418 1 14 . 1 1 14 14 SER HA H 14 4.754 4.754 4.798 -0.044 17890 10419 1 14 . 1 1 14 14 SER CA C 14 56.469 56.469 56.721 -0.252 17890 10420 1 14 . 1 1 14 14 SER CB C 14 63.553 63.553 64.279 -0.726 17890 10421 1 14 . 1 1 14 14 SER H H 14 8.210 8.210 8.104 0.106 17890 10422 1 14 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.512 -0.070 17890 10423 1 14 . 1 1 15 15 PRO C C 15 176.424 176.424 175.453 0.971 17890 10424 1 14 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.894 0.339 17890 10425 1 14 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.460 -0.312 17890 10426 1 14 . 1 1 16 16 ALA N N 16 124.219 124.219 124.701 -0.482 17890 10427 1 14 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.499 -0.149 17890 10428 1 14 . 1 1 16 16 ALA C C 16 177.552 177.552 175.988 1.564 17890 10429 1 14 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.199 0.234 17890 10430 1 14 . 1 1 16 16 ALA CB C 16 19.319 19.319 20.114 -0.795 17890 10431 1 14 . 1 1 16 16 ALA H H 16 8.284 8.284 8.231 0.053 17890 10432 1 14 . 1 1 17 17 VAL N N 17 119.504 119.504 117.984 1.520 17890 10433 1 14 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.388 -0.139 17890 10434 1 14 . 1 1 17 17 VAL C C 17 176.322 176.322 176.069 0.253 17890 10435 1 14 . 1 1 17 17 VAL CA C 17 62.278 62.278 61.986 0.292 17890 10436 1 14 . 1 1 17 17 VAL CB C 17 32.957 32.957 33.672 -0.715 17890 10437 1 14 . 1 1 17 17 VAL H H 17 8.046 8.046 7.813 0.233 17890 10438 1 14 . 1 1 18 18 THR N N 18 118.186 118.186 115.760 2.426 17890 10439 1 14 . 1 1 18 18 THR HA H 18 4.473 4.473 4.509 -0.036 17890 10440 1 14 . 1 1 18 18 THR C C 18 174.248 174.248 174.693 -0.445 17890 10441 1 14 . 1 1 18 18 THR CA C 18 61.565 61.565 61.554 0.011 17890 10442 1 14 . 1 1 18 18 THR CB C 18 70.165 70.165 69.966 0.199 17890 10443 1 14 . 1 1 18 18 THR H H 18 8.276 8.276 8.430 -0.154 17890 10444 1 14 . 1 1 19 19 LEU N N 19 125.265 125.265 119.335 5.930 17890 10445 1 14 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.924 0.369 17890 10446 1 14 . 1 1 19 19 LEU C C 19 175.689 175.689 175.505 0.184 17890 10447 1 14 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.533 -0.106 17890 10448 1 14 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.154 2.125 17890 10449 1 14 . 1 1 19 19 LEU H H 19 8.091 8.091 8.001 0.090 17890 10450 1 14 . 1 1 20 20 SER N N 20 114.622 114.622 115.594 -0.972 17890 10451 1 14 . 1 1 20 20 SER HA H 20 4.947 4.947 4.922 0.025 17890 10452 1 14 . 1 1 20 20 SER C C 20 174.220 174.220 173.359 0.861 17890 10453 1 14 . 1 1 20 20 SER CA C 20 56.583 56.583 57.390 -0.807 17890 10454 1 14 . 1 1 20 20 SER CB C 20 65.653 65.653 66.286 -0.633 17890 10455 1 14 . 1 1 20 20 SER H H 20 7.316 7.316 8.261 -0.945 17890 10456 1 14 . 1 1 21 21 ALA N N 21 125.517 125.517 124.650 0.867 17890 10457 1 14 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.977 -0.309 17890 10458 1 14 . 1 1 21 21 ALA C C 21 177.960 177.960 177.880 0.080 17890 10459 1 14 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.523 1.487 17890 10460 1 14 . 1 1 21 21 ALA CB C 21 19.225 19.225 18.886 0.339 17890 10461 1 14 . 1 1 21 21 ALA H H 21 8.993 8.993 8.838 0.155 17890 10462 1 14 . 1 1 22 22 GLY N N 22 109.543 109.543 111.231 -1.688 17890 10463 1 14 . 1 1 22 22 GLY C C 22 170.422 170.422 171.745 -1.323 17890 10464 1 14 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.269 0.112 17890 10465 1 14 . 1 1 22 22 GLY H H 22 8.411 8.411 9.062 -0.651 17890 10466 1 14 . 1 1 23 23 ASN N N 23 119.649 119.649 118.845 0.804 17890 10467 1 14 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.694 0.193 17890 10468 1 14 . 1 1 23 23 ASN C C 23 175.207 175.207 174.525 0.682 17890 10469 1 14 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.572 -0.751 17890 10470 1 14 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.679 -0.924 17890 10471 1 14 . 1 1 23 23 ASN H H 23 8.092 8.092 8.411 -0.319 17890 10472 1 14 . 1 1 24 24 TYR N N 24 120.889 120.889 121.449 -0.560 17890 10473 1 14 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.151 0.104 17890 10474 1 14 . 1 1 24 24 TYR C C 24 175.667 175.667 174.408 1.259 17890 10475 1 14 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.245 0.868 17890 10476 1 14 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.705 0.121 17890 10477 1 14 . 1 1 24 24 TYR H H 24 9.914 9.914 9.006 0.908 17890 10478 1 14 . 1 1 25 25 ILE N N 25 115.978 115.978 113.517 2.461 17890 10479 1 14 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.032 0.054 17890 10480 1 14 . 1 1 25 25 ILE C C 25 175.200 175.200 174.191 1.009 17890 10481 1 14 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.707 0.838 17890 10482 1 14 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.921 -0.799 17890 10483 1 14 . 1 1 25 25 ILE H H 25 9.216 9.216 9.281 -0.065 17890 10484 1 14 . 1 1 26 26 ILE N N 26 123.957 123.957 122.943 1.014 17890 10485 1 14 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.192 -0.216 17890 10486 1 14 . 1 1 26 26 ILE C C 26 174.810 174.810 174.788 0.022 17890 10487 1 14 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.396 0.213 17890 10488 1 14 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.016 1.106 17890 10489 1 14 . 1 1 26 26 ILE H H 26 9.559 9.559 9.079 0.480 17890 10490 1 14 . 1 1 27 27 TYR N N 27 121.371 121.371 124.004 -2.633 17890 10491 1 14 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.566 0.624 17890 10492 1 14 . 1 1 27 27 TYR C C 27 173.963 173.963 173.361 0.602 17890 10493 1 14 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.909 -0.240 17890 10494 1 14 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.072 0.626 17890 10495 1 14 . 1 1 27 27 TYR H H 27 9.378 9.378 9.109 0.269 17890 10496 1 14 . 1 1 28 28 ASN N N 28 121.991 121.991 119.756 2.235 17890 10497 1 14 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.169 -0.401 17890 10498 1 14 . 1 1 28 28 ASN C C 28 174.352 174.352 176.532 -2.180 17890 10499 1 14 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.678 2.442 17890 10500 1 14 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.754 1.692 17890 10501 1 14 . 1 1 28 28 ASN H H 28 8.466 8.466 8.340 0.126 17890 10502 1 14 . 1 1 29 29 ARG N N 29 121.103 121.103 126.313 -5.210 17890 10503 1 14 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.018 -0.157 17890 10504 1 14 . 1 1 29 29 ARG C C 29 173.635 173.635 177.523 -3.888 17890 10505 1 14 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.612 0.681 17890 10506 1 14 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.114 0.285 17890 10507 1 14 . 1 1 29 29 ARG H H 29 7.756 7.756 8.253 -0.497 17890 10508 1 14 . 1 1 30 30 VAL N N 30 118.412 118.412 117.460 0.952 17890 10509 1 14 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.833 0.111 17890 10510 1 14 . 1 1 30 30 VAL C C 30 176.199 176.199 175.822 0.377 17890 10511 1 14 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.629 -1.052 17890 10512 1 14 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.025 -1.803 17890 10513 1 14 . 1 1 30 30 VAL H H 30 8.976 8.976 7.727 1.249 17890 10514 1 14 . 1 1 31 31 LEU N N 31 125.418 125.418 113.961 11.457 17890 10515 1 14 . 1 1 31 31 LEU HA H 31 4.485 4.485 3.988 0.497 17890 10516 1 14 . 1 1 31 31 LEU C C 31 179.123 179.123 176.466 2.657 17890 10517 1 14 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.517 -1.492 17890 10518 1 14 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.207 4.374 17890 10519 1 14 . 1 1 31 31 LEU H H 31 8.856 8.856 7.509 1.347 17890 10520 1 14 . 1 1 32 32 SER N N 32 116.890 116.890 115.737 1.153 17890 10521 1 14 . 1 1 32 32 SER HA H 32 5.365 5.365 4.733 0.632 17890 10522 1 14 . 1 1 32 32 SER CA C 32 57.269 57.269 57.296 -0.027 17890 10523 1 14 . 1 1 32 32 SER CB C 32 62.213 62.213 64.204 -1.991 17890 10524 1 14 . 1 1 32 32 SER H H 32 9.307 9.307 8.566 0.741 17890 10525 1 14 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.508 -0.628 17890 10526 1 14 . 1 1 33 33 PRO C C 33 175.137 175.137 176.862 -1.725 17890 10527 1 14 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.368 0.917 17890 10528 1 14 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.344 0.687 17890 10529 1 14 . 1 1 34 34 ARG N N 34 110.279 110.279 119.207 -8.928 17890 10530 1 14 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.439 0.053 17890 10531 1 14 . 1 1 34 34 ARG C C 34 176.844 176.844 176.716 0.128 17890 10532 1 14 . 1 1 34 34 ARG CA C 34 54.436 54.436 54.825 -0.389 17890 10533 1 14 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.750 -0.167 17890 10534 1 14 . 1 1 34 34 ARG H H 34 7.257 7.257 7.716 -0.459 17890 10535 1 14 . 1 1 35 35 GLY N N 35 110.288 110.288 107.422 2.866 17890 10536 1 14 . 1 1 35 35 GLY C C 35 173.336 173.336 174.135 -0.799 17890 10537 1 14 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.995 2.034 17890 10538 1 14 . 1 1 35 35 GLY H H 35 8.589 8.589 7.637 0.952 17890 10539 1 14 . 1 1 36 36 GLU N N 36 116.838 116.838 118.933 -2.095 17890 10540 1 14 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.656 -0.308 17890 10541 1 14 . 1 1 36 36 GLU C C 36 176.915 176.915 175.692 1.223 17890 10542 1 14 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.921 0.986 17890 10543 1 14 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.246 -2.831 17890 10544 1 14 . 1 1 36 36 GLU H H 36 7.769 7.769 8.199 -0.430 17890 10545 1 14 . 1 1 37 37 LYS N N 37 123.775 123.775 120.132 3.643 17890 10546 1 14 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.113 0.310 17890 10547 1 14 . 1 1 37 37 LYS C C 37 176.067 176.067 175.372 0.695 17890 10548 1 14 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.679 -0.778 17890 10549 1 14 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.761 0.913 17890 10550 1 14 . 1 1 37 37 LYS H H 37 8.667 8.667 8.648 0.019 17890 10551 1 14 . 1 1 38 38 LEU N N 38 126.658 126.658 124.918 1.740 17890 10552 1 14 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.948 -0.721 17890 10553 1 14 . 1 1 38 38 LEU C C 38 174.332 174.332 175.149 -0.817 17890 10554 1 14 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.765 -0.422 17890 10555 1 14 . 1 1 38 38 LEU CB C 38 41.651 41.651 43.179 -1.528 17890 10556 1 14 . 1 1 38 38 LEU H H 38 10.455 10.455 8.821 1.634 17890 10557 1 14 . 1 1 39 39 ALA N N 39 127.018 127.018 125.757 1.261 17890 10558 1 14 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.333 -0.104 17890 10559 1 14 . 1 1 39 39 ALA C C 39 178.694 178.694 176.123 2.571 17890 10560 1 14 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.225 -0.000 17890 10561 1 14 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.857 0.492 17890 10562 1 14 . 1 1 39 39 ALA H H 39 8.773 8.773 8.445 0.328 17890 10563 1 14 . 1 1 40 40 LEU N N 40 126.771 126.771 122.952 3.819 17890 10564 1 14 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.483 -0.129 17890 10565 1 14 . 1 1 40 40 LEU C C 40 178.309 178.309 176.530 1.779 17890 10566 1 14 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.155 0.690 17890 10567 1 14 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.782 0.541 17890 10568 1 14 . 1 1 40 40 LEU H H 40 9.665 9.665 8.602 1.063 17890 10569 1 14 . 1 1 41 41 THR N N 41 126.578 126.578 124.829 1.749 17890 10570 1 14 . 1 1 41 41 THR HA H 41 4.916 4.916 5.179 -0.263 17890 10571 1 14 . 1 1 41 41 THR C C 41 172.547 172.547 173.284 -0.737 17890 10572 1 14 . 1 1 41 41 THR CA C 41 63.253 63.253 61.452 1.801 17890 10573 1 14 . 1 1 41 41 THR CB C 41 71.832 71.832 70.897 0.935 17890 10574 1 14 . 1 1 41 41 THR H H 41 9.802 9.802 9.218 0.584 17890 10575 1 14 . 1 1 42 42 TYR N N 42 130.506 130.506 129.738 0.768 17890 10576 1 14 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.541 0.561 17890 10577 1 14 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.807 -3.821 17890 10578 1 14 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.292 -0.137 17890 10579 1 14 . 1 1 42 42 TYR H H 42 9.428 9.428 8.863 0.565 17890 10580 1 14 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.392 0.098 17890 10581 1 14 . 1 1 43 43 PRO CA C 43 63.573 63.573 62.985 0.588 17890 10582 1 14 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.863 -0.219 17890 10583 1 14 . 1 1 44 44 GLY N N 44 113.736 113.736 106.715 7.021 17890 10584 1 14 . 1 1 44 44 GLY C C 44 171.790 171.790 173.148 -1.358 17890 10585 1 14 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.617 1.099 17890 10586 1 14 . 1 1 44 44 GLY H H 44 8.337 8.337 7.019 1.318 17890 10587 1 14 . 1 1 45 45 ARG N N 45 113.899 113.899 116.477 -2.578 17890 10588 1 14 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.538 0.038 17890 10589 1 14 . 1 1 45 45 ARG C C 45 175.151 175.151 173.686 1.465 17890 10590 1 14 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.762 -0.597 17890 10591 1 14 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.619 1.600 17890 10592 1 14 . 1 1 45 45 ARG H H 45 6.463 6.463 7.224 -0.761 17890 10593 1 14 . 1 1 46 46 GLN N N 46 119.000 119.000 117.903 1.097 17890 10594 1 14 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.515 -0.066 17890 10595 1 14 . 1 1 46 46 GLN C C 46 177.282 177.282 176.733 0.549 17890 10596 1 14 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.526 1.087 17890 10597 1 14 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.685 0.811 17890 10598 1 14 . 1 1 46 46 GLN H H 46 8.683 8.683 8.543 0.140 17890 10599 1 14 . 1 1 47 47 ARG N N 47 113.526 113.526 117.062 -3.536 17890 10600 1 14 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.018 -0.488 17890 10601 1 14 . 1 1 47 47 ARG C C 47 174.130 174.130 175.366 -1.236 17890 10602 1 14 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.152 1.664 17890 10603 1 14 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.089 1.981 17890 10604 1 14 . 1 1 47 47 ARG H H 47 9.677 9.677 8.859 0.818 17890 10605 1 14 . 1 1 48 48 THR N N 48 114.672 114.672 115.191 -0.519 17890 10606 1 14 . 1 1 48 48 THR HA H 48 4.938 4.938 4.746 0.192 17890 10607 1 14 . 1 1 48 48 THR CA C 48 59.987 59.987 59.840 0.147 17890 10608 1 14 . 1 1 48 48 THR CB C 48 71.947 71.947 70.917 1.030 17890 10609 1 14 . 1 1 48 48 THR H H 48 8.104 8.104 7.583 0.521 17890 10610 1 14 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.634 -0.266 17890 10611 1 14 . 1 1 49 49 PRO C C 49 175.651 175.651 176.620 -0.969 17890 10612 1 14 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.788 1.393 17890 10613 1 14 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.162 0.535 17890 10614 1 14 . 1 1 50 50 VAL N N 50 122.562 122.562 120.182 2.380 17890 10615 1 14 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.169 -0.222 17890 10616 1 14 . 1 1 50 50 VAL C C 50 174.493 174.493 175.677 -1.184 17890 10617 1 14 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.188 2.623 17890 10618 1 14 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.016 -1.848 17890 10619 1 14 . 1 1 50 50 VAL H H 50 8.123 8.123 8.377 -0.254 17890 10620 1 14 . 1 1 51 51 THR N N 51 113.549 113.549 118.786 -5.237 17890 10621 1 14 . 1 1 51 51 THR HA H 51 5.372 5.372 4.927 0.445 17890 10622 1 14 . 1 1 51 51 THR C C 51 174.841 174.841 173.049 1.792 17890 10623 1 14 . 1 1 51 51 THR CA C 51 59.196 59.196 61.055 -1.859 17890 10624 1 14 . 1 1 51 51 THR CB C 51 72.703 72.703 71.683 1.020 17890 10625 1 14 . 1 1 51 51 THR H H 51 7.057 7.057 8.073 -1.016 17890 10626 1 14 . 1 1 52 52 VAL N N 52 107.374 107.374 117.583 -10.209 17890 10627 1 14 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.353 0.161 17890 10628 1 14 . 1 1 52 52 VAL C C 52 175.697 175.697 174.151 1.546 17890 10629 1 14 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.809 -1.337 17890 10630 1 14 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.997 -0.223 17890 10631 1 14 . 1 1 52 52 VAL H H 52 8.062 8.062 8.563 -0.501 17890 10632 1 14 . 1 1 53 53 SER N N 53 114.662 114.662 119.247 -4.585 17890 10633 1 14 . 1 1 53 53 SER HA H 53 4.690 4.690 4.993 -0.303 17890 10634 1 14 . 1 1 53 53 SER CA C 53 56.828 56.828 56.460 0.368 17890 10635 1 14 . 1 1 53 53 SER CB C 53 64.789 64.789 65.267 -0.478 17890 10636 1 14 . 1 1 53 53 SER H H 53 8.681 8.681 8.960 -0.279 17890 10637 1 14 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.841 -0.065 17890 10638 1 14 . 1 1 54 54 PRO C C 54 177.724 177.724 176.266 1.458 17890 10639 1 14 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.051 0.374 17890 10640 1 14 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.406 -0.309 17890 10641 1 14 . 1 1 55 55 LEU N N 55 128.655 128.655 120.827 7.828 17890 10642 1 14 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.631 -0.104 17890 10643 1 14 . 1 1 55 55 LEU C C 55 178.696 178.696 175.686 3.010 17890 10644 1 14 . 1 1 55 55 LEU CA C 55 56.246 56.246 53.804 2.442 17890 10645 1 14 . 1 1 55 55 LEU CB C 55 43.606 43.606 44.504 -0.898 17890 10646 1 14 . 1 1 55 55 LEU H H 55 8.675 8.675 8.227 0.448 17890 10647 1 14 . 1 1 56 56 ASP N N 56 126.651 126.651 122.273 4.378 17890 10648 1 14 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.771 -0.062 17890 10649 1 14 . 1 1 56 56 ASP C C 56 177.729 177.729 176.951 0.778 17890 10650 1 14 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.852 -0.229 17890 10651 1 14 . 1 1 56 56 ASP CB C 56 41.632 41.632 43.308 -1.676 17890 10652 1 14 . 1 1 56 56 ASP H H 56 9.683 9.683 8.834 0.849 17890 10653 1 14 . 1 1 57 57 GLY N N 57 109.299 109.299 108.900 0.399 17890 10654 1 14 . 1 1 57 57 GLY C C 57 174.558 174.558 174.502 0.056 17890 10655 1 14 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.898 1.057 17890 10656 1 14 . 1 1 57 57 GLY H H 57 8.157 8.157 8.759 -0.602 17890 10657 1 14 . 1 1 58 58 SER N N 58 116.740 116.740 116.315 0.425 17890 10658 1 14 . 1 1 58 58 SER HA H 58 4.288 4.288 4.546 -0.258 17890 10659 1 14 . 1 1 58 58 SER C C 58 177.252 177.252 175.933 1.319 17890 10660 1 14 . 1 1 58 58 SER CA C 58 58.737 58.737 57.533 1.204 17890 10661 1 14 . 1 1 58 58 SER CB C 58 64.576 64.576 64.633 -0.057 17890 10662 1 14 . 1 1 58 58 SER H H 58 8.328 8.328 7.840 0.488 17890 10663 1 14 . 1 1 59 59 SER N N 59 119.768 119.768 116.055 3.713 17890 10664 1 14 . 1 1 59 59 SER HA H 59 4.046 4.046 4.106 -0.060 17890 10665 1 14 . 1 1 59 59 SER C C 59 176.671 176.671 175.821 0.850 17890 10666 1 14 . 1 1 59 59 SER CA C 59 61.691 61.691 59.835 1.856 17890 10667 1 14 . 1 1 59 59 SER CB C 59 63.154 63.154 62.769 0.385 17890 10668 1 14 . 1 1 59 59 SER H H 59 9.020 9.020 8.728 0.292 17890 10669 1 14 . 1 1 60 60 GLU N N 60 119.133 119.133 120.675 -1.542 17890 10670 1 14 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.060 0.126 17890 10671 1 14 . 1 1 60 60 GLU C C 60 177.435 177.435 177.663 -0.228 17890 10672 1 14 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.971 1.062 17890 10673 1 14 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.722 -1.496 17890 10674 1 14 . 1 1 60 60 GLU H H 60 8.832 8.832 7.843 0.989 17890 10675 1 14 . 1 1 61 61 GLN N N 61 118.818 118.818 115.242 3.576 17890 10676 1 14 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.911 0.266 17890 10677 1 14 . 1 1 61 61 GLN C C 61 173.254 173.254 175.040 -1.786 17890 10678 1 14 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.354 0.019 17890 10679 1 14 . 1 1 61 61 GLN CB C 61 27.922 27.922 29.733 -1.811 17890 10680 1 14 . 1 1 61 61 GLN H H 61 7.648 7.648 7.554 0.094 17890 10681 1 14 . 1 1 62 62 ALA N N 62 122.562 122.562 122.787 -0.225 17890 10682 1 14 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.483 0.581 17890 10683 1 14 . 1 1 62 62 ALA C C 62 176.637 176.637 175.216 1.421 17890 10684 1 14 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.502 -0.323 17890 10685 1 14 . 1 1 62 62 ALA CB C 62 20.595 20.595 20.756 -0.161 17890 10686 1 14 . 1 1 62 62 ALA H H 62 7.315 7.315 7.082 0.233 17890 10687 1 14 . 1 1 63 63 TRP N N 63 124.787 124.787 119.605 5.182 17890 10688 1 14 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.307 -0.343 17890 10689 1 14 . 1 1 63 63 TRP C C 63 174.351 174.351 175.311 -0.960 17890 10690 1 14 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.195 -0.293 17890 10691 1 14 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.886 -1.769 17890 10692 1 14 . 1 1 63 63 TRP H H 63 9.544 9.544 8.931 0.613 17890 10693 1 14 . 1 1 64 64 ILE N N 64 122.482 122.482 119.255 3.227 17890 10694 1 14 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.939 -0.245 17890 10695 1 14 . 1 1 64 64 ILE C C 64 177.078 177.078 174.289 2.789 17890 10696 1 14 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.614 0.417 17890 10697 1 14 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.149 -0.780 17890 10698 1 14 . 1 1 64 64 ILE H H 64 10.235 10.235 9.405 0.830 17890 10699 1 14 . 1 1 65 65 LEU N N 65 132.183 132.183 128.859 3.324 17890 10700 1 14 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.535 -0.070 17890 10701 1 14 . 1 1 65 65 LEU C C 65 177.048 177.048 174.489 2.559 17890 10702 1 14 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.864 0.485 17890 10703 1 14 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.049 -3.705 17890 10704 1 14 . 1 1 65 65 LEU H H 65 9.432 9.432 9.292 0.140 17890 10705 1 14 . 1 1 66 66 ARG N N 66 120.807 120.807 125.295 -4.488 17890 10706 1 14 . 1 1 66 66 ARG HA H 66 4.888 4.888 5.047 -0.159 17890 10707 1 14 . 1 1 66 66 ARG C C 66 175.275 175.275 174.724 0.551 17890 10708 1 14 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.579 0.476 17890 10709 1 14 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.542 -1.551 17890 10710 1 14 . 1 1 66 66 ARG H H 66 8.491 8.491 8.381 0.110 17890 10711 1 14 . 1 1 67 67 SER N N 67 119.709 119.709 118.051 1.658 17890 10712 1 14 . 1 1 67 67 SER HA H 67 3.186 3.186 3.243 -0.057 17890 10713 1 14 . 1 1 67 67 SER C C 67 174.508 174.508 173.587 0.921 17890 10714 1 14 . 1 1 67 67 SER CA C 67 58.521 58.521 58.879 -0.358 17890 10715 1 14 . 1 1 67 67 SER CB C 67 62.590 62.590 63.143 -0.553 17890 10716 1 14 . 1 1 67 67 SER H H 67 8.557 8.557 8.667 -0.110 17890 10717 1 14 . 1 1 68 68 TYR N N 68 131.011 131.011 127.622 3.389 17890 10718 1 14 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.647 -0.199 17890 10719 1 14 . 1 1 68 68 TYR C C 68 174.687 174.687 174.760 -0.073 17890 10720 1 14 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.736 1.028 17890 10721 1 14 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.027 -2.039 17890 10722 1 14 . 1 1 68 68 TYR H H 68 8.531 8.531 8.645 -0.114 17890 10723 1 14 . 1 1 69 69 ASP N N 69 117.066 117.066 120.173 -3.107 17890 10724 1 14 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.881 -0.256 17890 10725 1 14 . 1 1 69 69 ASP C C 69 176.455 176.455 175.982 0.473 17890 10726 1 14 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.919 -0.828 17890 10727 1 14 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.813 -0.666 17890 10728 1 14 . 1 1 69 69 ASP H H 69 7.122 7.122 7.691 -0.569 17890 10729 1 14 . 1 1 70 70 SER N N 70 122.869 122.869 119.613 3.256 17890 10730 1 14 . 1 1 70 70 SER HA H 70 4.270 4.270 4.150 0.120 17890 10731 1 14 . 1 1 70 70 SER C C 70 177.010 177.010 175.776 1.234 17890 10732 1 14 . 1 1 70 70 SER CA C 70 60.837 60.837 60.841 -0.004 17890 10733 1 14 . 1 1 70 70 SER CB C 70 62.722 62.722 63.278 -0.556 17890 10734 1 14 . 1 1 70 70 SER H H 70 8.757 8.757 8.714 0.043 17890 10735 1 14 . 1 1 71 71 ASN N N 71 119.873 119.873 118.604 1.269 17890 10736 1 14 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.615 -0.044 17890 10737 1 14 . 1 1 71 71 ASN C C 71 176.226 176.226 176.124 0.102 17890 10738 1 14 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.188 0.526 17890 10739 1 14 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.433 0.208 17890 10740 1 14 . 1 1 71 71 ASN H H 71 8.342 8.342 8.636 -0.294 17890 10741 1 14 . 1 1 72 72 SER N N 72 112.202 112.202 113.028 -0.826 17890 10742 1 14 . 1 1 72 72 SER HA H 72 4.567 4.567 4.622 -0.055 17890 10743 1 14 . 1 1 72 72 SER C C 72 173.789 173.789 173.385 0.404 17890 10744 1 14 . 1 1 72 72 SER CA C 72 57.816 57.816 57.642 0.174 17890 10745 1 14 . 1 1 72 72 SER CB C 72 63.935 63.935 65.281 -1.346 17890 10746 1 14 . 1 1 72 72 SER H H 72 7.560 7.560 7.790 -0.230 17890 10747 1 14 . 1 1 73 73 ASN N N 73 117.437 117.437 117.465 -0.028 17890 10748 1 14 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.490 0.044 17890 10749 1 14 . 1 1 73 73 ASN C C 73 173.647 173.647 174.043 -0.396 17890 10750 1 14 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.343 0.180 17890 10751 1 14 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.081 0.132 17890 10752 1 14 . 1 1 73 73 ASN H H 73 7.940 7.940 7.995 -0.055 17890 10753 1 14 . 1 1 74 74 THR N N 74 104.227 104.227 109.037 -4.810 17890 10754 1 14 . 1 1 74 74 THR HA H 74 5.477 5.477 5.213 0.264 17890 10755 1 14 . 1 1 74 74 THR C C 74 176.824 176.824 173.873 2.951 17890 10756 1 14 . 1 1 74 74 THR CA C 74 59.768 59.768 61.427 -1.659 17890 10757 1 14 . 1 1 74 74 THR CB C 74 71.985 71.985 70.040 1.945 17890 10758 1 14 . 1 1 74 74 THR H H 74 7.737 7.737 7.838 -0.101 17890 10759 1 14 . 1 1 75 75 TRP N N 75 124.636 124.636 123.034 1.602 17890 10760 1 14 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.366 -0.159 17890 10761 1 14 . 1 1 75 75 TRP C C 75 175.876 175.876 176.176 -0.300 17890 10762 1 14 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.272 1.334 17890 10763 1 14 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.500 0.016 17890 10764 1 14 . 1 1 75 75 TRP H H 75 9.442 9.442 9.398 0.044 17890 10765 1 14 . 1 1 76 76 THR N N 76 110.544 110.544 114.493 -3.949 17890 10766 1 14 . 1 1 76 76 THR HA H 76 5.129 5.129 5.026 0.103 17890 10767 1 14 . 1 1 76 76 THR C C 76 174.506 174.506 174.621 -0.115 17890 10768 1 14 . 1 1 76 76 THR CA C 76 60.561 60.561 61.378 -0.817 17890 10769 1 14 . 1 1 76 76 THR CB C 76 71.688 71.688 70.024 1.664 17890 10770 1 14 . 1 1 76 76 THR H H 76 9.415 9.415 9.361 0.054 17890 10771 1 14 . 1 1 77 77 ILE N N 77 121.567 121.567 123.697 -2.130 17890 10772 1 14 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.236 -0.097 17890 10773 1 14 . 1 1 77 77 ILE C C 77 176.148 176.148 175.161 0.987 17890 10774 1 14 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.750 1.958 17890 10775 1 14 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.808 1.179 17890 10776 1 14 . 1 1 77 77 ILE H H 77 9.255 9.255 8.375 0.880 17890 10777 1 14 . 1 1 78 78 SER N N 78 122.269 122.269 121.513 0.756 17890 10778 1 14 . 1 1 78 78 SER HA H 78 5.601 5.601 5.280 0.321 17890 10779 1 14 . 1 1 78 78 SER CA C 78 55.835 55.835 56.128 -0.293 17890 10780 1 14 . 1 1 78 78 SER CB C 78 65.858 65.858 66.636 -0.778 17890 10781 1 14 . 1 1 78 78 SER H H 78 9.226 9.226 8.663 0.563 17890 10782 1 14 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.203 -0.339 17890 10783 1 14 . 1 1 79 79 PRO C C 79 178.175 178.175 177.974 0.201 17890 10784 1 14 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.108 0.775 17890 10785 1 14 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.685 -1.413 17890 10786 1 14 . 1 1 80 80 VAL N N 80 121.906 121.906 119.799 2.107 17890 10787 1 14 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.856 -0.275 17890 10788 1 14 . 1 1 80 80 VAL C C 80 177.751 177.751 176.701 1.050 17890 10789 1 14 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.670 1.397 17890 10790 1 14 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.097 0.388 17890 10791 1 14 . 1 1 80 80 VAL H H 80 7.328 7.328 7.860 -0.532 17890 10792 1 14 . 1 1 81 81 GLY N N 81 104.643 104.643 106.954 -2.311 17890 10793 1 14 . 1 1 81 81 GLY C C 81 174.979 174.979 174.840 0.139 17890 10794 1 14 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.036 0.052 17890 10795 1 14 . 1 1 81 81 GLY H H 81 8.949 8.949 8.314 0.635 17890 10796 1 14 . 1 1 82 82 SER N N 82 111.865 111.865 116.036 -4.171 17890 10797 1 14 . 1 1 82 82 SER HA H 82 4.646 4.646 4.920 -0.274 17890 10798 1 14 . 1 1 82 82 SER CA C 82 55.441 55.441 56.553 -1.112 17890 10799 1 14 . 1 1 82 82 SER CB C 82 62.277 62.277 63.808 -1.531 17890 10800 1 14 . 1 1 82 82 SER H H 82 6.968 6.968 7.227 -0.259 17890 10801 1 14 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.640 -0.293 17890 10802 1 14 . 1 1 83 83 PRO C C 83 176.660 176.660 176.594 0.066 17890 10803 1 14 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.526 0.677 17890 10804 1 14 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.811 1.008 17890 10805 1 14 . 1 1 84 84 ASN N N 84 116.542 116.542 113.805 2.737 17890 10806 1 14 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.596 0.405 17890 10807 1 14 . 1 1 84 84 ASN C C 84 175.825 175.825 174.926 0.899 17890 10808 1 14 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.732 -0.841 17890 10809 1 14 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.003 0.741 17890 10810 1 14 . 1 1 84 84 ASN H H 84 8.502 8.502 8.261 0.241 17890 10811 1 14 . 1 1 85 85 SER N N 85 114.633 114.633 112.709 1.924 17890 10812 1 14 . 1 1 85 85 SER HA H 85 4.624 4.624 4.905 -0.281 17890 10813 1 14 . 1 1 85 85 SER C C 85 172.963 172.963 172.579 0.384 17890 10814 1 14 . 1 1 85 85 SER CA C 85 59.210 59.210 57.238 1.972 17890 10815 1 14 . 1 1 85 85 SER CB C 85 64.697 64.697 66.168 -1.470 17890 10816 1 14 . 1 1 85 85 SER H H 85 7.980 7.980 7.788 0.192 17890 10817 1 14 . 1 1 86 86 GLN N N 86 119.016 119.016 117.288 1.728 17890 10818 1 14 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.547 -0.101 17890 10819 1 14 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.637 -0.185 17890 10820 1 14 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.469 -0.071 17890 10821 1 14 . 1 1 86 86 GLN H H 86 9.399 9.399 9.054 0.345 17890 10822 1 14 . 1 1 87 87 ILE N N 87 119.691 119.691 119.404 0.287 17890 10823 1 14 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.175 -0.600 17890 10824 1 14 . 1 1 87 87 ILE C C 87 176.505 176.505 176.146 0.359 17890 10825 1 14 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.897 4.597 17890 10826 1 14 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.728 -0.531 17890 10827 1 14 . 1 1 87 87 ILE H H 87 8.970 8.970 8.277 0.693 17890 10828 1 14 . 1 1 88 88 GLY N N 88 118.378 118.378 114.761 3.617 17890 10829 1 14 . 1 1 88 88 GLY C C 88 171.397 171.397 171.645 -0.248 17890 10830 1 14 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.924 -1.320 17890 10831 1 14 . 1 1 88 88 GLY H H 88 9.752 9.752 9.107 0.645 17890 10832 1 14 . 1 1 89 89 TRP N N 89 122.749 122.749 122.137 0.612 17890 10833 1 14 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.451 -0.853 17890 10834 1 14 . 1 1 89 89 TRP C C 89 175.924 175.924 174.864 1.060 17890 10835 1 14 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.756 0.527 17890 10836 1 14 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.247 -2.161 17890 10837 1 14 . 1 1 89 89 TRP H H 89 8.215 8.215 8.201 0.014 17890 10838 1 14 . 1 1 90 90 GLY N N 90 116.305 116.305 111.585 4.720 17890 10839 1 14 . 1 1 90 90 GLY C C 90 173.725 173.725 172.502 1.223 17890 10840 1 14 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.490 0.565 17890 10841 1 14 . 1 1 90 90 GLY H H 90 8.922 8.922 8.279 0.643 17890 10842 1 14 . 1 1 91 91 ALA N N 91 123.795 123.795 122.074 1.721 17890 10843 1 14 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.157 0.086 17890 10844 1 14 . 1 1 91 91 ALA C C 91 178.510 178.510 178.962 -0.452 17890 10845 1 14 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.427 0.063 17890 10846 1 14 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.830 -0.421 17890 10847 1 14 . 1 1 91 91 ALA H H 91 8.367 8.367 8.172 0.195 17890 10848 1 14 . 1 1 92 92 GLY N N 92 108.871 108.871 112.581 -3.710 17890 10849 1 14 . 1 1 92 92 GLY C C 92 174.528 174.528 174.836 -0.308 17890 10850 1 14 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.759 0.499 17890 10851 1 14 . 1 1 92 92 GLY H H 92 8.776 8.776 8.619 0.157 17890 10852 1 14 . 1 1 93 93 ASN N N 93 114.921 114.921 117.235 -2.314 17890 10853 1 14 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.771 -0.322 17890 10854 1 14 . 1 1 93 93 ASN C C 93 172.774 172.774 174.047 -1.273 17890 10855 1 14 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.392 0.581 17890 10856 1 14 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.968 -0.639 17890 10857 1 14 . 1 1 93 93 ASN H H 93 8.647 8.647 8.272 0.375 17890 10858 1 14 . 1 1 94 94 VAL N N 94 112.437 112.437 112.720 -0.283 17890 10859 1 14 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.622 0.443 17890 10860 1 14 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.323 -1.408 17890 10861 1 14 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.242 -0.087 17890 10862 1 14 . 1 1 94 94 VAL H H 94 6.989 6.989 7.447 -0.458 17890 10863 1 14 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.977 -0.049 17890 10864 1 14 . 1 1 95 95 PRO C C 95 176.041 176.041 176.095 -0.054 17890 10865 1 14 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.400 -1.199 17890 10866 1 14 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.479 -0.754 17890 10867 1 14 . 1 1 96 96 VAL N N 96 113.564 113.564 117.564 -4.000 17890 10868 1 14 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.864 -0.129 17890 10869 1 14 . 1 1 96 96 VAL C C 96 173.656 173.656 175.031 -1.375 17890 10870 1 14 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.599 -0.746 17890 10871 1 14 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.482 1.671 17890 10872 1 14 . 1 1 96 96 VAL H H 96 8.199 8.199 8.860 -0.661 17890 10873 1 14 . 1 1 97 97 VAL N N 97 122.328 122.328 123.219 -0.891 17890 10874 1 14 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.680 -0.049 17890 10875 1 14 . 1 1 97 97 VAL C C 97 174.776 174.776 175.515 -0.739 17890 10876 1 14 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.175 0.482 17890 10877 1 14 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.994 -0.866 17890 10878 1 14 . 1 1 97 97 VAL H H 97 8.957 8.957 8.217 0.740 17890 10879 1 14 . 1 1 98 98 LEU N N 98 130.258 130.258 126.336 3.922 17890 10880 1 14 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.993 0.057 17890 10881 1 14 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.675 1.148 17890 10882 1 14 . 1 1 98 98 LEU CB C 98 46.118 46.118 44.859 1.259 17890 10883 1 14 . 1 1 98 98 LEU H H 98 9.245 9.245 9.202 0.043 17890 10884 1 14 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.697 0.082 17890 10885 1 14 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.688 -0.199 17890 10886 1 14 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.068 -0.614 17890 10887 1 14 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.478 -0.493 17890 10888 1 14 . 1 1 100 100 PRO C C 100 177.309 177.309 175.783 1.526 17890 10889 1 14 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.053 0.770 17890 10890 1 14 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.267 -0.162 17890 10891 1 14 . 1 1 101 101 ASN N N 101 119.284 119.284 124.779 -5.495 17890 10892 1 14 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.645 -0.103 17890 10893 1 14 . 1 1 101 101 ASN C C 101 171.920 171.920 173.827 -1.907 17890 10894 1 14 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.425 -0.225 17890 10895 1 14 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.658 -2.033 17890 10896 1 14 . 1 1 101 101 ASN H H 101 7.273 7.273 9.295 -2.022 17890 10897 1 14 . 1 1 102 102 ASN N N 102 115.674 115.674 117.686 -2.012 17890 10898 1 14 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.775 -0.857 17890 10899 1 14 . 1 1 102 102 ASN C C 102 173.264 173.264 173.860 -0.596 17890 10900 1 14 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.753 1.286 17890 10901 1 14 . 1 1 102 102 ASN CB C 102 36.982 36.982 40.000 -3.018 17890 10902 1 14 . 1 1 102 102 ASN H H 102 8.197 8.197 7.734 0.463 17890 10903 1 14 . 1 1 103 103 TYR N N 103 118.775 118.775 120.539 -1.764 17890 10904 1 14 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.290 0.195 17890 10905 1 14 . 1 1 103 103 TYR C C 103 175.248 175.248 175.022 0.226 17890 10906 1 14 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.714 -2.224 17890 10907 1 14 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.448 -0.916 17890 10908 1 14 . 1 1 103 103 TYR H H 103 7.745 7.745 7.485 0.260 17890 10909 1 14 . 1 1 104 104 VAL N N 104 116.205 116.205 114.794 1.411 17890 10910 1 14 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.984 -0.007 17890 10911 1 14 . 1 1 104 104 VAL C C 104 174.361 174.361 173.723 0.638 17890 10912 1 14 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.701 -1.450 17890 10913 1 14 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.689 -0.146 17890 10914 1 14 . 1 1 104 104 VAL H H 104 7.498 7.498 7.918 -0.420 17890 10915 1 14 . 1 1 105 105 TRP N N 105 119.557 119.557 119.705 -0.148 17890 10916 1 14 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.119 -0.244 17890 10917 1 14 . 1 1 105 105 TRP C C 105 175.526 175.526 176.020 -0.494 17890 10918 1 14 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.466 -0.582 17890 10919 1 14 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.722 -0.183 17890 10920 1 14 . 1 1 105 105 TRP H H 105 8.926 8.926 8.959 -0.033 17890 10921 1 14 . 1 1 106 106 THR N N 106 120.480 120.480 119.025 1.455 17890 10922 1 14 . 1 1 106 106 THR HA H 106 4.966 4.966 4.905 0.061 17890 10923 1 14 . 1 1 106 106 THR C C 106 174.177 174.177 174.450 -0.273 17890 10924 1 14 . 1 1 106 106 THR CA C 106 62.091 62.091 64.030 -1.939 17890 10925 1 14 . 1 1 106 106 THR CB C 106 69.649 69.649 69.381 0.268 17890 10926 1 14 . 1 1 106 106 THR H H 106 9.525 9.525 9.245 0.280 17890 10927 1 14 . 1 1 107 107 LEU N N 107 127.146 127.146 128.811 -1.665 17890 10928 1 14 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.005 -0.178 17890 10929 1 14 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.213 0.496 17890 10930 1 14 . 1 1 107 107 LEU CB C 107 41.523 41.523 40.439 1.084 17890 10931 1 14 . 1 1 107 107 LEU H H 107 7.591 7.591 8.671 -1.080 17890 10932 1 14 . 1 1 108 108 THR N N 108 119.928 119.928 119.892 0.036 17890 10933 1 14 . 1 1 108 108 THR HA H 108 4.411 4.411 4.311 0.100 17890 10934 1 14 . 1 1 108 108 THR C C 108 173.319 173.319 173.591 -0.272 17890 10935 1 14 . 1 1 108 108 THR CA C 108 62.243 62.243 62.873 -0.630 17890 10936 1 14 . 1 1 108 108 THR CB C 108 70.138 70.138 69.269 0.869 17890 10937 1 14 . 1 1 108 108 THR H H 108 8.141 8.141 8.037 0.104 17890 10938 1 14 . 1 1 109 109 LEU N N 109 130.557 130.557 130.793 -0.236 17890 10939 1 14 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.990 -0.445 17890 10940 1 14 . 1 1 109 109 LEU C C 109 175.217 175.217 176.459 -1.242 17890 10941 1 14 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.414 -0.128 17890 10942 1 14 . 1 1 109 109 LEU CB C 109 40.606 40.606 43.155 -2.549 17890 10943 1 14 . 1 1 109 109 LEU H H 109 8.924 8.924 8.710 0.214 17890 10944 1 14 . 1 1 110 110 THR N N 110 120.160 120.160 116.684 3.476 17890 10945 1 14 . 1 1 110 110 THR HA H 110 4.911 4.911 4.564 0.347 17890 10946 1 14 . 1 1 110 110 THR CA C 110 60.141 60.141 60.500 -0.359 17890 10947 1 14 . 1 1 110 110 THR CB C 110 72.785 72.785 70.656 2.129 17890 10948 1 14 . 1 1 110 110 THR H H 110 7.677 7.677 8.577 -0.900 17890 10949 1 14 . 1 1 111 111 SER HA H 111 4.204 4.204 4.231 -0.027 17890 10950 1 14 . 1 1 111 111 SER C C 111 174.755 174.755 174.669 0.086 17890 10951 1 14 . 1 1 111 111 SER CA C 111 60.710 60.710 60.090 0.620 17890 10952 1 14 . 1 1 111 111 SER CB C 111 62.660 62.660 62.906 -0.246 17890 10953 1 14 . 1 1 112 112 GLY N N 112 107.313 107.313 104.865 2.448 17890 10954 1 14 . 1 1 112 112 GLY C C 112 173.023 173.023 172.612 0.411 17890 10955 1 14 . 1 1 112 112 GLY CA C 112 44.150 44.150 44.867 -0.717 17890 10956 1 14 . 1 1 112 112 GLY H H 112 8.249 8.249 7.306 0.943 17890 10957 1 14 . 1 1 113 113 GLY N N 113 105.618 105.618 107.264 -1.646 17890 10958 1 14 . 1 1 113 113 GLY C C 113 175.844 175.844 171.809 4.035 17890 10959 1 14 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.762 -3.003 17890 10960 1 14 . 1 1 113 113 GLY H H 113 7.444 7.444 7.214 0.230 17890 10961 1 14 . 1 1 114 114 TYR N N 114 121.548 121.548 117.270 4.278 17890 10962 1 14 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.458 -0.606 17890 10963 1 14 . 1 1 114 114 TYR C C 114 175.605 175.605 174.148 1.457 17890 10964 1 14 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.738 4.525 17890 10965 1 14 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.600 -4.667 17890 10966 1 14 . 1 1 114 114 TYR H H 114 9.677 9.677 8.947 0.730 17890 10967 1 14 . 1 1 115 115 ASN N N 115 123.274 123.274 117.148 6.126 17890 10968 1 14 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.211 -0.113 17890 10969 1 14 . 1 1 115 115 ASN C C 115 174.355 174.355 173.318 1.037 17890 10970 1 14 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.128 -1.082 17890 10971 1 14 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.849 -2.500 17890 10972 1 14 . 1 1 115 115 ASN H H 115 9.350 9.350 8.984 0.366 17890 10973 1 14 . 1 1 116 116 ILE N N 116 130.611 130.611 122.525 8.086 17890 10974 1 14 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.667 -0.428 17890 10975 1 14 . 1 1 116 116 ILE C C 116 173.998 173.998 173.966 0.032 17890 10976 1 14 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.950 2.249 17890 10977 1 14 . 1 1 116 116 ILE CB C 116 37.100 37.100 38.767 -1.667 17890 10978 1 14 . 1 1 116 116 ILE H H 116 9.473 9.473 8.383 1.090 17890 10979 1 14 . 1 1 117 117 GLN N N 117 121.633 121.633 125.174 -3.541 17890 10980 1 14 . 1 1 117 117 GLN HA H 117 5.935 5.935 4.972 0.963 17890 10981 1 14 . 1 1 117 117 GLN C C 117 177.902 177.902 175.978 1.924 17890 10982 1 14 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.889 -0.569 17890 10983 1 14 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.490 3.967 17890 10984 1 14 . 1 1 117 117 GLN H H 117 8.781 8.781 8.055 0.726 17890 10985 1 14 . 1 1 118 118 ASP N N 118 116.836 116.836 120.639 -3.803 17890 10986 1 14 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.969 0.814 17890 10987 1 14 . 1 1 118 118 ASP C C 118 178.084 178.084 177.033 1.051 17890 10988 1 14 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.383 -1.613 17890 10989 1 14 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.147 -0.779 17890 10990 1 14 . 1 1 118 118 ASP H H 118 9.330 9.330 8.890 0.440 17890 10991 1 14 . 1 1 119 119 GLY N N 119 111.037 111.037 108.232 2.805 17890 10992 1 14 . 1 1 119 119 GLY C C 119 174.196 174.196 175.468 -1.272 17890 10993 1 14 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.126 1.850 17890 10994 1 14 . 1 1 119 119 GLY H H 119 8.986 8.986 8.434 0.552 17890 10995 1 14 . 1 1 120 120 LYS N N 120 114.809 114.809 122.998 -8.189 17890 10996 1 14 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.438 -0.089 17890 10997 1 14 . 1 1 120 120 LYS C C 120 175.174 175.174 176.550 -1.376 17890 10998 1 14 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.207 0.726 17890 10999 1 14 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.378 0.098 17890 11000 1 14 . 1 1 120 120 LYS H H 120 7.045 7.045 8.704 -1.659 17890 11001 1 14 . 1 1 121 121 ARG N N 121 116.291 116.291 113.890 2.401 17890 11002 1 14 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.074 -0.488 17890 11003 1 14 . 1 1 121 121 ARG C C 121 175.097 175.097 177.247 -2.150 17890 11004 1 14 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.858 1.211 17890 11005 1 14 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.758 -0.135 17890 11006 1 14 . 1 1 121 121 ARG H H 121 7.683 7.683 7.929 -0.246 17890 11007 1 14 . 1 1 122 122 THR N N 122 113.730 113.730 109.468 4.262 17890 11008 1 14 . 1 1 122 122 THR HA H 122 4.540 4.540 4.181 0.359 17890 11009 1 14 . 1 1 122 122 THR C C 122 175.302 175.302 174.580 0.722 17890 11010 1 14 . 1 1 122 122 THR CA C 122 62.871 62.871 64.410 -1.539 17890 11011 1 14 . 1 1 122 122 THR CB C 122 71.552 71.552 69.850 1.702 17890 11012 1 14 . 1 1 122 122 THR H H 122 11.059 11.059 8.041 3.018 17890 11013 1 14 . 1 1 123 123 VAL N N 123 118.350 118.350 114.097 4.253 17890 11014 1 14 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.786 0.024 17890 11015 1 14 . 1 1 123 123 VAL C C 123 174.730 174.730 173.297 1.433 17890 11016 1 14 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.853 0.458 17890 11017 1 14 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.889 2.193 17890 11018 1 14 . 1 1 123 123 VAL H H 123 8.181 8.181 7.437 0.744 17890 11019 1 14 . 1 1 124 124 SER N N 124 113.053 113.053 113.823 -0.770 17890 11020 1 14 . 1 1 124 124 SER HA H 124 5.820 5.820 5.149 0.671 17890 11021 1 14 . 1 1 124 124 SER C C 124 175.521 175.521 173.509 2.012 17890 11022 1 14 . 1 1 124 124 SER CA C 124 58.087 58.087 56.359 1.728 17890 11023 1 14 . 1 1 124 124 SER CB C 124 67.405 67.405 65.612 1.794 17890 11024 1 14 . 1 1 124 124 SER H H 124 9.138 9.138 8.547 0.591 17890 11025 1 14 . 1 1 125 125 TRP N N 125 124.900 124.900 123.712 1.188 17890 11026 1 14 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.027 0.583 17890 11027 1 14 . 1 1 125 125 TRP C C 125 178.114 178.114 177.339 0.775 17890 11028 1 14 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.183 -0.709 17890 11029 1 14 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.898 1.125 17890 11030 1 14 . 1 1 125 125 TRP H H 125 8.843 8.843 8.202 0.641 17890 11031 1 14 . 1 1 126 126 SER N N 126 119.243 119.243 114.635 4.608 17890 11032 1 14 . 1 1 126 126 SER HA H 126 5.443 5.443 5.379 0.064 17890 11033 1 14 . 1 1 126 126 SER C C 126 171.668 171.668 172.951 -1.283 17890 11034 1 14 . 1 1 126 126 SER CA C 126 58.696 58.696 57.056 1.640 17890 11035 1 14 . 1 1 126 126 SER CB C 126 66.176 66.176 66.362 -0.186 17890 11036 1 14 . 1 1 126 126 SER H H 126 9.835 9.835 9.206 0.629 17890 11037 1 14 . 1 1 127 127 LEU N N 127 113.708 113.708 117.737 -4.029 17890 11038 1 14 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.659 0.496 17890 11039 1 14 . 1 1 127 127 LEU C C 127 176.563 176.563 176.641 -0.078 17890 11040 1 14 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.337 -0.692 17890 11041 1 14 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.085 -1.389 17890 11042 1 14 . 1 1 127 127 LEU H H 127 6.559 6.559 8.234 -1.675 17890 11043 1 14 . 1 1 128 128 ASN N N 128 121.739 121.739 118.059 3.680 17890 11044 1 14 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.929 -0.240 17890 11045 1 14 . 1 1 128 128 ASN C C 128 175.452 175.452 175.360 0.092 17890 11046 1 14 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.763 1.244 17890 11047 1 14 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.461 -1.170 17890 11048 1 14 . 1 1 128 128 ASN H H 128 8.662 8.662 9.341 -0.679 17890 11049 1 14 . 1 1 129 129 ASN N N 129 119.586 119.586 116.416 3.170 17890 11050 1 14 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.926 0.071 17890 11051 1 14 . 1 1 129 129 ASN C C 129 175.900 175.900 174.808 1.092 17890 11052 1 14 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.438 0.796 17890 11053 1 14 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.120 0.136 17890 11054 1 14 . 1 1 129 129 ASN H H 129 10.962 10.962 8.804 2.158 17890 11055 1 14 . 1 1 130 130 ALA N N 130 128.292 128.292 122.506 5.786 17890 11056 1 14 . 1 1 130 130 ALA HA H 130 3.570 3.570 3.973 -0.403 17890 11057 1 14 . 1 1 130 130 ALA C C 130 172.620 172.620 176.288 -3.668 17890 11058 1 14 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.460 -0.821 17890 11059 1 14 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.210 -1.110 17890 11060 1 14 . 1 1 130 130 ALA H H 130 10.629 10.629 8.500 2.129 17890 11061 1 14 . 1 1 131 131 THR N N 131 105.584 105.584 111.002 -5.418 17890 11062 1 14 . 1 1 131 131 THR HA H 131 4.462 4.462 4.307 0.155 17890 11063 1 14 . 1 1 131 131 THR C C 131 173.552 173.552 174.460 -0.908 17890 11064 1 14 . 1 1 131 131 THR CA C 131 58.338 58.338 61.301 -2.963 17890 11065 1 14 . 1 1 131 131 THR CB C 131 71.569 71.569 70.169 1.400 17890 11066 1 14 . 1 1 131 131 THR H H 131 7.092 7.092 7.510 -0.418 17890 11067 1 14 . 1 1 132 132 ALA N N 132 121.773 121.773 122.951 -1.178 17890 11068 1 14 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.071 -0.322 17890 11069 1 14 . 1 1 132 132 ALA C C 132 178.819 178.819 178.577 0.242 17890 11070 1 14 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.766 1.518 17890 11071 1 14 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.791 -0.564 17890 11072 1 14 . 1 1 132 132 ALA H H 132 8.952 8.952 8.310 0.642 17890 11073 1 14 . 1 1 133 133 GLY N N 133 113.965 113.965 111.798 2.167 17890 11074 1 14 . 1 1 133 133 GLY C C 133 173.453 173.453 174.193 -0.740 17890 11075 1 14 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.913 0.254 17890 11076 1 14 . 1 1 133 133 GLY H H 133 9.016 9.016 8.753 0.263 17890 11077 1 14 . 1 1 134 134 GLU N N 134 123.460 123.460 121.327 2.133 17890 11078 1 14 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.320 -0.362 17890 11079 1 14 . 1 1 134 134 GLU C C 134 176.120 176.120 176.213 -0.093 17890 11080 1 14 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.871 1.528 17890 11081 1 14 . 1 1 134 134 GLU CB C 134 31.385 31.385 31.042 0.343 17890 11082 1 14 . 1 1 134 134 GLU H H 134 7.598 7.598 7.579 0.019 17890 11083 1 14 . 1 1 135 135 GLU N N 135 122.633 122.633 126.106 -3.473 17890 11084 1 14 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.248 0.063 17890 11085 1 14 . 1 1 135 135 GLU C C 135 176.014 176.014 176.365 -0.351 17890 11086 1 14 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.078 0.104 17890 11087 1 14 . 1 1 135 135 GLU CB C 135 29.453 29.453 29.901 -0.448 17890 11088 1 14 . 1 1 135 135 GLU H H 135 8.258 8.258 8.607 -0.349 17890 11089 1 14 . 1 1 136 136 VAL N N 136 123.635 123.635 126.186 -2.551 17890 11090 1 14 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.808 -0.116 17890 11091 1 14 . 1 1 136 136 VAL C C 136 173.932 173.932 174.759 -0.827 17890 11092 1 14 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.557 0.275 17890 11093 1 14 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.404 -0.540 17890 11094 1 14 . 1 1 136 136 VAL H H 136 7.267 7.267 8.312 -1.045 17890 11095 1 14 . 1 1 137 137 SER N N 137 118.950 118.950 121.083 -2.133 17890 11096 1 14 . 1 1 137 137 SER HA H 137 4.887 4.887 4.838 0.049 17890 11097 1 14 . 1 1 137 137 SER C C 137 173.780 173.780 172.884 0.896 17890 11098 1 14 . 1 1 137 137 SER CA C 137 57.895 57.895 56.292 1.603 17890 11099 1 14 . 1 1 137 137 SER CB C 137 65.027 65.027 65.471 -0.444 17890 11100 1 14 . 1 1 137 137 SER H H 137 8.454 8.454 8.627 -0.173 17890 11101 1 14 . 1 1 138 138 ILE N N 138 123.511 123.511 120.259 3.252 17890 11102 1 14 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.065 -0.817 17890 11103 1 14 . 1 1 138 138 ILE C C 138 176.142 176.142 175.348 0.794 17890 11104 1 14 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.492 1.358 17890 11105 1 14 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.643 -3.048 17890 11106 1 14 . 1 1 138 138 ILE H H 138 7.915 7.915 8.261 -0.346 17890 11107 1 14 . 1 1 139 139 GLY N N 139 115.638 115.638 111.298 4.340 17890 11108 1 14 . 1 1 139 139 GLY C C 139 171.947 171.947 172.169 -0.222 17890 11109 1 14 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.216 1.870 17890 11110 1 14 . 1 1 139 139 GLY H H 139 8.490 8.490 8.293 0.197 17890 11111 1 14 . 1 1 140 140 ALA N N 140 128.563 128.563 121.335 7.228 17890 11112 1 14 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.269 0.127 17890 11113 1 14 . 1 1 140 140 ALA C C 140 177.956 177.956 177.061 0.895 17890 11114 1 14 . 1 1 140 140 ALA CA C 140 52.646 52.646 52.527 0.119 17890 11115 1 14 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.331 -0.127 17890 11116 1 14 . 1 1 140 140 ALA H H 140 8.531 8.531 8.148 0.383 17890 11117 1 14 . 1 1 141 141 ASP N N 141 120.886 120.886 120.425 0.461 17890 11118 1 14 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.427 0.171 17890 11119 1 14 . 1 1 141 141 ASP C C 141 175.411 175.411 176.203 -0.792 17890 11120 1 14 . 1 1 141 141 ASP CA C 141 53.916 53.916 55.004 -1.088 17890 11121 1 14 . 1 1 141 141 ASP CB C 141 40.692 40.692 40.975 -0.283 17890 11122 1 14 . 1 1 141 141 ASP H H 141 8.507 8.507 8.302 0.205 17890 11123 1 14 . 1 1 142 142 ALA N N 142 125.604 125.604 128.200 -2.596 17890 11124 1 14 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.343 0.174 17890 11125 1 14 . 1 1 142 142 ALA C C 142 177.671 177.671 177.500 0.171 17890 11126 1 14 . 1 1 142 142 ALA CA C 142 51.993 51.993 52.311 -0.318 17890 11127 1 14 . 1 1 142 142 ALA CB C 142 21.535 21.535 20.081 1.454 17890 11128 1 14 . 1 1 142 142 ALA H H 142 7.894 7.894 8.435 -0.541 17890 11129 1 14 . 1 1 143 143 THR N N 143 118.085 118.085 113.640 4.445 17890 11130 1 14 . 1 1 143 143 THR HA H 143 3.744 3.744 4.411 -0.667 17890 11131 1 14 . 1 1 143 143 THR C C 143 175.464 175.464 174.669 0.795 17890 11132 1 14 . 1 1 143 143 THR CA C 143 64.548 64.548 63.409 1.139 17890 11133 1 14 . 1 1 143 143 THR CB C 143 69.305 69.305 68.865 0.440 17890 11134 1 14 . 1 1 143 143 THR H H 143 8.268 8.268 8.808 -0.540 17890 11135 1 14 . 1 1 144 144 PHE N N 144 118.635 118.635 118.256 0.379 17890 11136 1 14 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.721 -0.375 17890 11137 1 14 . 1 1 144 144 PHE C C 144 176.209 176.209 175.182 1.027 17890 11138 1 14 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.489 3.973 17890 11139 1 14 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.515 0.089 17890 11140 1 14 . 1 1 144 144 PHE H H 144 8.719 8.719 7.823 0.896 17890 11141 1 14 . 1 1 145 145 SER N N 145 113.446 113.446 116.661 -3.215 17890 11142 1 14 . 1 1 145 145 SER HA H 145 4.866 4.866 4.196 0.670 17890 11143 1 14 . 1 1 145 145 SER C C 145 176.605 176.605 175.866 0.739 17890 11144 1 14 . 1 1 145 145 SER CA C 145 59.432 59.432 57.499 1.933 17890 11145 1 14 . 1 1 145 145 SER CB C 145 62.167 62.167 63.189 -1.022 17890 11146 1 14 . 1 1 145 145 SER H H 145 8.657 8.657 7.291 1.366 17890 11147 1 14 . 1 1 146 146 GLY N N 146 109.277 109.277 110.088 -0.811 17890 11148 1 14 . 1 1 146 146 GLY C C 146 174.293 174.293 173.720 0.573 17890 11149 1 14 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.235 -0.295 17890 11150 1 14 . 1 1 146 146 GLY H H 146 7.467 7.467 8.201 -0.734 17890 11151 1 14 . 1 1 147 147 ARG N N 147 122.863 122.863 117.800 5.063 17890 11152 1 14 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.938 0.503 17890 11153 1 14 . 1 1 147 147 ARG C C 147 173.849 173.849 174.586 -0.737 17890 11154 1 14 . 1 1 147 147 ARG CA C 147 52.227 52.227 53.937 -1.710 17890 11155 1 14 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.239 -0.642 17890 11156 1 14 . 1 1 147 147 ARG H H 147 7.556 7.556 7.223 0.333 17890 11157 1 14 . 1 1 148 148 TRP N N 148 118.465 118.465 120.715 -2.250 17890 11158 1 14 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.060 -0.214 17890 11159 1 14 . 1 1 148 148 TRP C C 148 174.353 174.353 174.355 -0.002 17890 11160 1 14 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.865 -1.203 17890 11161 1 14 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.181 -1.182 17890 11162 1 14 . 1 1 148 148 TRP H H 148 8.709 8.709 9.336 -0.627 17890 11163 1 14 . 1 1 149 149 VAL N N 149 125.852 125.852 118.490 7.362 17890 11164 1 14 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.579 -0.436 17890 11165 1 14 . 1 1 149 149 VAL C C 149 173.613 173.613 173.144 0.469 17890 11166 1 14 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.783 1.957 17890 11167 1 14 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.370 -2.987 17890 11168 1 14 . 1 1 149 149 VAL H H 149 9.700 9.700 8.943 0.757 17890 11169 1 14 . 1 1 150 150 ILE N N 150 125.140 125.140 127.965 -2.825 17890 11170 1 14 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.081 -0.219 17890 11171 1 14 . 1 1 150 150 ILE C C 150 175.661 175.661 174.352 1.309 17890 11172 1 14 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.653 1.168 17890 11173 1 14 . 1 1 150 150 ILE CB C 150 38.820 38.820 40.020 -1.200 17890 11174 1 14 . 1 1 150 150 ILE H H 150 7.747 7.747 7.960 -0.213 17890 11175 1 14 . 1 1 151 151 GLU N N 151 126.762 126.762 126.910 -0.148 17890 11176 1 14 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.869 0.011 17890 11177 1 14 . 1 1 151 151 GLU C C 151 174.424 174.424 174.811 -0.387 17890 11178 1 14 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.025 0.771 17890 11179 1 14 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.789 0.462 17890 11180 1 14 . 1 1 151 151 GLU H H 151 8.892 8.892 8.752 0.140 17890 11181 1 14 . 1 1 152 152 LYS N N 152 126.299 126.299 122.433 3.866 17890 11182 1 14 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.811 0.050 17890 11183 1 14 . 1 1 152 152 LYS C C 152 176.282 176.282 176.634 -0.352 17890 11184 1 14 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.906 0.599 17890 11185 1 14 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.565 0.771 17890 11186 1 14 . 1 1 152 152 LYS H H 152 8.640 8.640 8.321 0.319 17890 11187 1 15 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.524 -2.230 17890 11188 1 15 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.471 0.151 17890 11189 1 15 . 1 1 8 8 HIS CA C 8 55.661 55.661 54.962 0.698 17890 11190 1 15 . 1 1 8 8 HIS CB C 8 29.880 29.880 31.652 -1.772 17890 11191 1 15 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.596 0.050 17890 11192 1 15 . 1 1 9 9 HIS CA C 9 55.684 55.684 57.217 -1.533 17890 11193 1 15 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.410 -0.579 17890 11194 1 15 . 1 1 10 10 HIS N N 10 120.811 120.811 118.325 2.486 17890 11195 1 15 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.669 0.011 17890 11196 1 15 . 1 1 10 10 HIS C C 10 174.875 174.875 173.194 1.681 17890 11197 1 15 . 1 1 10 10 HIS CA C 10 55.746 55.746 54.992 0.754 17890 11198 1 15 . 1 1 10 10 HIS CB C 10 29.889 29.889 31.238 -1.349 17890 11199 1 15 . 1 1 10 10 HIS H H 10 8.583 8.583 7.572 1.011 17890 11200 1 15 . 1 1 11 11 SER N N 11 118.009 118.009 117.602 0.407 17890 11201 1 15 . 1 1 11 11 SER HA H 11 4.424 4.424 4.332 0.092 17890 11202 1 15 . 1 1 11 11 SER C C 11 174.962 174.962 172.500 2.462 17890 11203 1 15 . 1 1 11 11 SER CA C 11 58.660 58.660 56.875 1.785 17890 11204 1 15 . 1 1 11 11 SER CB C 11 63.822 63.822 65.234 -1.413 17890 11205 1 15 . 1 1 11 11 SER H H 11 8.438 8.438 7.623 0.815 17890 11206 1 15 . 1 1 12 12 GLY N N 12 111.011 111.011 108.912 2.099 17890 11207 1 15 . 1 1 12 12 GLY C C 12 173.907 173.907 173.783 0.124 17890 11208 1 15 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.395 0.026 17890 11209 1 15 . 1 1 12 12 GLY H H 12 8.433 8.433 8.314 0.119 17890 11210 1 15 . 1 1 13 13 ASP N N 13 120.291 120.291 119.479 0.812 17890 11211 1 15 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.853 -0.191 17890 11212 1 15 . 1 1 13 13 ASP C C 13 176.115 176.115 175.756 0.359 17890 11213 1 15 . 1 1 13 13 ASP CA C 13 54.303 54.303 54.114 0.189 17890 11214 1 15 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.427 0.038 17890 11215 1 15 . 1 1 13 13 ASP H H 13 8.153 8.153 8.131 0.022 17890 11216 1 15 . 1 1 14 14 SER N N 14 116.987 116.987 115.572 1.415 17890 11217 1 15 . 1 1 14 14 SER HA H 14 4.754 4.754 4.779 -0.025 17890 11218 1 15 . 1 1 14 14 SER CA C 14 56.469 56.469 56.688 -0.219 17890 11219 1 15 . 1 1 14 14 SER CB C 14 63.553 63.553 64.726 -1.173 17890 11220 1 15 . 1 1 14 14 SER H H 14 8.210 8.210 7.596 0.614 17890 11221 1 15 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.633 -0.191 17890 11222 1 15 . 1 1 15 15 PRO C C 15 176.424 176.424 176.104 0.320 17890 11223 1 15 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.600 0.633 17890 11224 1 15 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.031 0.117 17890 11225 1 15 . 1 1 16 16 ALA N N 16 124.219 124.219 124.775 -0.556 17890 11226 1 15 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.625 -0.275 17890 11227 1 15 . 1 1 16 16 ALA C C 16 177.552 177.552 177.111 0.441 17890 11228 1 15 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.019 0.414 17890 11229 1 15 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.703 -0.384 17890 11230 1 15 . 1 1 16 16 ALA H H 16 8.284 8.284 8.241 0.043 17890 11231 1 15 . 1 1 17 17 VAL N N 17 119.504 119.504 119.914 -0.410 17890 11232 1 15 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.167 0.082 17890 11233 1 15 . 1 1 17 17 VAL C C 17 176.322 176.322 176.009 0.313 17890 11234 1 15 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.653 -0.375 17890 11235 1 15 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.342 0.615 17890 11236 1 15 . 1 1 17 17 VAL H H 17 8.046 8.046 7.833 0.213 17890 11237 1 15 . 1 1 18 18 THR N N 18 118.186 118.186 117.749 0.437 17890 11238 1 15 . 1 1 18 18 THR HA H 18 4.473 4.473 4.583 -0.110 17890 11239 1 15 . 1 1 18 18 THR C C 18 174.248 174.248 174.634 -0.386 17890 11240 1 15 . 1 1 18 18 THR CA C 18 61.565 61.565 61.235 0.330 17890 11241 1 15 . 1 1 18 18 THR CB C 18 70.165 70.165 69.459 0.706 17890 11242 1 15 . 1 1 18 18 THR H H 18 8.276 8.276 8.319 -0.043 17890 11243 1 15 . 1 1 19 19 LEU N N 19 125.265 125.265 119.636 5.629 17890 11244 1 15 . 1 1 19 19 LEU HA H 19 4.293 4.293 4.006 0.287 17890 11245 1 15 . 1 1 19 19 LEU C C 19 175.689 175.689 175.411 0.278 17890 11246 1 15 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.489 -0.062 17890 11247 1 15 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.051 2.228 17890 11248 1 15 . 1 1 19 19 LEU H H 19 8.091 8.091 8.265 -0.174 17890 11249 1 15 . 1 1 20 20 SER N N 20 114.622 114.622 114.250 0.372 17890 11250 1 15 . 1 1 20 20 SER HA H 20 4.947 4.947 4.909 0.038 17890 11251 1 15 . 1 1 20 20 SER C C 20 174.220 174.220 172.786 1.434 17890 11252 1 15 . 1 1 20 20 SER CA C 20 56.583 56.583 57.311 -0.728 17890 11253 1 15 . 1 1 20 20 SER CB C 20 65.653 65.653 64.707 0.946 17890 11254 1 15 . 1 1 20 20 SER H H 20 7.316 7.316 8.016 -0.700 17890 11255 1 15 . 1 1 21 21 ALA N N 21 125.517 125.517 123.275 2.242 17890 11256 1 15 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.956 -0.288 17890 11257 1 15 . 1 1 21 21 ALA C C 21 177.960 177.960 177.715 0.245 17890 11258 1 15 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.439 1.571 17890 11259 1 15 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.623 -0.398 17890 11260 1 15 . 1 1 21 21 ALA H H 21 8.993 8.993 8.503 0.490 17890 11261 1 15 . 1 1 22 22 GLY N N 22 109.543 109.543 110.936 -1.393 17890 11262 1 15 . 1 1 22 22 GLY C C 22 170.422 170.422 171.942 -1.520 17890 11263 1 15 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.238 0.143 17890 11264 1 15 . 1 1 22 22 GLY H H 22 8.411 8.411 9.028 -0.617 17890 11265 1 15 . 1 1 23 23 ASN N N 23 119.649 119.649 119.185 0.464 17890 11266 1 15 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.651 0.236 17890 11267 1 15 . 1 1 23 23 ASN C C 23 175.207 175.207 174.600 0.607 17890 11268 1 15 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.724 -0.903 17890 11269 1 15 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.312 -0.557 17890 11270 1 15 . 1 1 23 23 ASN H H 23 8.092 8.092 8.419 -0.327 17890 11271 1 15 . 1 1 24 24 TYR N N 24 120.889 120.889 121.725 -0.836 17890 11272 1 15 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.149 0.106 17890 11273 1 15 . 1 1 24 24 TYR C C 24 175.667 175.667 174.482 1.185 17890 11274 1 15 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.227 0.886 17890 11275 1 15 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.658 0.168 17890 11276 1 15 . 1 1 24 24 TYR H H 24 9.914 9.914 9.006 0.908 17890 11277 1 15 . 1 1 25 25 ILE N N 25 115.978 115.978 113.849 2.129 17890 11278 1 15 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.018 0.068 17890 11279 1 15 . 1 1 25 25 ILE C C 25 175.200 175.200 174.084 1.116 17890 11280 1 15 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.740 0.805 17890 11281 1 15 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.476 -0.354 17890 11282 1 15 . 1 1 25 25 ILE H H 25 9.216 9.216 9.263 -0.047 17890 11283 1 15 . 1 1 26 26 ILE N N 26 123.957 123.957 122.978 0.979 17890 11284 1 15 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.310 -0.334 17890 11285 1 15 . 1 1 26 26 ILE C C 26 174.810 174.810 174.994 -0.184 17890 11286 1 15 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.189 0.420 17890 11287 1 15 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.223 0.899 17890 11288 1 15 . 1 1 26 26 ILE H H 26 9.559 9.559 8.910 0.649 17890 11289 1 15 . 1 1 27 27 TYR N N 27 121.371 121.371 123.978 -2.607 17890 11290 1 15 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.563 0.627 17890 11291 1 15 . 1 1 27 27 TYR C C 27 173.963 173.963 173.478 0.485 17890 11292 1 15 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.951 -0.282 17890 11293 1 15 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.073 0.625 17890 11294 1 15 . 1 1 27 27 TYR H H 27 9.378 9.378 8.982 0.396 17890 11295 1 15 . 1 1 28 28 ASN N N 28 121.991 121.991 119.967 2.024 17890 11296 1 15 . 1 1 28 28 ASN HA H 28 3.768 3.768 3.908 -0.140 17890 11297 1 15 . 1 1 28 28 ASN C C 28 174.352 174.352 176.095 -1.743 17890 11298 1 15 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.393 1.727 17890 11299 1 15 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.846 1.600 17890 11300 1 15 . 1 1 28 28 ASN H H 28 8.466 8.466 8.457 0.009 17890 11301 1 15 . 1 1 29 29 ARG N N 29 121.103 121.103 127.661 -6.558 17890 11302 1 15 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.189 -0.328 17890 11303 1 15 . 1 1 29 29 ARG C C 29 173.635 173.635 177.420 -3.785 17890 11304 1 15 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.138 2.155 17890 11305 1 15 . 1 1 29 29 ARG CB C 29 30.399 30.399 29.784 0.615 17890 11306 1 15 . 1 1 29 29 ARG H H 29 7.756 7.756 8.376 -0.620 17890 11307 1 15 . 1 1 30 30 VAL N N 30 118.412 118.412 117.568 0.844 17890 11308 1 15 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.824 0.120 17890 11309 1 15 . 1 1 30 30 VAL C C 30 176.199 176.199 175.608 0.591 17890 11310 1 15 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.586 -1.009 17890 11311 1 15 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.351 -2.129 17890 11312 1 15 . 1 1 30 30 VAL H H 30 8.976 8.976 7.773 1.203 17890 11313 1 15 . 1 1 31 31 LEU N N 31 125.418 125.418 115.439 9.979 17890 11314 1 15 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.058 0.427 17890 11315 1 15 . 1 1 31 31 LEU C C 31 179.123 179.123 176.668 2.455 17890 11316 1 15 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.724 -1.699 17890 11317 1 15 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.318 4.263 17890 11318 1 15 . 1 1 31 31 LEU H H 31 8.856 8.856 7.510 1.346 17890 11319 1 15 . 1 1 32 32 SER N N 32 116.890 116.890 116.163 0.727 17890 11320 1 15 . 1 1 32 32 SER HA H 32 5.365 5.365 4.694 0.671 17890 11321 1 15 . 1 1 32 32 SER CA C 32 57.269 57.269 56.327 0.942 17890 11322 1 15 . 1 1 32 32 SER CB C 32 62.213 62.213 64.155 -1.942 17890 11323 1 15 . 1 1 32 32 SER H H 32 9.307 9.307 8.388 0.919 17890 11324 1 15 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.447 -0.567 17890 11325 1 15 . 1 1 33 33 PRO C C 33 175.137 175.137 177.619 -2.482 17890 11326 1 15 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.400 0.885 17890 11327 1 15 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.613 0.418 17890 11328 1 15 . 1 1 34 34 ARG N N 34 110.279 110.279 119.363 -9.084 17890 11329 1 15 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.273 0.219 17890 11330 1 15 . 1 1 34 34 ARG C C 34 176.844 176.844 177.147 -0.303 17890 11331 1 15 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.565 -1.129 17890 11332 1 15 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.290 0.294 17890 11333 1 15 . 1 1 34 34 ARG H H 34 7.257 7.257 7.794 -0.537 17890 11334 1 15 . 1 1 35 35 GLY N N 35 110.288 110.288 106.393 3.895 17890 11335 1 15 . 1 1 35 35 GLY C C 35 173.336 173.336 173.885 -0.549 17890 11336 1 15 . 1 1 35 35 GLY CA C 35 47.030 47.030 45.155 1.875 17890 11337 1 15 . 1 1 35 35 GLY H H 35 8.589 8.589 7.889 0.700 17890 11338 1 15 . 1 1 36 36 GLU N N 36 116.838 116.838 118.455 -1.617 17890 11339 1 15 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.617 -0.269 17890 11340 1 15 . 1 1 36 36 GLU C C 36 176.915 176.915 175.497 1.418 17890 11341 1 15 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.043 0.864 17890 11342 1 15 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.604 -2.189 17890 11343 1 15 . 1 1 36 36 GLU H H 36 7.769 7.769 7.790 -0.021 17890 11344 1 15 . 1 1 37 37 LYS N N 37 123.775 123.775 120.315 3.460 17890 11345 1 15 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.056 0.367 17890 11346 1 15 . 1 1 37 37 LYS C C 37 176.067 176.067 175.445 0.622 17890 11347 1 15 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.523 -0.621 17890 11348 1 15 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.719 0.955 17890 11349 1 15 . 1 1 37 37 LYS H H 37 8.667 8.667 8.620 0.047 17890 11350 1 15 . 1 1 38 38 LEU N N 38 126.658 126.658 125.549 1.109 17890 11351 1 15 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.922 -0.695 17890 11352 1 15 . 1 1 38 38 LEU C C 38 174.332 174.332 175.064 -0.732 17890 11353 1 15 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.672 -0.329 17890 11354 1 15 . 1 1 38 38 LEU CB C 38 41.651 41.651 43.208 -1.557 17890 11355 1 15 . 1 1 38 38 LEU H H 38 10.455 10.455 8.752 1.703 17890 11356 1 15 . 1 1 39 39 ALA N N 39 127.018 127.018 126.109 0.909 17890 11357 1 15 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.269 -0.040 17890 11358 1 15 . 1 1 39 39 ALA C C 39 178.694 178.694 176.208 2.486 17890 11359 1 15 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.312 -0.087 17890 11360 1 15 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.657 0.692 17890 11361 1 15 . 1 1 39 39 ALA H H 39 8.773 8.773 8.597 0.176 17890 11362 1 15 . 1 1 40 40 LEU N N 40 126.771 126.771 123.738 3.033 17890 11363 1 15 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.521 -0.167 17890 11364 1 15 . 1 1 40 40 LEU C C 40 178.309 178.309 176.583 1.726 17890 11365 1 15 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.116 0.729 17890 11366 1 15 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.930 0.393 17890 11367 1 15 . 1 1 40 40 LEU H H 40 9.665 9.665 8.744 0.921 17890 11368 1 15 . 1 1 41 41 THR N N 41 126.578 126.578 124.852 1.726 17890 11369 1 15 . 1 1 41 41 THR HA H 41 4.916 4.916 5.199 -0.283 17890 11370 1 15 . 1 1 41 41 THR C C 41 172.547 172.547 173.369 -0.822 17890 11371 1 15 . 1 1 41 41 THR CA C 41 63.253 63.253 61.461 1.792 17890 11372 1 15 . 1 1 41 41 THR CB C 41 71.832 71.832 70.645 1.187 17890 11373 1 15 . 1 1 41 41 THR H H 41 9.802 9.802 9.098 0.704 17890 11374 1 15 . 1 1 42 42 TYR N N 42 130.506 130.506 129.666 0.840 17890 11375 1 15 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.647 0.455 17890 11376 1 15 . 1 1 42 42 TYR CA C 42 53.986 53.986 58.131 -4.145 17890 11377 1 15 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.697 0.458 17890 11378 1 15 . 1 1 42 42 TYR H H 42 9.428 9.428 9.186 0.242 17890 11379 1 15 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.309 0.181 17890 11380 1 15 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.074 0.499 17890 11381 1 15 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.333 0.311 17890 11382 1 15 . 1 1 44 44 GLY N N 44 113.736 113.736 105.387 8.349 17890 11383 1 15 . 1 1 44 44 GLY C C 44 171.790 171.790 172.765 -0.975 17890 11384 1 15 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.662 1.054 17890 11385 1 15 . 1 1 44 44 GLY H H 44 8.337 8.337 7.145 1.192 17890 11386 1 15 . 1 1 45 45 ARG N N 45 113.899 113.899 116.507 -2.608 17890 11387 1 15 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.529 0.047 17890 11388 1 15 . 1 1 45 45 ARG C C 45 175.151 175.151 173.619 1.532 17890 11389 1 15 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.673 -0.508 17890 11390 1 15 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.823 1.396 17890 11391 1 15 . 1 1 45 45 ARG H H 45 6.463 6.463 7.246 -0.783 17890 11392 1 15 . 1 1 46 46 GLN N N 46 119.000 119.000 119.333 -0.333 17890 11393 1 15 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.488 -0.039 17890 11394 1 15 . 1 1 46 46 GLN C C 46 177.282 177.282 176.343 0.939 17890 11395 1 15 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.108 1.504 17890 11396 1 15 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.563 0.933 17890 11397 1 15 . 1 1 46 46 GLN H H 46 8.683 8.683 8.534 0.149 17890 11398 1 15 . 1 1 47 47 ARG N N 47 113.526 113.526 117.690 -4.164 17890 11399 1 15 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.032 -0.502 17890 11400 1 15 . 1 1 47 47 ARG C C 47 174.130 174.130 175.280 -1.150 17890 11401 1 15 . 1 1 47 47 ARG CA C 47 58.816 58.816 56.843 1.974 17890 11402 1 15 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.178 1.892 17890 11403 1 15 . 1 1 47 47 ARG H H 47 9.677 9.677 8.636 1.041 17890 11404 1 15 . 1 1 48 48 THR N N 48 114.672 114.672 115.020 -0.348 17890 11405 1 15 . 1 1 48 48 THR HA H 48 4.938 4.938 4.738 0.200 17890 11406 1 15 . 1 1 48 48 THR CA C 48 59.987 59.987 59.876 0.111 17890 11407 1 15 . 1 1 48 48 THR CB C 48 71.947 71.947 71.069 0.879 17890 11408 1 15 . 1 1 48 48 THR H H 48 8.104 8.104 7.605 0.499 17890 11409 1 15 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.672 -0.304 17890 11410 1 15 . 1 1 49 49 PRO C C 49 175.651 175.651 176.478 -0.827 17890 11411 1 15 . 1 1 49 49 PRO CA C 49 64.181 64.181 62.748 1.433 17890 11412 1 15 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.140 0.557 17890 11413 1 15 . 1 1 50 50 VAL N N 50 122.562 122.562 119.599 2.963 17890 11414 1 15 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.256 -0.309 17890 11415 1 15 . 1 1 50 50 VAL C C 50 174.493 174.493 175.936 -1.443 17890 11416 1 15 . 1 1 50 50 VAL CA C 50 63.811 63.811 60.727 3.084 17890 11417 1 15 . 1 1 50 50 VAL CB C 50 32.168 32.168 33.576 -1.408 17890 11418 1 15 . 1 1 50 50 VAL H H 50 8.123 8.123 8.245 -0.122 17890 11419 1 15 . 1 1 51 51 THR N N 51 113.549 113.549 118.205 -4.656 17890 11420 1 15 . 1 1 51 51 THR HA H 51 5.372 5.372 4.822 0.550 17890 11421 1 15 . 1 1 51 51 THR C C 51 174.841 174.841 172.686 2.155 17890 11422 1 15 . 1 1 51 51 THR CA C 51 59.196 59.196 61.130 -1.934 17890 11423 1 15 . 1 1 51 51 THR CB C 51 72.703 72.703 71.898 0.805 17890 11424 1 15 . 1 1 51 51 THR H H 51 7.057 7.057 8.231 -1.174 17890 11425 1 15 . 1 1 52 52 VAL N N 52 107.374 107.374 121.176 -13.802 17890 11426 1 15 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.053 0.461 17890 11427 1 15 . 1 1 52 52 VAL C C 52 175.697 175.697 173.984 1.713 17890 11428 1 15 . 1 1 52 52 VAL CA C 52 58.472 58.472 60.009 -1.537 17890 11429 1 15 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.934 -0.160 17890 11430 1 15 . 1 1 52 52 VAL H H 52 8.062 8.062 8.661 -0.599 17890 11431 1 15 . 1 1 53 53 SER N N 53 114.662 114.662 122.262 -7.600 17890 11432 1 15 . 1 1 53 53 SER HA H 53 4.690 4.690 4.947 -0.257 17890 11433 1 15 . 1 1 53 53 SER CA C 53 56.828 56.828 55.707 1.121 17890 11434 1 15 . 1 1 53 53 SER CB C 53 64.789 64.789 65.573 -0.784 17890 11435 1 15 . 1 1 53 53 SER H H 53 8.681 8.681 9.199 -0.518 17890 11436 1 15 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.778 -0.002 17890 11437 1 15 . 1 1 54 54 PRO C C 54 177.724 177.724 176.089 1.635 17890 11438 1 15 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.183 0.242 17890 11439 1 15 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.365 -0.268 17890 11440 1 15 . 1 1 55 55 LEU N N 55 128.655 128.655 121.463 7.192 17890 11441 1 15 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.598 -0.071 17890 11442 1 15 . 1 1 55 55 LEU C C 55 178.696 178.696 175.719 2.977 17890 11443 1 15 . 1 1 55 55 LEU CA C 55 56.246 56.246 54.171 2.075 17890 11444 1 15 . 1 1 55 55 LEU CB C 55 43.606 43.606 44.577 -0.971 17890 11445 1 15 . 1 1 55 55 LEU H H 55 8.675 8.675 7.899 0.776 17890 11446 1 15 . 1 1 56 56 ASP N N 56 126.651 126.651 124.572 2.079 17890 11447 1 15 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.832 -0.123 17890 11448 1 15 . 1 1 56 56 ASP C C 56 177.729 177.729 176.852 0.877 17890 11449 1 15 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.440 -0.817 17890 11450 1 15 . 1 1 56 56 ASP CB C 56 41.632 41.632 44.132 -2.500 17890 11451 1 15 . 1 1 56 56 ASP H H 56 9.683 9.683 9.627 0.056 17890 11452 1 15 . 1 1 57 57 GLY N N 57 109.299 109.299 108.557 0.742 17890 11453 1 15 . 1 1 57 57 GLY C C 57 174.558 174.558 174.151 0.407 17890 11454 1 15 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.935 1.020 17890 11455 1 15 . 1 1 57 57 GLY H H 57 8.157 8.157 8.585 -0.428 17890 11456 1 15 . 1 1 58 58 SER N N 58 116.740 116.740 115.851 0.889 17890 11457 1 15 . 1 1 58 58 SER HA H 58 4.288 4.288 4.472 -0.184 17890 11458 1 15 . 1 1 58 58 SER C C 58 177.252 177.252 176.265 0.987 17890 11459 1 15 . 1 1 58 58 SER CA C 58 58.737 58.737 57.309 1.428 17890 11460 1 15 . 1 1 58 58 SER CB C 58 64.576 64.576 64.216 0.360 17890 11461 1 15 . 1 1 58 58 SER H H 58 8.328 8.328 7.956 0.372 17890 11462 1 15 . 1 1 59 59 SER N N 59 119.768 119.768 120.432 -0.664 17890 11463 1 15 . 1 1 59 59 SER HA H 59 4.046 4.046 4.207 -0.161 17890 11464 1 15 . 1 1 59 59 SER C C 59 176.671 176.671 175.599 1.072 17890 11465 1 15 . 1 1 59 59 SER CA C 59 61.691 61.691 60.022 1.669 17890 11466 1 15 . 1 1 59 59 SER CB C 59 63.154 63.154 62.969 0.185 17890 11467 1 15 . 1 1 59 59 SER H H 59 9.020 9.020 8.821 0.199 17890 11468 1 15 . 1 1 60 60 GLU N N 60 119.133 119.133 120.420 -1.287 17890 11469 1 15 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.062 0.124 17890 11470 1 15 . 1 1 60 60 GLU C C 60 177.435 177.435 177.093 0.342 17890 11471 1 15 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.251 1.782 17890 11472 1 15 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.951 -1.725 17890 11473 1 15 . 1 1 60 60 GLU H H 60 8.832 8.832 7.625 1.207 17890 11474 1 15 . 1 1 61 61 GLN N N 61 118.818 118.818 113.736 5.082 17890 11475 1 15 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.033 0.144 17890 11476 1 15 . 1 1 61 61 GLN C C 61 173.254 173.254 174.945 -1.691 17890 11477 1 15 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.446 -0.073 17890 11478 1 15 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.198 -2.276 17890 11479 1 15 . 1 1 61 61 GLN H H 61 7.648 7.648 7.500 0.148 17890 11480 1 15 . 1 1 62 62 ALA N N 62 122.562 122.562 122.472 0.090 17890 11481 1 15 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.629 0.435 17890 11482 1 15 . 1 1 62 62 ALA C C 62 176.637 176.637 174.980 1.657 17890 11483 1 15 . 1 1 62 62 ALA CA C 62 51.179 51.179 50.905 0.274 17890 11484 1 15 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.675 -1.080 17890 11485 1 15 . 1 1 62 62 ALA H H 62 7.315 7.315 6.908 0.407 17890 11486 1 15 . 1 1 63 63 TRP N N 63 124.787 124.787 119.184 5.603 17890 11487 1 15 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.348 -0.384 17890 11488 1 15 . 1 1 63 63 TRP C C 63 174.351 174.351 175.317 -0.966 17890 11489 1 15 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.109 -0.207 17890 11490 1 15 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.829 -1.712 17890 11491 1 15 . 1 1 63 63 TRP H H 63 9.544 9.544 9.076 0.468 17890 11492 1 15 . 1 1 64 64 ILE N N 64 122.482 122.482 119.294 3.188 17890 11493 1 15 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.947 -0.253 17890 11494 1 15 . 1 1 64 64 ILE C C 64 177.078 177.078 174.318 2.760 17890 11495 1 15 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.596 0.435 17890 11496 1 15 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.102 -0.733 17890 11497 1 15 . 1 1 64 64 ILE H H 64 10.235 10.235 9.426 0.809 17890 11498 1 15 . 1 1 65 65 LEU N N 65 132.183 132.183 128.843 3.340 17890 11499 1 15 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.502 -0.037 17890 11500 1 15 . 1 1 65 65 LEU C C 65 177.048 177.048 174.468 2.580 17890 11501 1 15 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.793 0.556 17890 11502 1 15 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.191 -3.848 17890 11503 1 15 . 1 1 65 65 LEU H H 65 9.432 9.432 9.312 0.120 17890 11504 1 15 . 1 1 66 66 ARG N N 66 120.807 120.807 125.741 -4.934 17890 11505 1 15 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.936 -0.048 17890 11506 1 15 . 1 1 66 66 ARG C C 66 175.275 175.275 174.453 0.822 17890 11507 1 15 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.491 0.564 17890 11508 1 15 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.345 -1.354 17890 11509 1 15 . 1 1 66 66 ARG H H 66 8.491 8.491 8.570 -0.079 17890 11510 1 15 . 1 1 67 67 SER N N 67 119.709 119.709 117.799 1.910 17890 11511 1 15 . 1 1 67 67 SER HA H 67 3.186 3.186 3.467 -0.281 17890 11512 1 15 . 1 1 67 67 SER C C 67 174.508 174.508 173.647 0.861 17890 11513 1 15 . 1 1 67 67 SER CA C 67 58.521 58.521 58.858 -0.338 17890 11514 1 15 . 1 1 67 67 SER CB C 67 62.590 62.590 63.254 -0.664 17890 11515 1 15 . 1 1 67 67 SER H H 67 8.557 8.557 8.686 -0.129 17890 11516 1 15 . 1 1 68 68 TYR N N 68 131.011 131.011 127.591 3.420 17890 11517 1 15 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.630 -0.182 17890 11518 1 15 . 1 1 68 68 TYR C C 68 174.687 174.687 174.828 -0.141 17890 11519 1 15 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.858 0.907 17890 11520 1 15 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.760 -1.772 17890 11521 1 15 . 1 1 68 68 TYR H H 68 8.531 8.531 8.609 -0.078 17890 11522 1 15 . 1 1 69 69 ASP N N 69 117.066 117.066 119.818 -2.752 17890 11523 1 15 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.844 -0.219 17890 11524 1 15 . 1 1 69 69 ASP C C 69 176.455 176.455 176.383 0.072 17890 11525 1 15 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.797 -0.706 17890 11526 1 15 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.729 -0.582 17890 11527 1 15 . 1 1 69 69 ASP H H 69 7.122 7.122 7.537 -0.415 17890 11528 1 15 . 1 1 70 70 SER N N 70 122.869 122.869 119.829 3.040 17890 11529 1 15 . 1 1 70 70 SER HA H 70 4.270 4.270 3.942 0.328 17890 11530 1 15 . 1 1 70 70 SER C C 70 177.010 177.010 175.893 1.117 17890 11531 1 15 . 1 1 70 70 SER CA C 70 60.837 60.837 61.673 -0.836 17890 11532 1 15 . 1 1 70 70 SER CB C 70 62.722 62.722 63.385 -0.663 17890 11533 1 15 . 1 1 70 70 SER H H 70 8.757 8.757 8.756 0.001 17890 11534 1 15 . 1 1 71 71 ASN N N 71 119.873 119.873 115.571 4.302 17890 11535 1 15 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.593 -0.022 17890 11536 1 15 . 1 1 71 71 ASN C C 71 176.226 176.226 176.240 -0.014 17890 11537 1 15 . 1 1 71 71 ASN CA C 71 55.714 55.714 54.183 1.531 17890 11538 1 15 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.013 0.628 17890 11539 1 15 . 1 1 71 71 ASN H H 71 8.342 8.342 8.649 -0.307 17890 11540 1 15 . 1 1 72 72 SER N N 72 112.202 112.202 114.476 -2.274 17890 11541 1 15 . 1 1 72 72 SER HA H 72 4.567 4.567 4.684 -0.117 17890 11542 1 15 . 1 1 72 72 SER C C 72 173.789 173.789 173.504 0.285 17890 11543 1 15 . 1 1 72 72 SER CA C 72 57.816 57.816 58.078 -0.262 17890 11544 1 15 . 1 1 72 72 SER CB C 72 63.935 63.935 64.196 -0.261 17890 11545 1 15 . 1 1 72 72 SER H H 72 7.560 7.560 7.676 -0.116 17890 11546 1 15 . 1 1 73 73 ASN N N 73 117.437 117.437 117.998 -0.561 17890 11547 1 15 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.423 0.111 17890 11548 1 15 . 1 1 73 73 ASN C C 73 173.647 173.647 174.601 -0.954 17890 11549 1 15 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.311 0.212 17890 11550 1 15 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.484 -0.271 17890 11551 1 15 . 1 1 73 73 ASN H H 73 7.940 7.940 7.638 0.302 17890 11552 1 15 . 1 1 74 74 THR N N 74 104.227 104.227 109.088 -4.861 17890 11553 1 15 . 1 1 74 74 THR HA H 74 5.477 5.477 4.924 0.553 17890 11554 1 15 . 1 1 74 74 THR C C 74 176.824 176.824 173.845 2.979 17890 11555 1 15 . 1 1 74 74 THR CA C 74 59.768 59.768 61.605 -1.837 17890 11556 1 15 . 1 1 74 74 THR CB C 74 71.985 71.985 69.952 2.033 17890 11557 1 15 . 1 1 74 74 THR H H 74 7.737 7.737 7.690 0.047 17890 11558 1 15 . 1 1 75 75 TRP N N 75 124.636 124.636 122.440 2.196 17890 11559 1 15 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.342 -0.135 17890 11560 1 15 . 1 1 75 75 TRP C C 75 175.876 175.876 176.147 -0.271 17890 11561 1 15 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.290 1.316 17890 11562 1 15 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.613 -0.097 17890 11563 1 15 . 1 1 75 75 TRP H H 75 9.442 9.442 9.003 0.439 17890 11564 1 15 . 1 1 76 76 THR N N 76 110.544 110.544 114.746 -4.202 17890 11565 1 15 . 1 1 76 76 THR HA H 76 5.129 5.129 5.028 0.101 17890 11566 1 15 . 1 1 76 76 THR C C 76 174.506 174.506 174.496 0.010 17890 11567 1 15 . 1 1 76 76 THR CA C 76 60.561 60.561 61.406 -0.845 17890 11568 1 15 . 1 1 76 76 THR CB C 76 71.688 71.688 70.066 1.622 17890 11569 1 15 . 1 1 76 76 THR H H 76 9.415 9.415 9.342 0.073 17890 11570 1 15 . 1 1 77 77 ILE N N 77 121.567 121.567 124.492 -2.925 17890 11571 1 15 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.184 -0.045 17890 11572 1 15 . 1 1 77 77 ILE C C 77 176.148 176.148 174.884 1.264 17890 11573 1 15 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.815 1.893 17890 11574 1 15 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.531 1.456 17890 11575 1 15 . 1 1 77 77 ILE H H 77 9.255 9.255 8.479 0.776 17890 11576 1 15 . 1 1 78 78 SER N N 78 122.269 122.269 121.738 0.531 17890 11577 1 15 . 1 1 78 78 SER HA H 78 5.601 5.601 5.256 0.345 17890 11578 1 15 . 1 1 78 78 SER CA C 78 55.835 55.835 56.050 -0.214 17890 11579 1 15 . 1 1 78 78 SER CB C 78 65.858 65.858 66.627 -0.769 17890 11580 1 15 . 1 1 78 78 SER H H 78 9.226 9.226 8.664 0.562 17890 11581 1 15 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.256 -0.392 17890 11582 1 15 . 1 1 79 79 PRO C C 79 178.175 178.175 178.292 -0.117 17890 11583 1 15 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.044 0.841 17890 11584 1 15 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.731 -1.459 17890 11585 1 15 . 1 1 80 80 VAL N N 80 121.906 121.906 118.414 3.492 17890 11586 1 15 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.823 -0.242 17890 11587 1 15 . 1 1 80 80 VAL C C 80 177.751 177.751 176.543 1.208 17890 11588 1 15 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.575 1.492 17890 11589 1 15 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.241 0.243 17890 11590 1 15 . 1 1 80 80 VAL H H 80 7.328 7.328 8.052 -0.724 17890 11591 1 15 . 1 1 81 81 GLY N N 81 104.643 104.643 106.853 -2.210 17890 11592 1 15 . 1 1 81 81 GLY C C 81 174.979 174.979 173.974 1.005 17890 11593 1 15 . 1 1 81 81 GLY CA C 81 45.088 45.088 44.668 0.420 17890 11594 1 15 . 1 1 81 81 GLY H H 81 8.949 8.949 8.049 0.900 17890 11595 1 15 . 1 1 82 82 SER N N 82 111.865 111.865 115.778 -3.913 17890 11596 1 15 . 1 1 82 82 SER HA H 82 4.646 4.646 4.911 -0.265 17890 11597 1 15 . 1 1 82 82 SER CA C 82 55.441 55.441 55.476 -0.035 17890 11598 1 15 . 1 1 82 82 SER CB C 82 62.277 62.277 63.554 -1.277 17890 11599 1 15 . 1 1 82 82 SER H H 82 6.968 6.968 7.238 -0.270 17890 11600 1 15 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.451 -0.104 17890 11601 1 15 . 1 1 83 83 PRO C C 83 176.660 176.660 176.649 0.011 17890 11602 1 15 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.361 0.842 17890 11603 1 15 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.687 1.132 17890 11604 1 15 . 1 1 84 84 ASN N N 84 116.542 116.542 116.491 0.051 17890 11605 1 15 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.759 0.242 17890 11606 1 15 . 1 1 84 84 ASN C C 84 175.825 175.825 174.639 1.186 17890 11607 1 15 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.861 -0.970 17890 11608 1 15 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.497 0.247 17890 11609 1 15 . 1 1 84 84 ASN H H 84 8.502 8.502 8.730 -0.228 17890 11610 1 15 . 1 1 85 85 SER N N 85 114.633 114.633 113.613 1.020 17890 11611 1 15 . 1 1 85 85 SER HA H 85 4.624 4.624 5.122 -0.498 17890 11612 1 15 . 1 1 85 85 SER C C 85 172.963 172.963 172.362 0.601 17890 11613 1 15 . 1 1 85 85 SER CA C 85 59.210 59.210 57.714 1.496 17890 11614 1 15 . 1 1 85 85 SER CB C 85 64.697 64.697 67.457 -2.760 17890 11615 1 15 . 1 1 85 85 SER H H 85 7.980 7.980 7.780 0.200 17890 11616 1 15 . 1 1 86 86 GLN N N 86 119.016 119.016 119.625 -0.609 17890 11617 1 15 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.558 -0.112 17890 11618 1 15 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.659 -0.207 17890 11619 1 15 . 1 1 86 86 GLN CB C 86 34.398 34.398 33.990 0.408 17890 11620 1 15 . 1 1 86 86 GLN H H 86 9.399 9.399 9.232 0.167 17890 11621 1 15 . 1 1 87 87 ILE N N 87 119.691 119.691 120.420 -0.729 17890 11622 1 15 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.214 -0.639 17890 11623 1 15 . 1 1 87 87 ILE C C 87 176.505 176.505 175.922 0.583 17890 11624 1 15 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.751 4.743 17890 11625 1 15 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.305 -1.108 17890 11626 1 15 . 1 1 87 87 ILE H H 87 8.970 8.970 8.312 0.658 17890 11627 1 15 . 1 1 88 88 GLY N N 88 118.378 118.378 114.672 3.706 17890 11628 1 15 . 1 1 88 88 GLY C C 88 171.397 171.397 171.632 -0.235 17890 11629 1 15 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.232 -1.628 17890 11630 1 15 . 1 1 88 88 GLY H H 88 9.752 9.752 9.050 0.702 17890 11631 1 15 . 1 1 89 89 TRP N N 89 122.749 122.749 122.102 0.647 17890 11632 1 15 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.417 -0.819 17890 11633 1 15 . 1 1 89 89 TRP C C 89 175.924 175.924 174.792 1.132 17890 11634 1 15 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.893 0.390 17890 11635 1 15 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.373 -2.287 17890 11636 1 15 . 1 1 89 89 TRP H H 89 8.215 8.215 8.207 0.008 17890 11637 1 15 . 1 1 90 90 GLY N N 90 116.305 116.305 110.933 5.372 17890 11638 1 15 . 1 1 90 90 GLY C C 90 173.725 173.725 172.438 1.287 17890 11639 1 15 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.502 0.554 17890 11640 1 15 . 1 1 90 90 GLY H H 90 8.922 8.922 8.231 0.691 17890 11641 1 15 . 1 1 91 91 ALA N N 91 123.795 123.795 122.016 1.779 17890 11642 1 15 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.157 0.086 17890 11643 1 15 . 1 1 91 91 ALA C C 91 178.510 178.510 178.964 -0.454 17890 11644 1 15 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.406 0.085 17890 11645 1 15 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.823 -0.414 17890 11646 1 15 . 1 1 91 91 ALA H H 91 8.367 8.367 8.156 0.211 17890 11647 1 15 . 1 1 92 92 GLY N N 92 108.871 108.871 112.563 -3.692 17890 11648 1 15 . 1 1 92 92 GLY C C 92 174.528 174.528 174.826 -0.298 17890 11649 1 15 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.746 0.512 17890 11650 1 15 . 1 1 92 92 GLY H H 92 8.776 8.776 8.623 0.153 17890 11651 1 15 . 1 1 93 93 ASN N N 93 114.921 114.921 117.866 -2.945 17890 11652 1 15 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.809 -0.360 17890 11653 1 15 . 1 1 93 93 ASN C C 93 172.774 172.774 173.983 -1.209 17890 11654 1 15 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.452 0.521 17890 11655 1 15 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.032 -0.703 17890 11656 1 15 . 1 1 93 93 ASN H H 93 8.647 8.647 8.255 0.392 17890 11657 1 15 . 1 1 94 94 VAL N N 94 112.437 112.437 112.532 -0.095 17890 11658 1 15 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.680 0.385 17890 11659 1 15 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.350 -1.435 17890 11660 1 15 . 1 1 94 94 VAL CB C 94 34.155 34.155 34.164 -0.009 17890 11661 1 15 . 1 1 94 94 VAL H H 94 6.989 6.989 7.476 -0.487 17890 11662 1 15 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.996 -0.068 17890 11663 1 15 . 1 1 95 95 PRO C C 95 176.041 176.041 175.972 0.069 17890 11664 1 15 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.399 -1.198 17890 11665 1 15 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.865 -1.140 17890 11666 1 15 . 1 1 96 96 VAL N N 96 113.564 113.564 116.101 -2.537 17890 11667 1 15 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.855 -0.120 17890 11668 1 15 . 1 1 96 96 VAL C C 96 173.656 173.656 174.948 -1.292 17890 11669 1 15 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.140 -0.287 17890 11670 1 15 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.372 1.781 17890 11671 1 15 . 1 1 96 96 VAL H H 96 8.199 8.199 8.863 -0.664 17890 11672 1 15 . 1 1 97 97 VAL N N 97 122.328 122.328 123.453 -1.125 17890 11673 1 15 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.694 -0.063 17890 11674 1 15 . 1 1 97 97 VAL C C 97 174.776 174.776 175.802 -1.026 17890 11675 1 15 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.470 0.187 17890 11676 1 15 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.916 -0.788 17890 11677 1 15 . 1 1 97 97 VAL H H 97 8.957 8.957 8.405 0.552 17890 11678 1 15 . 1 1 98 98 LEU N N 98 130.258 130.258 125.985 4.273 17890 11679 1 15 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.992 0.058 17890 11680 1 15 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.646 1.177 17890 11681 1 15 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.275 0.843 17890 11682 1 15 . 1 1 98 98 LEU H H 98 9.245 9.245 9.183 0.062 17890 11683 1 15 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.807 -0.028 17890 11684 1 15 . 1 1 99 99 PRO CA C 99 61.489 61.489 60.919 0.570 17890 11685 1 15 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.081 -0.627 17890 11686 1 15 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.639 -0.654 17890 11687 1 15 . 1 1 100 100 PRO C C 100 177.309 177.309 175.762 1.547 17890 11688 1 15 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.016 0.808 17890 11689 1 15 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.174 -0.069 17890 11690 1 15 . 1 1 101 101 ASN N N 101 119.284 119.284 126.024 -6.740 17890 11691 1 15 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.631 -0.089 17890 11692 1 15 . 1 1 101 101 ASN C C 101 171.920 171.920 174.024 -2.104 17890 11693 1 15 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.753 -0.553 17890 11694 1 15 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.568 -1.943 17890 11695 1 15 . 1 1 101 101 ASN H H 101 7.273 7.273 9.322 -2.049 17890 11696 1 15 . 1 1 102 102 ASN N N 102 115.674 115.674 116.311 -0.637 17890 11697 1 15 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.663 -0.745 17890 11698 1 15 . 1 1 102 102 ASN C C 102 173.264 173.264 174.228 -0.964 17890 11699 1 15 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.781 1.258 17890 11700 1 15 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.320 -1.338 17890 11701 1 15 . 1 1 102 102 ASN H H 102 8.197 8.197 7.688 0.509 17890 11702 1 15 . 1 1 103 103 TYR N N 103 118.775 118.775 120.277 -1.502 17890 11703 1 15 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.363 0.122 17890 11704 1 15 . 1 1 103 103 TYR C C 103 175.248 175.248 175.181 0.067 17890 11705 1 15 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.493 -2.003 17890 11706 1 15 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.525 -0.993 17890 11707 1 15 . 1 1 103 103 TYR H H 103 7.745 7.745 7.366 0.379 17890 11708 1 15 . 1 1 104 104 VAL N N 104 116.205 116.205 115.562 0.643 17890 11709 1 15 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.913 0.064 17890 11710 1 15 . 1 1 104 104 VAL C C 104 174.361 174.361 173.725 0.636 17890 11711 1 15 . 1 1 104 104 VAL CA C 104 58.251 58.251 60.078 -1.827 17890 11712 1 15 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.559 -0.016 17890 11713 1 15 . 1 1 104 104 VAL H H 104 7.498 7.498 8.002 -0.504 17890 11714 1 15 . 1 1 105 105 TRP N N 105 119.557 119.557 120.403 -0.846 17890 11715 1 15 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.077 -0.202 17890 11716 1 15 . 1 1 105 105 TRP C C 105 175.526 175.526 176.450 -0.924 17890 11717 1 15 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.196 -0.312 17890 11718 1 15 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.364 0.175 17890 11719 1 15 . 1 1 105 105 TRP H H 105 8.926 8.926 8.862 0.064 17890 11720 1 15 . 1 1 106 106 THR N N 106 120.480 120.480 120.196 0.284 17890 11721 1 15 . 1 1 106 106 THR HA H 106 4.966 4.966 4.846 0.120 17890 11722 1 15 . 1 1 106 106 THR C C 106 174.177 174.177 173.941 0.236 17890 11723 1 15 . 1 1 106 106 THR CA C 106 62.091 62.091 64.097 -2.006 17890 11724 1 15 . 1 1 106 106 THR CB C 106 69.649 69.649 69.116 0.533 17890 11725 1 15 . 1 1 106 106 THR H H 106 9.525 9.525 9.148 0.377 17890 11726 1 15 . 1 1 107 107 LEU N N 107 127.146 127.146 129.098 -1.952 17890 11727 1 15 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.136 -0.309 17890 11728 1 15 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.471 0.238 17890 11729 1 15 . 1 1 107 107 LEU CB C 107 41.523 41.523 44.134 -2.611 17890 11730 1 15 . 1 1 107 107 LEU H H 107 7.591 7.591 8.744 -1.153 17890 11731 1 15 . 1 1 108 108 THR N N 108 119.928 119.928 120.459 -0.531 17890 11732 1 15 . 1 1 108 108 THR HA H 108 4.411 4.411 4.651 -0.240 17890 11733 1 15 . 1 1 108 108 THR C C 108 173.319 173.319 173.057 0.262 17890 11734 1 15 . 1 1 108 108 THR CA C 108 62.243 62.243 61.695 0.548 17890 11735 1 15 . 1 1 108 108 THR CB C 108 70.138 70.138 71.024 -0.886 17890 11736 1 15 . 1 1 108 108 THR H H 108 8.141 8.141 8.935 -0.794 17890 11737 1 15 . 1 1 109 109 LEU N N 109 130.557 130.557 130.105 0.452 17890 11738 1 15 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.036 -0.491 17890 11739 1 15 . 1 1 109 109 LEU C C 109 175.217 175.217 176.306 -1.089 17890 11740 1 15 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.239 0.047 17890 11741 1 15 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.987 -2.381 17890 11742 1 15 . 1 1 109 109 LEU H H 109 8.924 8.924 8.757 0.167 17890 11743 1 15 . 1 1 110 110 THR N N 110 120.160 120.160 115.489 4.671 17890 11744 1 15 . 1 1 110 110 THR HA H 110 4.911 4.911 4.731 0.180 17890 11745 1 15 . 1 1 110 110 THR CA C 110 60.141 60.141 60.393 -0.252 17890 11746 1 15 . 1 1 110 110 THR CB C 110 72.785 72.785 70.805 1.980 17890 11747 1 15 . 1 1 110 110 THR H H 110 7.677 7.677 8.535 -0.858 17890 11748 1 15 . 1 1 111 111 SER HA H 111 4.204 4.204 4.238 -0.034 17890 11749 1 15 . 1 1 111 111 SER C C 111 174.755 174.755 174.963 -0.208 17890 11750 1 15 . 1 1 111 111 SER CA C 111 60.710 60.710 59.711 0.999 17890 11751 1 15 . 1 1 111 111 SER CB C 111 62.660 62.660 62.822 -0.162 17890 11752 1 15 . 1 1 112 112 GLY N N 112 107.313 107.313 106.828 0.485 17890 11753 1 15 . 1 1 112 112 GLY C C 112 173.023 173.023 172.901 0.122 17890 11754 1 15 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.086 -0.936 17890 11755 1 15 . 1 1 112 112 GLY H H 112 8.249 8.249 7.454 0.795 17890 11756 1 15 . 1 1 113 113 GLY N N 113 105.618 105.618 107.729 -2.111 17890 11757 1 15 . 1 1 113 113 GLY C C 113 175.844 175.844 171.810 4.034 17890 11758 1 15 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.972 -3.213 17890 11759 1 15 . 1 1 113 113 GLY H H 113 7.444 7.444 7.356 0.088 17890 11760 1 15 . 1 1 114 114 TYR N N 114 121.548 121.548 118.284 3.264 17890 11761 1 15 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.433 -0.581 17890 11762 1 15 . 1 1 114 114 TYR C C 114 175.605 175.605 174.344 1.261 17890 11763 1 15 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.431 4.832 17890 11764 1 15 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.417 -4.484 17890 11765 1 15 . 1 1 114 114 TYR H H 114 9.677 9.677 8.954 0.723 17890 11766 1 15 . 1 1 115 115 ASN N N 115 123.274 123.274 117.554 5.720 17890 11767 1 15 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.223 -0.125 17890 11768 1 15 . 1 1 115 115 ASN C C 115 174.355 174.355 173.089 1.266 17890 11769 1 15 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.611 -1.565 17890 11770 1 15 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.726 -2.377 17890 11771 1 15 . 1 1 115 115 ASN H H 115 9.350 9.350 8.952 0.398 17890 11772 1 15 . 1 1 116 116 ILE N N 116 130.611 130.611 121.927 8.684 17890 11773 1 15 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.801 -0.562 17890 11774 1 15 . 1 1 116 116 ILE C C 116 173.998 173.998 174.131 -0.133 17890 11775 1 15 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.075 2.124 17890 11776 1 15 . 1 1 116 116 ILE CB C 116 37.100 37.100 40.179 -3.079 17890 11777 1 15 . 1 1 116 116 ILE H H 116 9.473 9.473 8.335 1.138 17890 11778 1 15 . 1 1 117 117 GLN N N 117 121.633 121.633 124.962 -3.329 17890 11779 1 15 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.027 0.908 17890 11780 1 15 . 1 1 117 117 GLN C C 117 177.902 177.902 175.854 2.048 17890 11781 1 15 . 1 1 117 117 GLN CA C 117 53.320 53.320 54.014 -0.694 17890 11782 1 15 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.638 3.819 17890 11783 1 15 . 1 1 117 117 GLN H H 117 8.781 8.781 8.958 -0.177 17890 11784 1 15 . 1 1 118 118 ASP N N 118 116.836 116.836 119.782 -2.946 17890 11785 1 15 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.994 0.789 17890 11786 1 15 . 1 1 118 118 ASP C C 118 178.084 178.084 176.689 1.395 17890 11787 1 15 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.211 -1.441 17890 11788 1 15 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.215 -0.847 17890 11789 1 15 . 1 1 118 118 ASP H H 118 9.330 9.330 8.572 0.758 17890 11790 1 15 . 1 1 119 119 GLY N N 119 111.037 111.037 107.981 3.056 17890 11791 1 15 . 1 1 119 119 GLY C C 119 174.196 174.196 175.329 -1.133 17890 11792 1 15 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.901 2.075 17890 11793 1 15 . 1 1 119 119 GLY H H 119 8.986 8.986 8.359 0.627 17890 11794 1 15 . 1 1 120 120 LYS N N 120 114.809 114.809 122.308 -7.499 17890 11795 1 15 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.544 -0.195 17890 11796 1 15 . 1 1 120 120 LYS C C 120 175.174 175.174 175.551 -0.377 17890 11797 1 15 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.433 1.500 17890 11798 1 15 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.941 -0.465 17890 11799 1 15 . 1 1 120 120 LYS H H 120 7.045 7.045 8.794 -1.749 17890 11800 1 15 . 1 1 121 121 ARG N N 121 116.291 116.291 113.791 2.500 17890 11801 1 15 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.102 -0.516 17890 11802 1 15 . 1 1 121 121 ARG C C 121 175.097 175.097 177.051 -1.954 17890 11803 1 15 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.920 1.149 17890 11804 1 15 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.747 -0.124 17890 11805 1 15 . 1 1 121 121 ARG H H 121 7.683 7.683 8.367 -0.684 17890 11806 1 15 . 1 1 122 122 THR N N 122 113.730 113.730 109.658 4.072 17890 11807 1 15 . 1 1 122 122 THR HA H 122 4.540 4.540 4.193 0.347 17890 11808 1 15 . 1 1 122 122 THR C C 122 175.302 175.302 174.722 0.580 17890 11809 1 15 . 1 1 122 122 THR CA C 122 62.871 62.871 64.541 -1.670 17890 11810 1 15 . 1 1 122 122 THR CB C 122 71.552 71.552 69.906 1.646 17890 11811 1 15 . 1 1 122 122 THR H H 122 11.059 11.059 8.317 2.742 17890 11812 1 15 . 1 1 123 123 VAL N N 123 118.350 118.350 113.518 4.832 17890 11813 1 15 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.610 0.200 17890 11814 1 15 . 1 1 123 123 VAL C C 123 174.730 174.730 173.805 0.925 17890 11815 1 15 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.702 0.609 17890 11816 1 15 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.556 2.526 17890 11817 1 15 . 1 1 123 123 VAL H H 123 8.181 8.181 8.101 0.080 17890 11818 1 15 . 1 1 124 124 SER N N 124 113.053 113.053 113.828 -0.775 17890 11819 1 15 . 1 1 124 124 SER HA H 124 5.820 5.820 5.207 0.613 17890 11820 1 15 . 1 1 124 124 SER C C 124 175.521 175.521 173.431 2.090 17890 11821 1 15 . 1 1 124 124 SER CA C 124 58.087 58.087 57.067 1.020 17890 11822 1 15 . 1 1 124 124 SER CB C 124 67.405 67.405 66.188 1.217 17890 11823 1 15 . 1 1 124 124 SER H H 124 9.138 9.138 8.668 0.470 17890 11824 1 15 . 1 1 125 125 TRP N N 125 124.900 124.900 124.807 0.093 17890 11825 1 15 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.044 0.566 17890 11826 1 15 . 1 1 125 125 TRP C C 125 178.114 178.114 177.564 0.550 17890 11827 1 15 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.044 -0.570 17890 11828 1 15 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.878 1.145 17890 11829 1 15 . 1 1 125 125 TRP H H 125 8.843 8.843 7.979 0.864 17890 11830 1 15 . 1 1 126 126 SER N N 126 119.243 119.243 113.638 5.605 17890 11831 1 15 . 1 1 126 126 SER HA H 126 5.443 5.443 5.361 0.082 17890 11832 1 15 . 1 1 126 126 SER C C 126 171.668 171.668 172.874 -1.206 17890 11833 1 15 . 1 1 126 126 SER CA C 126 58.696 58.696 57.150 1.546 17890 11834 1 15 . 1 1 126 126 SER CB C 126 66.176 66.176 66.337 -0.161 17890 11835 1 15 . 1 1 126 126 SER H H 126 9.835 9.835 9.249 0.586 17890 11836 1 15 . 1 1 127 127 LEU N N 127 113.708 113.708 117.858 -4.150 17890 11837 1 15 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.706 0.449 17890 11838 1 15 . 1 1 127 127 LEU C C 127 176.563 176.563 176.785 -0.222 17890 11839 1 15 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.264 -0.619 17890 11840 1 15 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.603 -1.907 17890 11841 1 15 . 1 1 127 127 LEU H H 127 6.559 6.559 8.205 -1.646 17890 11842 1 15 . 1 1 128 128 ASN N N 128 121.739 121.739 119.355 2.384 17890 11843 1 15 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.952 -0.263 17890 11844 1 15 . 1 1 128 128 ASN C C 128 175.452 175.452 175.434 0.018 17890 11845 1 15 . 1 1 128 128 ASN CA C 128 56.007 56.007 55.033 0.974 17890 11846 1 15 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.163 -0.872 17890 11847 1 15 . 1 1 128 128 ASN H H 128 8.662 8.662 9.334 -0.672 17890 11848 1 15 . 1 1 129 129 ASN N N 129 119.586 119.586 116.350 3.236 17890 11849 1 15 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.924 0.073 17890 11850 1 15 . 1 1 129 129 ASN C C 129 175.900 175.900 174.837 1.063 17890 11851 1 15 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.388 0.845 17890 11852 1 15 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.026 0.230 17890 11853 1 15 . 1 1 129 129 ASN H H 129 10.962 10.962 8.798 2.164 17890 11854 1 15 . 1 1 130 130 ALA N N 130 128.292 128.292 121.926 6.366 17890 11855 1 15 . 1 1 130 130 ALA HA H 130 3.570 3.570 3.986 -0.416 17890 11856 1 15 . 1 1 130 130 ALA C C 130 172.620 172.620 176.408 -3.788 17890 11857 1 15 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.408 -0.769 17890 11858 1 15 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.229 -1.129 17890 11859 1 15 . 1 1 130 130 ALA H H 130 10.629 10.629 8.462 2.167 17890 11860 1 15 . 1 1 131 131 THR N N 131 105.584 105.584 109.788 -4.204 17890 11861 1 15 . 1 1 131 131 THR HA H 131 4.462 4.462 4.262 0.200 17890 11862 1 15 . 1 1 131 131 THR C C 131 173.552 173.552 175.423 -1.871 17890 11863 1 15 . 1 1 131 131 THR CA C 131 58.338 58.338 61.564 -3.226 17890 11864 1 15 . 1 1 131 131 THR CB C 131 71.569 71.569 69.528 2.041 17890 11865 1 15 . 1 1 131 131 THR H H 131 7.092 7.092 7.872 -0.780 17890 11866 1 15 . 1 1 132 132 ALA N N 132 121.773 121.773 124.247 -2.474 17890 11867 1 15 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.040 -0.291 17890 11868 1 15 . 1 1 132 132 ALA C C 132 178.819 178.819 178.426 0.393 17890 11869 1 15 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.787 1.497 17890 11870 1 15 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.861 -0.634 17890 11871 1 15 . 1 1 132 132 ALA H H 132 8.952 8.952 8.307 0.645 17890 11872 1 15 . 1 1 133 133 GLY N N 133 113.965 113.965 111.684 2.281 17890 11873 1 15 . 1 1 133 133 GLY C C 133 173.453 173.453 174.221 -0.768 17890 11874 1 15 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.889 0.278 17890 11875 1 15 . 1 1 133 133 GLY H H 133 9.016 9.016 8.678 0.338 17890 11876 1 15 . 1 1 134 134 GLU N N 134 123.460 123.460 121.253 2.207 17890 11877 1 15 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.339 -0.381 17890 11878 1 15 . 1 1 134 134 GLU C C 134 176.120 176.120 176.052 0.068 17890 11879 1 15 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.946 1.453 17890 11880 1 15 . 1 1 134 134 GLU CB C 134 31.385 31.385 31.044 0.341 17890 11881 1 15 . 1 1 134 134 GLU H H 134 7.598 7.598 7.594 0.004 17890 11882 1 15 . 1 1 135 135 GLU N N 135 122.633 122.633 125.397 -2.764 17890 11883 1 15 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.222 0.089 17890 11884 1 15 . 1 1 135 135 GLU C C 135 176.014 176.014 176.434 -0.420 17890 11885 1 15 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.349 -0.167 17890 11886 1 15 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.148 -0.695 17890 11887 1 15 . 1 1 135 135 GLU H H 135 8.258 8.258 8.612 -0.354 17890 11888 1 15 . 1 1 136 136 VAL N N 136 123.635 123.635 126.621 -2.986 17890 11889 1 15 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.837 -0.145 17890 11890 1 15 . 1 1 136 136 VAL C C 136 173.932 173.932 174.686 -0.754 17890 11891 1 15 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.488 0.344 17890 11892 1 15 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.531 -0.666 17890 11893 1 15 . 1 1 136 136 VAL H H 136 7.267 7.267 7.899 -0.632 17890 11894 1 15 . 1 1 137 137 SER N N 137 118.950 118.950 120.808 -1.858 17890 11895 1 15 . 1 1 137 137 SER HA H 137 4.887 4.887 4.975 -0.088 17890 11896 1 15 . 1 1 137 137 SER C C 137 173.780 173.780 172.960 0.820 17890 11897 1 15 . 1 1 137 137 SER CA C 137 57.895 57.895 56.161 1.734 17890 11898 1 15 . 1 1 137 137 SER CB C 137 65.027 65.027 65.335 -0.309 17890 11899 1 15 . 1 1 137 137 SER H H 137 8.454 8.454 8.647 -0.193 17890 11900 1 15 . 1 1 138 138 ILE N N 138 123.511 123.511 120.499 3.012 17890 11901 1 15 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.053 -0.805 17890 11902 1 15 . 1 1 138 138 ILE C C 138 176.142 176.142 175.267 0.875 17890 11903 1 15 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.528 1.323 17890 11904 1 15 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.821 -3.226 17890 11905 1 15 . 1 1 138 138 ILE H H 138 7.915 7.915 8.201 -0.286 17890 11906 1 15 . 1 1 139 139 GLY N N 139 115.638 115.638 111.115 4.523 17890 11907 1 15 . 1 1 139 139 GLY C C 139 171.947 171.947 173.267 -1.320 17890 11908 1 15 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.404 1.682 17890 11909 1 15 . 1 1 139 139 GLY H H 139 8.490 8.490 8.431 0.059 17890 11910 1 15 . 1 1 140 140 ALA N N 140 128.563 128.563 121.261 7.302 17890 11911 1 15 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.367 0.029 17890 11912 1 15 . 1 1 140 140 ALA C C 140 177.956 177.956 177.139 0.817 17890 11913 1 15 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.641 -1.995 17890 11914 1 15 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.958 0.246 17890 11915 1 15 . 1 1 140 140 ALA H H 140 8.531 8.531 8.370 0.161 17890 11916 1 15 . 1 1 141 141 ASP N N 141 120.886 120.886 114.608 6.278 17890 11917 1 15 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.583 0.015 17890 11918 1 15 . 1 1 141 141 ASP C C 141 175.411 175.411 174.311 1.100 17890 11919 1 15 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.691 0.225 17890 11920 1 15 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.351 -1.659 17890 11921 1 15 . 1 1 141 141 ASP H H 141 8.507 8.507 7.676 0.831 17890 11922 1 15 . 1 1 142 142 ALA N N 142 125.604 125.604 123.221 2.383 17890 11923 1 15 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.666 -0.149 17890 11924 1 15 . 1 1 142 142 ALA C C 142 177.671 177.671 177.994 -0.323 17890 11925 1 15 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.625 0.368 17890 11926 1 15 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.306 0.229 17890 11927 1 15 . 1 1 142 142 ALA H H 142 7.894 7.894 8.183 -0.289 17890 11928 1 15 . 1 1 143 143 THR N N 143 118.085 118.085 117.263 0.822 17890 11929 1 15 . 1 1 143 143 THR HA H 143 3.744 3.744 4.113 -0.369 17890 11930 1 15 . 1 1 143 143 THR C C 143 175.464 175.464 175.094 0.370 17890 11931 1 15 . 1 1 143 143 THR CA C 143 64.548 64.548 65.052 -0.505 17890 11932 1 15 . 1 1 143 143 THR CB C 143 69.305 69.305 69.049 0.256 17890 11933 1 15 . 1 1 143 143 THR H H 143 8.268 8.268 8.902 -0.634 17890 11934 1 15 . 1 1 144 144 PHE N N 144 118.635 118.635 116.172 2.463 17890 11935 1 15 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.682 -0.336 17890 11936 1 15 . 1 1 144 144 PHE C C 144 176.209 176.209 175.132 1.077 17890 11937 1 15 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.833 3.629 17890 11938 1 15 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.136 0.468 17890 11939 1 15 . 1 1 144 144 PHE H H 144 8.719 8.719 7.956 0.763 17890 11940 1 15 . 1 1 145 145 SER N N 145 113.446 113.446 114.535 -1.089 17890 11941 1 15 . 1 1 145 145 SER HA H 145 4.866 4.866 3.972 0.894 17890 11942 1 15 . 1 1 145 145 SER C C 145 176.605 176.605 175.276 1.329 17890 11943 1 15 . 1 1 145 145 SER CA C 145 59.432 59.432 57.436 1.996 17890 11944 1 15 . 1 1 145 145 SER CB C 145 62.167 62.167 63.029 -0.862 17890 11945 1 15 . 1 1 145 145 SER H H 145 8.657 8.657 7.252 1.405 17890 11946 1 15 . 1 1 146 146 GLY N N 146 109.277 109.277 109.116 0.161 17890 11947 1 15 . 1 1 146 146 GLY C C 146 174.293 174.293 173.581 0.712 17890 11948 1 15 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.321 -0.381 17890 11949 1 15 . 1 1 146 146 GLY H H 146 7.467 7.467 7.580 -0.113 17890 11950 1 15 . 1 1 147 147 ARG N N 147 122.863 122.863 117.927 4.936 17890 11951 1 15 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.997 0.444 17890 11952 1 15 . 1 1 147 147 ARG C C 147 173.849 173.849 174.549 -0.700 17890 11953 1 15 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.794 -2.567 17890 11954 1 15 . 1 1 147 147 ARG CB C 147 32.597 32.597 34.022 -1.425 17890 11955 1 15 . 1 1 147 147 ARG H H 147 7.556 7.556 6.868 0.688 17890 11956 1 15 . 1 1 148 148 TRP N N 148 118.465 118.465 120.078 -1.613 17890 11957 1 15 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.191 -0.345 17890 11958 1 15 . 1 1 148 148 TRP C C 148 174.353 174.353 174.396 -0.043 17890 11959 1 15 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.900 -1.238 17890 11960 1 15 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.385 -1.386 17890 11961 1 15 . 1 1 148 148 TRP H H 148 8.709 8.709 9.269 -0.560 17890 11962 1 15 . 1 1 149 149 VAL N N 149 125.852 125.852 118.196 7.656 17890 11963 1 15 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.337 -0.194 17890 11964 1 15 . 1 1 149 149 VAL C C 149 173.613 173.613 174.077 -0.464 17890 11965 1 15 . 1 1 149 149 VAL CA C 149 61.740 61.740 60.937 0.803 17890 11966 1 15 . 1 1 149 149 VAL CB C 149 32.383 32.383 34.806 -2.423 17890 11967 1 15 . 1 1 149 149 VAL H H 149 9.700 9.700 8.838 0.862 17890 11968 1 15 . 1 1 150 150 ILE N N 150 125.140 125.140 125.570 -0.430 17890 11969 1 15 . 1 1 150 150 ILE HA H 150 4.862 4.862 4.995 -0.133 17890 11970 1 15 . 1 1 150 150 ILE C C 150 175.661 175.661 174.427 1.234 17890 11971 1 15 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.428 1.393 17890 11972 1 15 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.779 -0.959 17890 11973 1 15 . 1 1 150 150 ILE H H 150 7.747 7.747 7.713 0.034 17890 11974 1 15 . 1 1 151 151 GLU N N 151 126.762 126.762 126.866 -0.104 17890 11975 1 15 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.855 0.025 17890 11976 1 15 . 1 1 151 151 GLU C C 151 174.424 174.424 174.770 -0.346 17890 11977 1 15 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.937 0.859 17890 11978 1 15 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.821 0.430 17890 11979 1 15 . 1 1 151 151 GLU H H 151 8.892 8.892 8.689 0.203 17890 11980 1 15 . 1 1 152 152 LYS N N 152 126.299 126.299 122.865 3.434 17890 11981 1 15 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.797 0.064 17890 11982 1 15 . 1 1 152 152 LYS C C 152 176.282 176.282 176.463 -0.181 17890 11983 1 15 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.761 0.744 17890 11984 1 15 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.585 0.751 17890 11985 1 15 . 1 1 152 152 LYS H H 152 8.640 8.640 8.348 0.292 17890 11986 1 16 . 1 1 2 2 GLY CA C 2 43.294 43.294 44.819 -1.525 17890 11987 1 16 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.804 -0.182 17890 11988 1 16 . 1 1 8 8 HIS CA C 8 55.661 55.661 55.309 0.352 17890 11989 1 16 . 1 1 8 8 HIS CB C 8 29.880 29.880 30.783 -0.903 17890 11990 1 16 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.875 -0.229 17890 11991 1 16 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.346 0.338 17890 11992 1 16 . 1 1 9 9 HIS CB C 9 29.831 29.831 32.636 -2.805 17890 11993 1 16 . 1 1 10 10 HIS N N 10 120.811 120.811 118.248 2.563 17890 11994 1 16 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.900 -0.220 17890 11995 1 16 . 1 1 10 10 HIS C C 10 174.875 174.875 173.941 0.934 17890 11996 1 16 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.384 0.362 17890 11997 1 16 . 1 1 10 10 HIS CB C 10 29.889 29.889 32.637 -2.748 17890 11998 1 16 . 1 1 10 10 HIS H H 10 8.583 8.583 9.092 -0.509 17890 11999 1 16 . 1 1 11 11 SER N N 11 118.009 118.009 116.627 1.382 17890 12000 1 16 . 1 1 11 11 SER HA H 11 4.424 4.424 4.652 -0.228 17890 12001 1 16 . 1 1 11 11 SER C C 11 174.962 174.962 173.544 1.418 17890 12002 1 16 . 1 1 11 11 SER CA C 11 58.660 58.660 57.916 0.744 17890 12003 1 16 . 1 1 11 11 SER CB C 11 63.822 63.822 64.206 -0.384 17890 12004 1 16 . 1 1 11 11 SER H H 11 8.438 8.438 8.570 -0.132 17890 12005 1 16 . 1 1 12 12 GLY N N 12 111.011 111.011 108.539 2.472 17890 12006 1 16 . 1 1 12 12 GLY C C 12 173.907 173.907 173.912 -0.005 17890 12007 1 16 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.137 0.284 17890 12008 1 16 . 1 1 12 12 GLY H H 12 8.433 8.433 6.631 1.802 17890 12009 1 16 . 1 1 13 13 ASP N N 13 120.291 120.291 120.770 -0.479 17890 12010 1 16 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.498 0.164 17890 12011 1 16 . 1 1 13 13 ASP C C 13 176.115 176.115 176.565 -0.450 17890 12012 1 16 . 1 1 13 13 ASP CA C 13 54.303 54.303 54.499 -0.196 17890 12013 1 16 . 1 1 13 13 ASP CB C 13 41.465 41.465 41.058 0.407 17890 12014 1 16 . 1 1 13 13 ASP H H 13 8.153 8.153 7.946 0.207 17890 12015 1 16 . 1 1 14 14 SER N N 14 116.987 116.987 113.794 3.193 17890 12016 1 16 . 1 1 14 14 SER HA H 14 4.754 4.754 4.218 0.536 17890 12017 1 16 . 1 1 14 14 SER CA C 14 56.469 56.469 58.106 -1.637 17890 12018 1 16 . 1 1 14 14 SER CB C 14 63.553 63.553 61.595 1.958 17890 12019 1 16 . 1 1 14 14 SER H H 14 8.210 8.210 8.084 0.126 17890 12020 1 16 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.408 0.034 17890 12021 1 16 . 1 1 15 15 PRO C C 15 176.424 176.424 177.332 -0.908 17890 12022 1 16 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.904 0.330 17890 12023 1 16 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.343 -0.195 17890 12024 1 16 . 1 1 16 16 ALA N N 16 124.219 124.219 121.176 3.043 17890 12025 1 16 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.044 0.306 17890 12026 1 16 . 1 1 16 16 ALA C C 16 177.552 177.552 177.176 0.376 17890 12027 1 16 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.886 -0.453 17890 12028 1 16 . 1 1 16 16 ALA CB C 16 19.319 19.319 18.068 1.251 17890 12029 1 16 . 1 1 16 16 ALA H H 16 8.284 8.284 8.370 -0.086 17890 12030 1 16 . 1 1 17 17 VAL N N 17 119.504 119.504 117.400 2.104 17890 12031 1 16 . 1 1 17 17 VAL HA H 17 4.249 4.249 3.925 0.324 17890 12032 1 16 . 1 1 17 17 VAL C C 17 176.322 176.322 176.554 -0.232 17890 12033 1 16 . 1 1 17 17 VAL CA C 17 62.278 62.278 63.778 -1.500 17890 12034 1 16 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.272 0.685 17890 12035 1 16 . 1 1 17 17 VAL H H 17 8.046 8.046 7.725 0.321 17890 12036 1 16 . 1 1 18 18 THR N N 18 118.186 118.186 119.557 -1.371 17890 12037 1 16 . 1 1 18 18 THR HA H 18 4.473 4.473 4.525 -0.052 17890 12038 1 16 . 1 1 18 18 THR C C 18 174.248 174.248 174.808 -0.560 17890 12039 1 16 . 1 1 18 18 THR CA C 18 61.565 61.565 61.175 0.390 17890 12040 1 16 . 1 1 18 18 THR CB C 18 70.165 70.165 69.544 0.621 17890 12041 1 16 . 1 1 18 18 THR H H 18 8.276 8.276 8.384 -0.108 17890 12042 1 16 . 1 1 19 19 LEU N N 19 125.265 125.265 119.710 5.555 17890 12043 1 16 . 1 1 19 19 LEU HA H 19 4.293 4.293 4.021 0.272 17890 12044 1 16 . 1 1 19 19 LEU C C 19 175.689 175.689 175.289 0.400 17890 12045 1 16 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.642 -0.216 17890 12046 1 16 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.268 2.011 17890 12047 1 16 . 1 1 19 19 LEU H H 19 8.091 8.091 8.283 -0.192 17890 12048 1 16 . 1 1 20 20 SER N N 20 114.622 114.622 115.395 -0.773 17890 12049 1 16 . 1 1 20 20 SER HA H 20 4.947 4.947 4.844 0.103 17890 12050 1 16 . 1 1 20 20 SER C C 20 174.220 174.220 173.141 1.079 17890 12051 1 16 . 1 1 20 20 SER CA C 20 56.583 56.583 57.205 -0.622 17890 12052 1 16 . 1 1 20 20 SER CB C 20 65.653 65.653 66.050 -0.397 17890 12053 1 16 . 1 1 20 20 SER H H 20 7.316 7.316 7.974 -0.658 17890 12054 1 16 . 1 1 21 21 ALA N N 21 125.517 125.517 123.761 1.756 17890 12055 1 16 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.891 -0.223 17890 12056 1 16 . 1 1 21 21 ALA C C 21 177.960 177.960 177.355 0.605 17890 12057 1 16 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.291 1.719 17890 12058 1 16 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.632 -0.407 17890 12059 1 16 . 1 1 21 21 ALA H H 21 8.993 8.993 8.469 0.524 17890 12060 1 16 . 1 1 22 22 GLY N N 22 109.543 109.543 110.443 -0.900 17890 12061 1 16 . 1 1 22 22 GLY C C 22 170.422 170.422 171.791 -1.369 17890 12062 1 16 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.128 0.253 17890 12063 1 16 . 1 1 22 22 GLY H H 22 8.411 8.411 8.926 -0.515 17890 12064 1 16 . 1 1 23 23 ASN N N 23 119.649 119.649 119.048 0.601 17890 12065 1 16 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.638 0.249 17890 12066 1 16 . 1 1 23 23 ASN C C 23 175.207 175.207 174.616 0.591 17890 12067 1 16 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.728 -0.907 17890 12068 1 16 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.315 -0.560 17890 12069 1 16 . 1 1 23 23 ASN H H 23 8.092 8.092 8.434 -0.342 17890 12070 1 16 . 1 1 24 24 TYR N N 24 120.889 120.889 121.767 -0.878 17890 12071 1 16 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.143 0.112 17890 12072 1 16 . 1 1 24 24 TYR C C 24 175.667 175.667 174.452 1.215 17890 12073 1 16 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.277 0.836 17890 12074 1 16 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.692 0.134 17890 12075 1 16 . 1 1 24 24 TYR H H 24 9.914 9.914 8.966 0.948 17890 12076 1 16 . 1 1 25 25 ILE N N 25 115.978 115.978 113.603 2.375 17890 12077 1 16 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.025 0.061 17890 12078 1 16 . 1 1 25 25 ILE C C 25 175.200 175.200 174.148 1.052 17890 12079 1 16 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.733 0.812 17890 12080 1 16 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.733 -0.612 17890 12081 1 16 . 1 1 25 25 ILE H H 25 9.216 9.216 9.283 -0.067 17890 12082 1 16 . 1 1 26 26 ILE N N 26 123.957 123.957 122.899 1.058 17890 12083 1 16 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.276 -0.300 17890 12084 1 16 . 1 1 26 26 ILE C C 26 174.810 174.810 174.895 -0.085 17890 12085 1 16 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.215 0.394 17890 12086 1 16 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.221 0.901 17890 12087 1 16 . 1 1 26 26 ILE H H 26 9.559 9.559 9.012 0.547 17890 12088 1 16 . 1 1 27 27 TYR N N 27 121.371 121.371 123.955 -2.584 17890 12089 1 16 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.573 0.617 17890 12090 1 16 . 1 1 27 27 TYR C C 27 173.963 173.963 173.434 0.529 17890 12091 1 16 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.963 -0.294 17890 12092 1 16 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.084 0.614 17890 12093 1 16 . 1 1 27 27 TYR H H 27 9.378 9.378 9.008 0.370 17890 12094 1 16 . 1 1 28 28 ASN N N 28 121.991 121.991 120.158 1.833 17890 12095 1 16 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.050 -0.282 17890 12096 1 16 . 1 1 28 28 ASN C C 28 174.352 174.352 176.176 -1.824 17890 12097 1 16 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.937 2.183 17890 12098 1 16 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.816 1.629 17890 12099 1 16 . 1 1 28 28 ASN H H 28 8.466 8.466 8.457 0.009 17890 12100 1 16 . 1 1 29 29 ARG N N 29 121.103 121.103 126.999 -5.896 17890 12101 1 16 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.036 -0.175 17890 12102 1 16 . 1 1 29 29 ARG C C 29 173.635 173.635 177.430 -3.795 17890 12103 1 16 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.535 0.758 17890 12104 1 16 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.098 0.301 17890 12105 1 16 . 1 1 29 29 ARG H H 29 7.756 7.756 8.204 -0.448 17890 12106 1 16 . 1 1 30 30 VAL N N 30 118.412 118.412 117.082 1.330 17890 12107 1 16 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.824 0.120 17890 12108 1 16 . 1 1 30 30 VAL C C 30 176.199 176.199 175.788 0.411 17890 12109 1 16 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.941 -1.363 17890 12110 1 16 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.268 -2.046 17890 12111 1 16 . 1 1 30 30 VAL H H 30 8.976 8.976 7.681 1.295 17890 12112 1 16 . 1 1 31 31 LEU N N 31 125.418 125.418 114.012 11.406 17890 12113 1 16 . 1 1 31 31 LEU HA H 31 4.485 4.485 3.987 0.498 17890 12114 1 16 . 1 1 31 31 LEU C C 31 179.123 179.123 176.313 2.810 17890 12115 1 16 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.542 -1.517 17890 12116 1 16 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.197 4.384 17890 12117 1 16 . 1 1 31 31 LEU H H 31 8.856 8.856 7.527 1.329 17890 12118 1 16 . 1 1 32 32 SER N N 32 116.890 116.890 115.642 1.248 17890 12119 1 16 . 1 1 32 32 SER HA H 32 5.365 5.365 4.861 0.504 17890 12120 1 16 . 1 1 32 32 SER CA C 32 57.269 57.269 56.940 0.329 17890 12121 1 16 . 1 1 32 32 SER CB C 32 62.213 62.213 64.478 -2.265 17890 12122 1 16 . 1 1 32 32 SER H H 32 9.307 9.307 8.508 0.799 17890 12123 1 16 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.474 -0.594 17890 12124 1 16 . 1 1 33 33 PRO C C 33 175.137 175.137 177.528 -2.391 17890 12125 1 16 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.643 0.642 17890 12126 1 16 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.612 0.419 17890 12127 1 16 . 1 1 34 34 ARG N N 34 110.279 110.279 118.634 -8.355 17890 12128 1 16 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.288 0.204 17890 12129 1 16 . 1 1 34 34 ARG C C 34 176.844 176.844 176.731 0.113 17890 12130 1 16 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.704 -1.268 17890 12131 1 16 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.162 0.422 17890 12132 1 16 . 1 1 34 34 ARG H H 34 7.257 7.257 7.856 -0.599 17890 12133 1 16 . 1 1 35 35 GLY N N 35 110.288 110.288 106.313 3.975 17890 12134 1 16 . 1 1 35 35 GLY C C 35 173.336 173.336 174.094 -0.758 17890 12135 1 16 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.741 2.289 17890 12136 1 16 . 1 1 35 35 GLY H H 35 8.589 8.589 7.589 1.000 17890 12137 1 16 . 1 1 36 36 GLU N N 36 116.838 116.838 118.984 -2.146 17890 12138 1 16 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.635 -0.287 17890 12139 1 16 . 1 1 36 36 GLU C C 36 176.915 176.915 175.556 1.359 17890 12140 1 16 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.864 1.043 17890 12141 1 16 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.522 -3.107 17890 12142 1 16 . 1 1 36 36 GLU H H 36 7.769 7.769 8.251 -0.482 17890 12143 1 16 . 1 1 37 37 LYS N N 37 123.775 123.775 121.153 2.622 17890 12144 1 16 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.030 0.393 17890 12145 1 16 . 1 1 37 37 LYS C C 37 176.067 176.067 175.489 0.578 17890 12146 1 16 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.434 -0.533 17890 12147 1 16 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.421 1.253 17890 12148 1 16 . 1 1 37 37 LYS H H 37 8.667 8.667 8.595 0.072 17890 12149 1 16 . 1 1 38 38 LEU N N 38 126.658 126.658 127.572 -0.914 17890 12150 1 16 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.868 -0.641 17890 12151 1 16 . 1 1 38 38 LEU C C 38 174.332 174.332 175.065 -0.733 17890 12152 1 16 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.479 -0.136 17890 12153 1 16 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.642 -0.991 17890 12154 1 16 . 1 1 38 38 LEU H H 38 10.455 10.455 8.978 1.477 17890 12155 1 16 . 1 1 39 39 ALA N N 39 127.018 127.018 127.404 -0.386 17890 12156 1 16 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.278 -0.049 17890 12157 1 16 . 1 1 39 39 ALA C C 39 178.694 178.694 176.190 2.504 17890 12158 1 16 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.235 -0.010 17890 12159 1 16 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.733 0.616 17890 12160 1 16 . 1 1 39 39 ALA H H 39 8.773 8.773 8.688 0.085 17890 12161 1 16 . 1 1 40 40 LEU N N 40 126.771 126.771 123.417 3.354 17890 12162 1 16 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.626 -0.272 17890 12163 1 16 . 1 1 40 40 LEU C C 40 178.309 178.309 176.548 1.761 17890 12164 1 16 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.023 0.822 17890 12165 1 16 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.987 0.336 17890 12166 1 16 . 1 1 40 40 LEU H H 40 9.665 9.665 8.753 0.912 17890 12167 1 16 . 1 1 41 41 THR N N 41 126.578 126.578 124.329 2.249 17890 12168 1 16 . 1 1 41 41 THR HA H 41 4.916 4.916 5.169 -0.253 17890 12169 1 16 . 1 1 41 41 THR C C 41 172.547 172.547 173.503 -0.956 17890 12170 1 16 . 1 1 41 41 THR CA C 41 63.253 63.253 61.706 1.547 17890 12171 1 16 . 1 1 41 41 THR CB C 41 71.832 71.832 70.699 1.133 17890 12172 1 16 . 1 1 41 41 THR H H 41 9.802 9.802 9.059 0.743 17890 12173 1 16 . 1 1 42 42 TYR N N 42 130.506 130.506 129.347 1.159 17890 12174 1 16 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.559 0.543 17890 12175 1 16 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.798 -3.812 17890 12176 1 16 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.371 -0.216 17890 12177 1 16 . 1 1 42 42 TYR H H 42 9.428 9.428 9.041 0.387 17890 12178 1 16 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.345 0.145 17890 12179 1 16 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.092 0.482 17890 12180 1 16 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.224 0.420 17890 12181 1 16 . 1 1 44 44 GLY N N 44 113.736 113.736 105.077 8.659 17890 12182 1 16 . 1 1 44 44 GLY C C 44 171.790 171.790 172.881 -1.091 17890 12183 1 16 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.685 1.031 17890 12184 1 16 . 1 1 44 44 GLY H H 44 8.337 8.337 7.134 1.203 17890 12185 1 16 . 1 1 45 45 ARG N N 45 113.899 113.899 116.392 -2.493 17890 12186 1 16 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.548 0.028 17890 12187 1 16 . 1 1 45 45 ARG C C 45 175.151 175.151 173.655 1.496 17890 12188 1 16 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.704 -0.539 17890 12189 1 16 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.680 1.540 17890 12190 1 16 . 1 1 45 45 ARG H H 45 6.463 6.463 7.202 -0.739 17890 12191 1 16 . 1 1 46 46 GLN N N 46 119.000 119.000 118.048 0.952 17890 12192 1 16 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.545 -0.096 17890 12193 1 16 . 1 1 46 46 GLN C C 46 177.282 177.282 176.435 0.847 17890 12194 1 16 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.382 1.231 17890 12195 1 16 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.591 0.905 17890 12196 1 16 . 1 1 46 46 GLN H H 46 8.683 8.683 8.560 0.123 17890 12197 1 16 . 1 1 47 47 ARG N N 47 113.526 113.526 120.538 -7.012 17890 12198 1 16 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.032 -0.502 17890 12199 1 16 . 1 1 47 47 ARG C C 47 174.130 174.130 174.957 -0.827 17890 12200 1 16 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.328 1.488 17890 12201 1 16 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.249 0.821 17890 12202 1 16 . 1 1 47 47 ARG H H 47 9.677 9.677 8.547 1.130 17890 12203 1 16 . 1 1 48 48 THR N N 48 114.672 114.672 114.770 -0.098 17890 12204 1 16 . 1 1 48 48 THR HA H 48 4.938 4.938 4.661 0.277 17890 12205 1 16 . 1 1 48 48 THR CA C 48 59.987 59.987 59.338 0.649 17890 12206 1 16 . 1 1 48 48 THR CB C 48 71.947 71.947 71.367 0.580 17890 12207 1 16 . 1 1 48 48 THR H H 48 8.104 8.104 7.588 0.516 17890 12208 1 16 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.486 -0.118 17890 12209 1 16 . 1 1 49 49 PRO C C 49 175.651 175.651 176.237 -0.586 17890 12210 1 16 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.358 0.823 17890 12211 1 16 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.130 0.567 17890 12212 1 16 . 1 1 50 50 VAL N N 50 122.562 122.562 120.681 1.881 17890 12213 1 16 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.287 -0.340 17890 12214 1 16 . 1 1 50 50 VAL C C 50 174.493 174.493 175.801 -1.308 17890 12215 1 16 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.019 2.792 17890 12216 1 16 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.057 -1.889 17890 12217 1 16 . 1 1 50 50 VAL H H 50 8.123 8.123 8.193 -0.070 17890 12218 1 16 . 1 1 51 51 THR N N 51 113.549 113.549 118.714 -5.165 17890 12219 1 16 . 1 1 51 51 THR HA H 51 5.372 5.372 4.856 0.516 17890 12220 1 16 . 1 1 51 51 THR C C 51 174.841 174.841 172.883 1.958 17890 12221 1 16 . 1 1 51 51 THR CA C 51 59.196 59.196 60.994 -1.798 17890 12222 1 16 . 1 1 51 51 THR CB C 51 72.703 72.703 71.732 0.971 17890 12223 1 16 . 1 1 51 51 THR H H 51 7.057 7.057 8.232 -1.175 17890 12224 1 16 . 1 1 52 52 VAL N N 52 107.374 107.374 120.557 -13.183 17890 12225 1 16 . 1 1 52 52 VAL HA H 52 5.514 5.514 4.969 0.545 17890 12226 1 16 . 1 1 52 52 VAL C C 52 175.697 175.697 173.943 1.754 17890 12227 1 16 . 1 1 52 52 VAL CA C 52 58.472 58.472 60.224 -1.752 17890 12228 1 16 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.794 -1.020 17890 12229 1 16 . 1 1 52 52 VAL H H 52 8.062 8.062 8.437 -0.375 17890 12230 1 16 . 1 1 53 53 SER N N 53 114.662 114.662 121.668 -7.006 17890 12231 1 16 . 1 1 53 53 SER HA H 53 4.690 4.690 5.071 -0.381 17890 12232 1 16 . 1 1 53 53 SER CA C 53 56.828 56.828 56.332 0.496 17890 12233 1 16 . 1 1 53 53 SER CB C 53 64.789 64.789 65.382 -0.593 17890 12234 1 16 . 1 1 53 53 SER H H 53 8.681 8.681 9.171 -0.490 17890 12235 1 16 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.673 0.103 17890 12236 1 16 . 1 1 54 54 PRO C C 54 177.724 177.724 176.563 1.161 17890 12237 1 16 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.799 0.626 17890 12238 1 16 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.074 0.023 17890 12239 1 16 . 1 1 55 55 LEU N N 55 128.655 128.655 124.113 4.542 17890 12240 1 16 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.130 0.397 17890 12241 1 16 . 1 1 55 55 LEU C C 55 178.696 178.696 176.310 2.386 17890 12242 1 16 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.130 0.116 17890 12243 1 16 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.238 1.368 17890 12244 1 16 . 1 1 55 55 LEU H H 55 8.675 8.675 8.509 0.166 17890 12245 1 16 . 1 1 56 56 ASP N N 56 126.651 126.651 125.779 0.872 17890 12246 1 16 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.774 -0.065 17890 12247 1 16 . 1 1 56 56 ASP C C 56 177.729 177.729 176.887 0.842 17890 12248 1 16 . 1 1 56 56 ASP CA C 56 53.623 53.623 53.986 -0.363 17890 12249 1 16 . 1 1 56 56 ASP CB C 56 41.632 41.632 43.929 -2.297 17890 12250 1 16 . 1 1 56 56 ASP H H 56 9.683 9.683 9.146 0.537 17890 12251 1 16 . 1 1 57 57 GLY N N 57 109.299 109.299 108.871 0.428 17890 12252 1 16 . 1 1 57 57 GLY C C 57 174.558 174.558 174.479 0.079 17890 12253 1 16 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.036 0.919 17890 12254 1 16 . 1 1 57 57 GLY H H 57 8.157 8.157 8.801 -0.644 17890 12255 1 16 . 1 1 58 58 SER N N 58 116.740 116.740 115.345 1.395 17890 12256 1 16 . 1 1 58 58 SER HA H 58 4.288 4.288 4.643 -0.355 17890 12257 1 16 . 1 1 58 58 SER C C 58 177.252 177.252 176.132 1.120 17890 12258 1 16 . 1 1 58 58 SER CA C 58 58.737 58.737 57.091 1.646 17890 12259 1 16 . 1 1 58 58 SER CB C 58 64.576 64.576 65.286 -0.710 17890 12260 1 16 . 1 1 58 58 SER H H 58 8.328 8.328 7.762 0.566 17890 12261 1 16 . 1 1 59 59 SER N N 59 119.768 119.768 117.866 1.902 17890 12262 1 16 . 1 1 59 59 SER HA H 59 4.046 4.046 4.038 0.008 17890 12263 1 16 . 1 1 59 59 SER C C 59 176.671 176.671 176.064 0.607 17890 12264 1 16 . 1 1 59 59 SER CA C 59 61.691 61.691 60.655 1.036 17890 12265 1 16 . 1 1 59 59 SER CB C 59 63.154 63.154 62.742 0.412 17890 12266 1 16 . 1 1 59 59 SER H H 59 9.020 9.020 8.810 0.210 17890 12267 1 16 . 1 1 60 60 GLU N N 60 119.133 119.133 119.671 -0.538 17890 12268 1 16 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.049 0.137 17890 12269 1 16 . 1 1 60 60 GLU C C 60 177.435 177.435 177.088 0.347 17890 12270 1 16 . 1 1 60 60 GLU CA C 60 60.033 60.033 59.044 0.990 17890 12271 1 16 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.688 -1.462 17890 12272 1 16 . 1 1 60 60 GLU H H 60 8.832 8.832 8.251 0.581 17890 12273 1 16 . 1 1 61 61 GLN N N 61 118.818 118.818 114.986 3.832 17890 12274 1 16 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.786 0.391 17890 12275 1 16 . 1 1 61 61 GLN C C 61 173.254 173.254 174.246 -0.992 17890 12276 1 16 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.179 0.194 17890 12277 1 16 . 1 1 61 61 GLN CB C 61 27.922 27.922 29.507 -1.585 17890 12278 1 16 . 1 1 61 61 GLN H H 61 7.648 7.648 7.721 -0.073 17890 12279 1 16 . 1 1 62 62 ALA N N 62 122.562 122.562 122.729 -0.167 17890 12280 1 16 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.465 0.599 17890 12281 1 16 . 1 1 62 62 ALA C C 62 176.637 176.637 175.262 1.375 17890 12282 1 16 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.199 -0.020 17890 12283 1 16 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.133 -0.538 17890 12284 1 16 . 1 1 62 62 ALA H H 62 7.315 7.315 6.905 0.410 17890 12285 1 16 . 1 1 63 63 TRP N N 63 124.787 124.787 119.152 5.635 17890 12286 1 16 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.295 -0.331 17890 12287 1 16 . 1 1 63 63 TRP C C 63 174.351 174.351 175.288 -0.937 17890 12288 1 16 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.271 -0.369 17890 12289 1 16 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.867 -1.750 17890 12290 1 16 . 1 1 63 63 TRP H H 63 9.544 9.544 8.906 0.638 17890 12291 1 16 . 1 1 64 64 ILE N N 64 122.482 122.482 119.266 3.216 17890 12292 1 16 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.962 -0.268 17890 12293 1 16 . 1 1 64 64 ILE C C 64 177.078 177.078 174.283 2.795 17890 12294 1 16 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.566 0.464 17890 12295 1 16 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.254 -0.885 17890 12296 1 16 . 1 1 64 64 ILE H H 64 10.235 10.235 9.417 0.818 17890 12297 1 16 . 1 1 65 65 LEU N N 65 132.183 132.183 128.557 3.626 17890 12298 1 16 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.486 -0.021 17890 12299 1 16 . 1 1 65 65 LEU C C 65 177.048 177.048 174.472 2.576 17890 12300 1 16 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.853 0.495 17890 12301 1 16 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.168 -3.824 17890 12302 1 16 . 1 1 65 65 LEU H H 65 9.432 9.432 9.323 0.109 17890 12303 1 16 . 1 1 66 66 ARG N N 66 120.807 120.807 125.274 -4.467 17890 12304 1 16 . 1 1 66 66 ARG HA H 66 4.888 4.888 5.013 -0.125 17890 12305 1 16 . 1 1 66 66 ARG C C 66 175.275 175.275 174.762 0.513 17890 12306 1 16 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.698 0.357 17890 12307 1 16 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.489 -1.498 17890 12308 1 16 . 1 1 66 66 ARG H H 66 8.491 8.491 8.460 0.031 17890 12309 1 16 . 1 1 67 67 SER N N 67 119.709 119.709 118.387 1.322 17890 12310 1 16 . 1 1 67 67 SER HA H 67 3.186 3.186 3.389 -0.203 17890 12311 1 16 . 1 1 67 67 SER C C 67 174.508 174.508 173.643 0.865 17890 12312 1 16 . 1 1 67 67 SER CA C 67 58.521 58.521 58.928 -0.407 17890 12313 1 16 . 1 1 67 67 SER CB C 67 62.590 62.590 63.257 -0.667 17890 12314 1 16 . 1 1 67 67 SER H H 67 8.557 8.557 8.725 -0.168 17890 12315 1 16 . 1 1 68 68 TYR N N 68 131.011 131.011 127.479 3.532 17890 12316 1 16 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.640 -0.192 17890 12317 1 16 . 1 1 68 68 TYR C C 68 174.687 174.687 174.738 -0.051 17890 12318 1 16 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.849 0.916 17890 12319 1 16 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.888 -1.900 17890 12320 1 16 . 1 1 68 68 TYR H H 68 8.531 8.531 8.662 -0.131 17890 12321 1 16 . 1 1 69 69 ASP N N 69 117.066 117.066 119.688 -2.622 17890 12322 1 16 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.887 -0.262 17890 12323 1 16 . 1 1 69 69 ASP C C 69 176.455 176.455 175.603 0.852 17890 12324 1 16 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.758 -0.667 17890 12325 1 16 . 1 1 69 69 ASP CB C 69 42.147 42.147 43.068 -0.921 17890 12326 1 16 . 1 1 69 69 ASP H H 69 7.122 7.122 7.613 -0.491 17890 12327 1 16 . 1 1 70 70 SER N N 70 122.869 122.869 119.858 3.011 17890 12328 1 16 . 1 1 70 70 SER HA H 70 4.270 4.270 4.019 0.251 17890 12329 1 16 . 1 1 70 70 SER C C 70 177.010 177.010 176.127 0.883 17890 12330 1 16 . 1 1 70 70 SER CA C 70 60.837 60.837 61.452 -0.615 17890 12331 1 16 . 1 1 70 70 SER CB C 70 62.722 62.722 63.335 -0.613 17890 12332 1 16 . 1 1 70 70 SER H H 70 8.757 8.757 8.782 -0.025 17890 12333 1 16 . 1 1 71 71 ASN N N 71 119.873 119.873 117.095 2.778 17890 12334 1 16 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.589 -0.018 17890 12335 1 16 . 1 1 71 71 ASN C C 71 176.226 176.226 176.025 0.201 17890 12336 1 16 . 1 1 71 71 ASN CA C 71 55.714 55.714 54.941 0.773 17890 12337 1 16 . 1 1 71 71 ASN CB C 71 38.641 38.641 37.891 0.750 17890 12338 1 16 . 1 1 71 71 ASN H H 71 8.342 8.342 8.848 -0.506 17890 12339 1 16 . 1 1 72 72 SER N N 72 112.202 112.202 114.076 -1.874 17890 12340 1 16 . 1 1 72 72 SER HA H 72 4.567 4.567 4.671 -0.104 17890 12341 1 16 . 1 1 72 72 SER C C 72 173.789 173.789 173.349 0.440 17890 12342 1 16 . 1 1 72 72 SER CA C 72 57.816 57.816 58.037 -0.221 17890 12343 1 16 . 1 1 72 72 SER CB C 72 63.935 63.935 64.412 -0.477 17890 12344 1 16 . 1 1 72 72 SER H H 72 7.560 7.560 7.472 0.088 17890 12345 1 16 . 1 1 73 73 ASN N N 73 117.437 117.437 118.983 -1.546 17890 12346 1 16 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.392 0.142 17890 12347 1 16 . 1 1 73 73 ASN C C 73 173.647 173.647 174.316 -0.669 17890 12348 1 16 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.667 -0.144 17890 12349 1 16 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.397 -0.183 17890 12350 1 16 . 1 1 73 73 ASN H H 73 7.940 7.940 7.988 -0.048 17890 12351 1 16 . 1 1 74 74 THR N N 74 104.227 104.227 109.001 -4.774 17890 12352 1 16 . 1 1 74 74 THR HA H 74 5.477 5.477 4.982 0.495 17890 12353 1 16 . 1 1 74 74 THR C C 74 176.824 176.824 173.837 2.987 17890 12354 1 16 . 1 1 74 74 THR CA C 74 59.768 59.768 61.477 -1.709 17890 12355 1 16 . 1 1 74 74 THR CB C 74 71.985 71.985 70.005 1.980 17890 12356 1 16 . 1 1 74 74 THR H H 74 7.737 7.737 7.872 -0.135 17890 12357 1 16 . 1 1 75 75 TRP N N 75 124.636 124.636 122.763 1.873 17890 12358 1 16 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.266 -0.059 17890 12359 1 16 . 1 1 75 75 TRP C C 75 175.876 175.876 176.234 -0.358 17890 12360 1 16 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.288 1.318 17890 12361 1 16 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.583 -0.067 17890 12362 1 16 . 1 1 75 75 TRP H H 75 9.442 9.442 9.040 0.402 17890 12363 1 16 . 1 1 76 76 THR N N 76 110.544 110.544 115.156 -4.612 17890 12364 1 16 . 1 1 76 76 THR HA H 76 5.129 5.129 5.062 0.067 17890 12365 1 16 . 1 1 76 76 THR C C 76 174.506 174.506 174.183 0.323 17890 12366 1 16 . 1 1 76 76 THR CA C 76 60.561 60.561 61.592 -1.030 17890 12367 1 16 . 1 1 76 76 THR CB C 76 71.688 71.688 70.295 1.393 17890 12368 1 16 . 1 1 76 76 THR H H 76 9.415 9.415 9.424 -0.009 17890 12369 1 16 . 1 1 77 77 ILE N N 77 121.567 121.567 123.996 -2.429 17890 12370 1 16 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.222 -0.083 17890 12371 1 16 . 1 1 77 77 ILE C C 77 176.148 176.148 175.044 1.104 17890 12372 1 16 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.680 2.028 17890 12373 1 16 . 1 1 77 77 ILE CB C 77 40.987 40.987 40.267 0.720 17890 12374 1 16 . 1 1 77 77 ILE H H 77 9.255 9.255 8.516 0.739 17890 12375 1 16 . 1 1 78 78 SER N N 78 122.269 122.269 121.103 1.166 17890 12376 1 16 . 1 1 78 78 SER HA H 78 5.601 5.601 5.270 0.331 17890 12377 1 16 . 1 1 78 78 SER CA C 78 55.835 55.835 56.169 -0.334 17890 12378 1 16 . 1 1 78 78 SER CB C 78 65.858 65.858 66.607 -0.749 17890 12379 1 16 . 1 1 78 78 SER H H 78 9.226 9.226 8.707 0.519 17890 12380 1 16 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.233 -0.369 17890 12381 1 16 . 1 1 79 79 PRO C C 79 178.175 178.175 177.563 0.612 17890 12382 1 16 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.162 0.722 17890 12383 1 16 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.097 -1.825 17890 12384 1 16 . 1 1 80 80 VAL N N 80 121.906 121.906 116.513 5.393 17890 12385 1 16 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.829 -0.248 17890 12386 1 16 . 1 1 80 80 VAL C C 80 177.751 177.751 176.554 1.197 17890 12387 1 16 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.144 1.923 17890 12388 1 16 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.390 0.095 17890 12389 1 16 . 1 1 80 80 VAL H H 80 7.328 7.328 7.652 -0.324 17890 12390 1 16 . 1 1 81 81 GLY N N 81 104.643 104.643 107.350 -2.707 17890 12391 1 16 . 1 1 81 81 GLY C C 81 174.979 174.979 174.700 0.279 17890 12392 1 16 . 1 1 81 81 GLY CA C 81 45.088 45.088 44.788 0.300 17890 12393 1 16 . 1 1 81 81 GLY H H 81 8.949 8.949 7.970 0.979 17890 12394 1 16 . 1 1 82 82 SER N N 82 111.865 111.865 116.328 -4.463 17890 12395 1 16 . 1 1 82 82 SER HA H 82 4.646 4.646 4.890 -0.244 17890 12396 1 16 . 1 1 82 82 SER CA C 82 55.441 55.441 55.484 -0.043 17890 12397 1 16 . 1 1 82 82 SER CB C 82 62.277 62.277 63.803 -1.526 17890 12398 1 16 . 1 1 82 82 SER H H 82 6.968 6.968 7.108 -0.140 17890 12399 1 16 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.546 -0.199 17890 12400 1 16 . 1 1 83 83 PRO C C 83 176.660 176.660 176.629 0.031 17890 12401 1 16 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.536 0.667 17890 12402 1 16 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.823 0.996 17890 12403 1 16 . 1 1 84 84 ASN N N 84 116.542 116.542 113.778 2.764 17890 12404 1 16 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.597 0.404 17890 12405 1 16 . 1 1 84 84 ASN C C 84 175.825 175.825 174.904 0.921 17890 12406 1 16 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.739 -0.848 17890 12407 1 16 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.013 0.731 17890 12408 1 16 . 1 1 84 84 ASN H H 84 8.502 8.502 8.271 0.231 17890 12409 1 16 . 1 1 85 85 SER N N 85 114.633 114.633 112.668 1.965 17890 12410 1 16 . 1 1 85 85 SER HA H 85 4.624 4.624 4.982 -0.358 17890 12411 1 16 . 1 1 85 85 SER C C 85 172.963 172.963 172.656 0.307 17890 12412 1 16 . 1 1 85 85 SER CA C 85 59.210 59.210 57.145 2.064 17890 12413 1 16 . 1 1 85 85 SER CB C 85 64.697 64.697 66.239 -1.542 17890 12414 1 16 . 1 1 85 85 SER H H 85 7.980 7.980 7.810 0.170 17890 12415 1 16 . 1 1 86 86 GLN N N 86 119.016 119.016 117.413 1.603 17890 12416 1 16 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.613 -0.167 17890 12417 1 16 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.478 -0.027 17890 12418 1 16 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.389 0.009 17890 12419 1 16 . 1 1 86 86 GLN H H 86 9.399 9.399 9.101 0.298 17890 12420 1 16 . 1 1 87 87 ILE N N 87 119.691 119.691 119.281 0.410 17890 12421 1 16 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.186 -0.611 17890 12422 1 16 . 1 1 87 87 ILE C C 87 176.505 176.505 176.091 0.414 17890 12423 1 16 . 1 1 87 87 ILE CA C 87 63.494 63.494 59.028 4.466 17890 12424 1 16 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.011 -0.814 17890 12425 1 16 . 1 1 87 87 ILE H H 87 8.970 8.970 8.308 0.662 17890 12426 1 16 . 1 1 88 88 GLY N N 88 118.378 118.378 114.913 3.465 17890 12427 1 16 . 1 1 88 88 GLY C C 88 171.397 171.397 171.685 -0.288 17890 12428 1 16 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.910 -1.306 17890 12429 1 16 . 1 1 88 88 GLY H H 88 9.752 9.752 9.112 0.640 17890 12430 1 16 . 1 1 89 89 TRP N N 89 122.749 122.749 121.976 0.773 17890 12431 1 16 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.402 -0.804 17890 12432 1 16 . 1 1 89 89 TRP C C 89 175.924 175.924 174.784 1.140 17890 12433 1 16 . 1 1 89 89 TRP CA C 89 56.283 56.283 55.931 0.353 17890 12434 1 16 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.424 -2.338 17890 12435 1 16 . 1 1 89 89 TRP H H 89 8.215 8.215 8.193 0.022 17890 12436 1 16 . 1 1 90 90 GLY N N 90 116.305 116.305 110.782 5.523 17890 12437 1 16 . 1 1 90 90 GLY C C 90 173.725 173.725 172.394 1.331 17890 12438 1 16 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.509 0.546 17890 12439 1 16 . 1 1 90 90 GLY H H 90 8.922 8.922 8.182 0.740 17890 12440 1 16 . 1 1 91 91 ALA N N 91 123.795 123.795 121.958 1.837 17890 12441 1 16 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.168 0.075 17890 12442 1 16 . 1 1 91 91 ALA C C 91 178.510 178.510 178.932 -0.422 17890 12443 1 16 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.436 0.054 17890 12444 1 16 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.791 -0.382 17890 12445 1 16 . 1 1 91 91 ALA H H 91 8.367 8.367 8.155 0.212 17890 12446 1 16 . 1 1 92 92 GLY N N 92 108.871 108.871 112.630 -3.759 17890 12447 1 16 . 1 1 92 92 GLY C C 92 174.528 174.528 174.830 -0.302 17890 12448 1 16 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.739 0.520 17890 12449 1 16 . 1 1 92 92 GLY H H 92 8.776 8.776 8.623 0.153 17890 12450 1 16 . 1 1 93 93 ASN N N 93 114.921 114.921 117.383 -2.462 17890 12451 1 16 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.770 -0.321 17890 12452 1 16 . 1 1 93 93 ASN C C 93 172.774 172.774 173.777 -1.003 17890 12453 1 16 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.234 0.738 17890 12454 1 16 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.198 -0.869 17890 12455 1 16 . 1 1 93 93 ASN H H 93 8.647 8.647 8.311 0.336 17890 12456 1 16 . 1 1 94 94 VAL N N 94 112.437 112.437 119.134 -6.697 17890 12457 1 16 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.664 0.401 17890 12458 1 16 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.112 -1.197 17890 12459 1 16 . 1 1 94 94 VAL CB C 94 34.155 34.155 36.061 -1.906 17890 12460 1 16 . 1 1 94 94 VAL H H 94 6.989 6.989 7.516 -0.527 17890 12461 1 16 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.952 -0.024 17890 12462 1 16 . 1 1 95 95 PRO C C 95 176.041 176.041 175.577 0.464 17890 12463 1 16 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.460 -1.259 17890 12464 1 16 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.709 -0.984 17890 12465 1 16 . 1 1 96 96 VAL N N 96 113.564 113.564 116.746 -3.182 17890 12466 1 16 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.925 -0.190 17890 12467 1 16 . 1 1 96 96 VAL C C 96 173.656 173.656 175.034 -1.378 17890 12468 1 16 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.054 -0.201 17890 12469 1 16 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.406 1.747 17890 12470 1 16 . 1 1 96 96 VAL H H 96 8.199 8.199 8.866 -0.667 17890 12471 1 16 . 1 1 97 97 VAL N N 97 122.328 122.328 123.171 -0.843 17890 12472 1 16 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.782 -0.151 17890 12473 1 16 . 1 1 97 97 VAL C C 97 174.776 174.776 175.900 -1.124 17890 12474 1 16 . 1 1 97 97 VAL CA C 97 63.657 63.657 62.787 0.870 17890 12475 1 16 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.392 -0.264 17890 12476 1 16 . 1 1 97 97 VAL H H 97 8.957 8.957 8.325 0.632 17890 12477 1 16 . 1 1 98 98 LEU N N 98 130.258 130.258 126.014 4.244 17890 12478 1 16 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.920 0.130 17890 12479 1 16 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.769 1.054 17890 12480 1 16 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.205 0.913 17890 12481 1 16 . 1 1 98 98 LEU H H 98 9.245 9.245 9.134 0.111 17890 12482 1 16 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.802 -0.023 17890 12483 1 16 . 1 1 99 99 PRO CA C 99 61.489 61.489 60.979 0.510 17890 12484 1 16 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.038 -0.584 17890 12485 1 16 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.639 -0.654 17890 12486 1 16 . 1 1 100 100 PRO C C 100 177.309 177.309 175.773 1.536 17890 12487 1 16 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.034 0.790 17890 12488 1 16 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.262 -0.157 17890 12489 1 16 . 1 1 101 101 ASN N N 101 119.284 119.284 125.868 -6.584 17890 12490 1 16 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.615 -0.073 17890 12491 1 16 . 1 1 101 101 ASN C C 101 171.920 171.920 173.886 -1.966 17890 12492 1 16 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.736 -0.535 17890 12493 1 16 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.384 -1.759 17890 12494 1 16 . 1 1 101 101 ASN H H 101 7.273 7.273 9.318 -2.045 17890 12495 1 16 . 1 1 102 102 ASN N N 102 115.674 115.674 116.285 -0.611 17890 12496 1 16 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.734 -0.816 17890 12497 1 16 . 1 1 102 102 ASN C C 102 173.264 173.264 174.327 -1.063 17890 12498 1 16 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.775 1.264 17890 12499 1 16 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.017 -1.034 17890 12500 1 16 . 1 1 102 102 ASN H H 102 8.197 8.197 7.721 0.476 17890 12501 1 16 . 1 1 103 103 TYR N N 103 118.775 118.775 121.280 -2.505 17890 12502 1 16 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.351 0.134 17890 12503 1 16 . 1 1 103 103 TYR C C 103 175.248 175.248 174.927 0.321 17890 12504 1 16 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.956 -2.466 17890 12505 1 16 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.607 -1.075 17890 12506 1 16 . 1 1 103 103 TYR H H 103 7.745 7.745 7.165 0.580 17890 12507 1 16 . 1 1 104 104 VAL N N 104 116.205 116.205 115.567 0.638 17890 12508 1 16 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.935 0.042 17890 12509 1 16 . 1 1 104 104 VAL C C 104 174.361 174.361 173.680 0.681 17890 12510 1 16 . 1 1 104 104 VAL CA C 104 58.251 58.251 60.193 -1.942 17890 12511 1 16 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.653 -0.110 17890 12512 1 16 . 1 1 104 104 VAL H H 104 7.498 7.498 8.029 -0.531 17890 12513 1 16 . 1 1 105 105 TRP N N 105 119.557 119.557 119.989 -0.432 17890 12514 1 16 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.066 -0.191 17890 12515 1 16 . 1 1 105 105 TRP C C 105 175.526 175.526 176.384 -0.858 17890 12516 1 16 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.279 -0.395 17890 12517 1 16 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.512 0.027 17890 12518 1 16 . 1 1 105 105 TRP H H 105 8.926 8.926 8.938 -0.012 17890 12519 1 16 . 1 1 106 106 THR N N 106 120.480 120.480 120.148 0.332 17890 12520 1 16 . 1 1 106 106 THR HA H 106 4.966 4.966 4.805 0.161 17890 12521 1 16 . 1 1 106 106 THR C C 106 174.177 174.177 173.971 0.206 17890 12522 1 16 . 1 1 106 106 THR CA C 106 62.091 62.091 64.152 -2.061 17890 12523 1 16 . 1 1 106 106 THR CB C 106 69.649 69.649 68.890 0.759 17890 12524 1 16 . 1 1 106 106 THR H H 106 9.525 9.525 9.155 0.370 17890 12525 1 16 . 1 1 107 107 LEU N N 107 127.146 127.146 129.821 -2.675 17890 12526 1 16 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.173 -0.346 17890 12527 1 16 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.550 0.159 17890 12528 1 16 . 1 1 107 107 LEU CB C 107 41.523 41.523 44.161 -2.638 17890 12529 1 16 . 1 1 107 107 LEU H H 107 7.591 7.591 8.868 -1.277 17890 12530 1 16 . 1 1 108 108 THR N N 108 119.928 119.928 120.086 -0.158 17890 12531 1 16 . 1 1 108 108 THR HA H 108 4.411 4.411 4.687 -0.276 17890 12532 1 16 . 1 1 108 108 THR C C 108 173.319 173.319 173.071 0.248 17890 12533 1 16 . 1 1 108 108 THR CA C 108 62.243 62.243 61.545 0.698 17890 12534 1 16 . 1 1 108 108 THR CB C 108 70.138 70.138 71.055 -0.917 17890 12535 1 16 . 1 1 108 108 THR H H 108 8.141 8.141 8.703 -0.562 17890 12536 1 16 . 1 1 109 109 LEU N N 109 130.557 130.557 128.684 1.873 17890 12537 1 16 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.902 -0.357 17890 12538 1 16 . 1 1 109 109 LEU C C 109 175.217 175.217 176.561 -1.344 17890 12539 1 16 . 1 1 109 109 LEU CA C 109 55.286 55.286 54.935 0.351 17890 12540 1 16 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.776 -2.170 17890 12541 1 16 . 1 1 109 109 LEU H H 109 8.924 8.924 8.650 0.274 17890 12542 1 16 . 1 1 110 110 THR N N 110 120.160 120.160 115.291 4.869 17890 12543 1 16 . 1 1 110 110 THR HA H 110 4.911 4.911 4.726 0.185 17890 12544 1 16 . 1 1 110 110 THR CA C 110 60.141 60.141 60.246 -0.105 17890 12545 1 16 . 1 1 110 110 THR CB C 110 72.785 72.785 71.062 1.723 17890 12546 1 16 . 1 1 110 110 THR H H 110 7.677 7.677 8.341 -0.664 17890 12547 1 16 . 1 1 111 111 SER HA H 111 4.204 4.204 4.240 -0.036 17890 12548 1 16 . 1 1 111 111 SER C C 111 174.755 174.755 175.297 -0.542 17890 12549 1 16 . 1 1 111 111 SER CA C 111 60.710 60.710 59.743 0.967 17890 12550 1 16 . 1 1 111 111 SER CB C 111 62.660 62.660 62.890 -0.230 17890 12551 1 16 . 1 1 112 112 GLY N N 112 107.313 107.313 108.284 -0.971 17890 12552 1 16 . 1 1 112 112 GLY C C 112 173.023 173.023 172.783 0.240 17890 12553 1 16 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.123 -0.973 17890 12554 1 16 . 1 1 112 112 GLY H H 112 8.249 8.249 7.628 0.621 17890 12555 1 16 . 1 1 113 113 GLY N N 113 105.618 105.618 107.618 -2.000 17890 12556 1 16 . 1 1 113 113 GLY C C 113 175.844 175.844 171.920 3.924 17890 12557 1 16 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.530 -2.771 17890 12558 1 16 . 1 1 113 113 GLY H H 113 7.444 7.444 7.305 0.139 17890 12559 1 16 . 1 1 114 114 TYR N N 114 121.548 121.548 117.212 4.336 17890 12560 1 16 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.477 -0.625 17890 12561 1 16 . 1 1 114 114 TYR C C 114 175.605 175.605 174.165 1.440 17890 12562 1 16 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.770 4.493 17890 12563 1 16 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.613 -4.680 17890 12564 1 16 . 1 1 114 114 TYR H H 114 9.677 9.677 9.027 0.650 17890 12565 1 16 . 1 1 115 115 ASN N N 115 123.274 123.274 117.198 6.076 17890 12566 1 16 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.207 -0.109 17890 12567 1 16 . 1 1 115 115 ASN C C 115 174.355 174.355 173.207 1.148 17890 12568 1 16 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.358 -1.312 17890 12569 1 16 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.761 -2.412 17890 12570 1 16 . 1 1 115 115 ASN H H 115 9.350 9.350 9.020 0.330 17890 12571 1 16 . 1 1 116 116 ILE N N 116 130.611 130.611 122.443 8.168 17890 12572 1 16 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.663 -0.424 17890 12573 1 16 . 1 1 116 116 ILE C C 116 173.998 173.998 173.836 0.162 17890 12574 1 16 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.253 1.946 17890 12575 1 16 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.344 -2.244 17890 12576 1 16 . 1 1 116 116 ILE H H 116 9.473 9.473 8.599 0.874 17890 12577 1 16 . 1 1 117 117 GLN N N 117 121.633 121.633 125.020 -3.387 17890 12578 1 16 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.027 0.908 17890 12579 1 16 . 1 1 117 117 GLN C C 117 177.902 177.902 175.899 2.003 17890 12580 1 16 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.827 -0.507 17890 12581 1 16 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.487 3.970 17890 12582 1 16 . 1 1 117 117 GLN H H 117 8.781 8.781 8.842 -0.061 17890 12583 1 16 . 1 1 118 118 ASP N N 118 116.836 116.836 120.081 -3.245 17890 12584 1 16 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.895 0.888 17890 12585 1 16 . 1 1 118 118 ASP C C 118 178.084 178.084 176.657 1.427 17890 12586 1 16 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.272 -1.502 17890 12587 1 16 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.237 -0.869 17890 12588 1 16 . 1 1 118 118 ASP H H 118 9.330 9.330 8.621 0.709 17890 12589 1 16 . 1 1 119 119 GLY N N 119 111.037 111.037 108.102 2.935 17890 12590 1 16 . 1 1 119 119 GLY C C 119 174.196 174.196 175.677 -1.481 17890 12591 1 16 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.883 2.093 17890 12592 1 16 . 1 1 119 119 GLY H H 119 8.986 8.986 8.311 0.675 17890 12593 1 16 . 1 1 120 120 LYS N N 120 114.809 114.809 122.087 -7.278 17890 12594 1 16 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.505 -0.156 17890 12595 1 16 . 1 1 120 120 LYS C C 120 175.174 175.174 176.318 -1.144 17890 12596 1 16 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.205 1.728 17890 12597 1 16 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.574 -0.098 17890 12598 1 16 . 1 1 120 120 LYS H H 120 7.045 7.045 8.801 -1.756 17890 12599 1 16 . 1 1 121 121 ARG N N 121 116.291 116.291 113.965 2.326 17890 12600 1 16 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.064 -0.478 17890 12601 1 16 . 1 1 121 121 ARG C C 121 175.097 175.097 177.132 -2.035 17890 12602 1 16 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.103 0.966 17890 12603 1 16 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.836 -0.213 17890 12604 1 16 . 1 1 121 121 ARG H H 121 7.683 7.683 7.963 -0.280 17890 12605 1 16 . 1 1 122 122 THR N N 122 113.730 113.730 109.640 4.090 17890 12606 1 16 . 1 1 122 122 THR HA H 122 4.540 4.540 4.228 0.312 17890 12607 1 16 . 1 1 122 122 THR C C 122 175.302 175.302 174.509 0.793 17890 12608 1 16 . 1 1 122 122 THR CA C 122 62.871 62.871 64.189 -1.319 17890 12609 1 16 . 1 1 122 122 THR CB C 122 71.552 71.552 69.999 1.553 17890 12610 1 16 . 1 1 122 122 THR H H 122 11.059 11.059 8.113 2.946 17890 12611 1 16 . 1 1 123 123 VAL N N 123 118.350 118.350 115.535 2.815 17890 12612 1 16 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.590 0.220 17890 12613 1 16 . 1 1 123 123 VAL C C 123 174.730 174.730 173.625 1.105 17890 12614 1 16 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.044 0.268 17890 12615 1 16 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.776 2.306 17890 12616 1 16 . 1 1 123 123 VAL H H 123 8.181 8.181 7.602 0.579 17890 12617 1 16 . 1 1 124 124 SER N N 124 113.053 113.053 113.962 -0.909 17890 12618 1 16 . 1 1 124 124 SER HA H 124 5.820 5.820 5.235 0.585 17890 12619 1 16 . 1 1 124 124 SER C C 124 175.521 175.521 173.537 1.984 17890 12620 1 16 . 1 1 124 124 SER CA C 124 58.087 58.087 56.480 1.607 17890 12621 1 16 . 1 1 124 124 SER CB C 124 67.405 67.405 65.558 1.847 17890 12622 1 16 . 1 1 124 124 SER H H 124 9.138 9.138 8.620 0.518 17890 12623 1 16 . 1 1 125 125 TRP N N 125 124.900 124.900 123.922 0.978 17890 12624 1 16 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.991 0.619 17890 12625 1 16 . 1 1 125 125 TRP C C 125 178.114 178.114 177.322 0.792 17890 12626 1 16 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.061 -0.587 17890 12627 1 16 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.243 0.780 17890 12628 1 16 . 1 1 125 125 TRP H H 125 8.843 8.843 8.011 0.832 17890 12629 1 16 . 1 1 126 126 SER N N 126 119.243 119.243 113.666 5.577 17890 12630 1 16 . 1 1 126 126 SER HA H 126 5.443 5.443 5.319 0.123 17890 12631 1 16 . 1 1 126 126 SER C C 126 171.668 171.668 173.009 -1.341 17890 12632 1 16 . 1 1 126 126 SER CA C 126 58.696 58.696 57.314 1.382 17890 12633 1 16 . 1 1 126 126 SER CB C 126 66.176 66.176 66.190 -0.014 17890 12634 1 16 . 1 1 126 126 SER H H 126 9.835 9.835 9.259 0.576 17890 12635 1 16 . 1 1 127 127 LEU N N 127 113.708 113.708 119.075 -5.367 17890 12636 1 16 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.638 0.517 17890 12637 1 16 . 1 1 127 127 LEU C C 127 176.563 176.563 176.192 0.371 17890 12638 1 16 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.615 -0.970 17890 12639 1 16 . 1 1 127 127 LEU CB C 127 43.696 43.696 44.278 -0.582 17890 12640 1 16 . 1 1 127 127 LEU H H 127 6.559 6.559 8.304 -1.745 17890 12641 1 16 . 1 1 128 128 ASN N N 128 121.739 121.739 117.480 4.259 17890 12642 1 16 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.951 -0.262 17890 12643 1 16 . 1 1 128 128 ASN C C 128 175.452 175.452 175.829 -0.377 17890 12644 1 16 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.590 1.417 17890 12645 1 16 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.485 -1.194 17890 12646 1 16 . 1 1 128 128 ASN H H 128 8.662 8.662 9.086 -0.424 17890 12647 1 16 . 1 1 129 129 ASN N N 129 119.586 119.586 116.596 2.990 17890 12648 1 16 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.907 0.090 17890 12649 1 16 . 1 1 129 129 ASN C C 129 175.900 175.900 174.869 1.031 17890 12650 1 16 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.404 0.829 17890 12651 1 16 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.041 0.215 17890 12652 1 16 . 1 1 129 129 ASN H H 129 10.962 10.962 8.810 2.152 17890 12653 1 16 . 1 1 130 130 ALA N N 130 128.292 128.292 122.657 5.635 17890 12654 1 16 . 1 1 130 130 ALA HA H 130 3.570 3.570 3.975 -0.405 17890 12655 1 16 . 1 1 130 130 ALA C C 130 172.620 172.620 176.312 -3.692 17890 12656 1 16 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.446 -0.807 17890 12657 1 16 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.186 -1.086 17890 12658 1 16 . 1 1 130 130 ALA H H 130 10.629 10.629 8.528 2.101 17890 12659 1 16 . 1 1 131 131 THR N N 131 105.584 105.584 110.775 -5.191 17890 12660 1 16 . 1 1 131 131 THR HA H 131 4.462 4.462 4.353 0.109 17890 12661 1 16 . 1 1 131 131 THR C C 131 173.552 173.552 174.514 -0.962 17890 12662 1 16 . 1 1 131 131 THR CA C 131 58.338 58.338 60.967 -2.629 17890 12663 1 16 . 1 1 131 131 THR CB C 131 71.569 71.569 70.208 1.361 17890 12664 1 16 . 1 1 131 131 THR H H 131 7.092 7.092 7.448 -0.356 17890 12665 1 16 . 1 1 132 132 ALA N N 132 121.773 121.773 123.553 -1.780 17890 12666 1 16 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.062 -0.313 17890 12667 1 16 . 1 1 132 132 ALA C C 132 178.819 178.819 178.204 0.615 17890 12668 1 16 . 1 1 132 132 ALA CA C 132 54.284 54.284 53.250 1.034 17890 12669 1 16 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.480 -0.253 17890 12670 1 16 . 1 1 132 132 ALA H H 132 8.952 8.952 8.368 0.584 17890 12671 1 16 . 1 1 133 133 GLY N N 133 113.965 113.965 112.457 1.508 17890 12672 1 16 . 1 1 133 133 GLY C C 133 173.453 173.453 174.254 -0.801 17890 12673 1 16 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.808 0.358 17890 12674 1 16 . 1 1 133 133 GLY H H 133 9.016 9.016 8.655 0.361 17890 12675 1 16 . 1 1 134 134 GLU N N 134 123.460 123.460 121.308 2.152 17890 12676 1 16 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.311 -0.353 17890 12677 1 16 . 1 1 134 134 GLU C C 134 176.120 176.120 176.098 0.022 17890 12678 1 16 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.105 1.294 17890 12679 1 16 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.987 0.398 17890 12680 1 16 . 1 1 134 134 GLU H H 134 7.598 7.598 7.604 -0.006 17890 12681 1 16 . 1 1 135 135 GLU N N 135 122.633 122.633 124.702 -2.069 17890 12682 1 16 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.232 0.079 17890 12683 1 16 . 1 1 135 135 GLU C C 135 176.014 176.014 176.647 -0.633 17890 12684 1 16 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.457 -0.275 17890 12685 1 16 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.073 -0.620 17890 12686 1 16 . 1 1 135 135 GLU H H 135 8.258 8.258 8.598 -0.340 17890 12687 1 16 . 1 1 136 136 VAL N N 136 123.635 123.635 126.270 -2.635 17890 12688 1 16 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.777 -0.085 17890 12689 1 16 . 1 1 136 136 VAL C C 136 173.932 173.932 174.914 -0.982 17890 12690 1 16 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.258 0.574 17890 12691 1 16 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.593 -0.729 17890 12692 1 16 . 1 1 136 136 VAL H H 136 7.267 7.267 7.766 -0.499 17890 12693 1 16 . 1 1 137 137 SER N N 137 118.950 118.950 121.221 -2.271 17890 12694 1 16 . 1 1 137 137 SER HA H 137 4.887 4.887 5.180 -0.293 17890 12695 1 16 . 1 1 137 137 SER C C 137 173.780 173.780 173.085 0.695 17890 12696 1 16 . 1 1 137 137 SER CA C 137 57.895 57.895 56.764 1.131 17890 12697 1 16 . 1 1 137 137 SER CB C 137 65.027 65.027 67.085 -2.058 17890 12698 1 16 . 1 1 137 137 SER H H 137 8.454 8.454 8.727 -0.273 17890 12699 1 16 . 1 1 138 138 ILE N N 138 123.511 123.511 119.773 3.738 17890 12700 1 16 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.006 -0.758 17890 12701 1 16 . 1 1 138 138 ILE C C 138 176.142 176.142 175.602 0.540 17890 12702 1 16 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.497 1.353 17890 12703 1 16 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.697 -3.102 17890 12704 1 16 . 1 1 138 138 ILE H H 138 7.915 7.915 8.347 -0.432 17890 12705 1 16 . 1 1 139 139 GLY N N 139 115.638 115.638 110.986 4.652 17890 12706 1 16 . 1 1 139 139 GLY C C 139 171.947 171.947 173.272 -1.325 17890 12707 1 16 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.420 1.666 17890 12708 1 16 . 1 1 139 139 GLY H H 139 8.490 8.490 8.442 0.048 17890 12709 1 16 . 1 1 140 140 ALA N N 140 128.563 128.563 121.373 7.190 17890 12710 1 16 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.382 0.014 17890 12711 1 16 . 1 1 140 140 ALA C C 140 177.956 177.956 177.195 0.761 17890 12712 1 16 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.647 -2.001 17890 12713 1 16 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.965 0.239 17890 12714 1 16 . 1 1 140 140 ALA H H 140 8.531 8.531 8.379 0.152 17890 12715 1 16 . 1 1 141 141 ASP N N 141 120.886 120.886 114.705 6.181 17890 12716 1 16 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.590 0.008 17890 12717 1 16 . 1 1 141 141 ASP C C 141 175.411 175.411 174.345 1.066 17890 12718 1 16 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.665 0.251 17890 12719 1 16 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.434 -1.742 17890 12720 1 16 . 1 1 141 141 ASP H H 141 8.507 8.507 7.697 0.810 17890 12721 1 16 . 1 1 142 142 ALA N N 142 125.604 125.604 123.444 2.160 17890 12722 1 16 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.657 -0.140 17890 12723 1 16 . 1 1 142 142 ALA C C 142 177.671 177.671 178.191 -0.520 17890 12724 1 16 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.489 0.504 17890 12725 1 16 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.368 0.167 17890 12726 1 16 . 1 1 142 142 ALA H H 142 7.894 7.894 8.232 -0.338 17890 12727 1 16 . 1 1 143 143 THR N N 143 118.085 118.085 117.866 0.219 17890 12728 1 16 . 1 1 143 143 THR HA H 143 3.744 3.744 4.128 -0.384 17890 12729 1 16 . 1 1 143 143 THR C C 143 175.464 175.464 174.981 0.483 17890 12730 1 16 . 1 1 143 143 THR CA C 143 64.548 64.548 65.006 -0.458 17890 12731 1 16 . 1 1 143 143 THR CB C 143 69.305 69.305 68.859 0.446 17890 12732 1 16 . 1 1 143 143 THR H H 143 8.268 8.268 8.907 -0.639 17890 12733 1 16 . 1 1 144 144 PHE N N 144 118.635 118.635 115.320 3.315 17890 12734 1 16 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.636 -0.290 17890 12735 1 16 . 1 1 144 144 PHE C C 144 176.209 176.209 174.972 1.237 17890 12736 1 16 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.890 3.572 17890 12737 1 16 . 1 1 144 144 PHE CB C 144 39.604 39.604 38.757 0.848 17890 12738 1 16 . 1 1 144 144 PHE H H 144 8.719 8.719 7.942 0.777 17890 12739 1 16 . 1 1 145 145 SER N N 145 113.446 113.446 115.551 -2.105 17890 12740 1 16 . 1 1 145 145 SER HA H 145 4.866 4.866 3.953 0.913 17890 12741 1 16 . 1 1 145 145 SER C C 145 176.605 176.605 176.103 0.502 17890 12742 1 16 . 1 1 145 145 SER CA C 145 59.432 59.432 57.316 2.116 17890 12743 1 16 . 1 1 145 145 SER CB C 145 62.167 62.167 62.853 -0.686 17890 12744 1 16 . 1 1 145 145 SER H H 145 8.657 8.657 7.207 1.450 17890 12745 1 16 . 1 1 146 146 GLY N N 146 109.277 109.277 111.533 -2.256 17890 12746 1 16 . 1 1 146 146 GLY C C 146 174.293 174.293 173.427 0.866 17890 12747 1 16 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.114 -0.174 17890 12748 1 16 . 1 1 146 146 GLY H H 146 7.467 7.467 7.642 -0.175 17890 12749 1 16 . 1 1 147 147 ARG N N 147 122.863 122.863 118.133 4.730 17890 12750 1 16 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.979 0.462 17890 12751 1 16 . 1 1 147 147 ARG C C 147 173.849 173.849 174.325 -0.476 17890 12752 1 16 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.184 -1.957 17890 12753 1 16 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.718 -1.121 17890 12754 1 16 . 1 1 147 147 ARG H H 147 7.556 7.556 7.398 0.158 17890 12755 1 16 . 1 1 148 148 TRP N N 148 118.465 118.465 120.239 -1.774 17890 12756 1 16 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.199 -0.353 17890 12757 1 16 . 1 1 148 148 TRP C C 148 174.353 174.353 174.450 -0.097 17890 12758 1 16 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.901 -1.239 17890 12759 1 16 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.233 -1.234 17890 12760 1 16 . 1 1 148 148 TRP H H 148 8.709 8.709 9.250 -0.541 17890 12761 1 16 . 1 1 149 149 VAL N N 149 125.852 125.852 118.044 7.808 17890 12762 1 16 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.357 -0.214 17890 12763 1 16 . 1 1 149 149 VAL C C 149 173.613 173.613 174.025 -0.412 17890 12764 1 16 . 1 1 149 149 VAL CA C 149 61.740 61.740 60.934 0.805 17890 12765 1 16 . 1 1 149 149 VAL CB C 149 32.383 32.383 34.908 -2.525 17890 12766 1 16 . 1 1 149 149 VAL H H 149 9.700 9.700 8.824 0.876 17890 12767 1 16 . 1 1 150 150 ILE N N 150 125.140 125.140 125.237 -0.097 17890 12768 1 16 . 1 1 150 150 ILE HA H 150 4.862 4.862 4.977 -0.115 17890 12769 1 16 . 1 1 150 150 ILE C C 150 175.661 175.661 174.405 1.256 17890 12770 1 16 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.425 1.396 17890 12771 1 16 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.831 -1.011 17890 12772 1 16 . 1 1 150 150 ILE H H 150 7.747 7.747 7.676 0.071 17890 12773 1 16 . 1 1 151 151 GLU N N 151 126.762 126.762 126.814 -0.052 17890 12774 1 16 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.863 0.017 17890 12775 1 16 . 1 1 151 151 GLU C C 151 174.424 174.424 174.764 -0.340 17890 12776 1 16 . 1 1 151 151 GLU CA C 151 54.796 54.796 53.919 0.877 17890 12777 1 16 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.855 0.396 17890 12778 1 16 . 1 1 151 151 GLU H H 151 8.892 8.892 8.738 0.154 17890 12779 1 16 . 1 1 152 152 LYS N N 152 126.299 126.299 122.456 3.843 17890 12780 1 16 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.739 0.122 17890 12781 1 16 . 1 1 152 152 LYS C C 152 176.282 176.282 176.483 -0.201 17890 12782 1 16 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.874 0.631 17890 12783 1 16 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.568 0.768 17890 12784 1 16 . 1 1 152 152 LYS H H 152 8.640 8.640 8.298 0.342 17890 12785 1 17 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.174 -1.880 17890 12786 1 17 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.954 -0.332 17890 12787 1 17 . 1 1 8 8 HIS CA C 8 55.661 55.661 56.321 -0.659 17890 12788 1 17 . 1 1 8 8 HIS CB C 8 29.880 29.880 29.972 -0.092 17890 12789 1 17 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.516 0.130 17890 12790 1 17 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.077 -0.393 17890 12791 1 17 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.118 -0.287 17890 12792 1 17 . 1 1 10 10 HIS N N 10 120.811 120.811 116.617 4.194 17890 12793 1 17 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.559 0.121 17890 12794 1 17 . 1 1 10 10 HIS C C 10 174.875 174.875 174.476 0.399 17890 12795 1 17 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.705 -0.959 17890 12796 1 17 . 1 1 10 10 HIS CB C 10 29.889 29.889 31.214 -1.325 17890 12797 1 17 . 1 1 10 10 HIS H H 10 8.583 8.583 8.222 0.361 17890 12798 1 17 . 1 1 11 11 SER N N 11 118.009 118.009 114.468 3.541 17890 12799 1 17 . 1 1 11 11 SER HA H 11 4.424 4.424 4.489 -0.065 17890 12800 1 17 . 1 1 11 11 SER C C 11 174.962 174.962 173.831 1.131 17890 12801 1 17 . 1 1 11 11 SER CA C 11 58.660 58.660 58.424 0.236 17890 12802 1 17 . 1 1 11 11 SER CB C 11 63.822 63.822 63.982 -0.160 17890 12803 1 17 . 1 1 11 11 SER H H 11 8.438 8.438 8.352 0.086 17890 12804 1 17 . 1 1 12 12 GLY N N 12 111.011 111.011 108.526 2.485 17890 12805 1 17 . 1 1 12 12 GLY C C 12 173.907 173.907 172.240 1.667 17890 12806 1 17 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.456 -0.035 17890 12807 1 17 . 1 1 12 12 GLY H H 12 8.433 8.433 7.779 0.654 17890 12808 1 17 . 1 1 13 13 ASP N N 13 120.291 120.291 116.358 3.933 17890 12809 1 17 . 1 1 13 13 ASP HA H 13 4.662 4.662 5.168 -0.506 17890 12810 1 17 . 1 1 13 13 ASP C C 13 176.115 176.115 175.832 0.283 17890 12811 1 17 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.316 0.987 17890 12812 1 17 . 1 1 13 13 ASP CB C 13 41.465 41.465 42.018 -0.553 17890 12813 1 17 . 1 1 13 13 ASP H H 13 8.153 8.153 8.560 -0.407 17890 12814 1 17 . 1 1 14 14 SER N N 14 116.987 116.987 115.171 1.816 17890 12815 1 17 . 1 1 14 14 SER HA H 14 4.754 4.754 4.896 -0.142 17890 12816 1 17 . 1 1 14 14 SER CA C 14 56.469 56.469 56.728 -0.259 17890 12817 1 17 . 1 1 14 14 SER CB C 14 63.553 63.553 65.561 -2.008 17890 12818 1 17 . 1 1 14 14 SER H H 14 8.210 8.210 7.876 0.334 17890 12819 1 17 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.424 0.018 17890 12820 1 17 . 1 1 15 15 PRO C C 15 176.424 176.424 175.945 0.479 17890 12821 1 17 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.432 -0.199 17890 12822 1 17 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.277 -0.129 17890 12823 1 17 . 1 1 16 16 ALA N N 16 124.219 124.219 124.379 -0.160 17890 12824 1 17 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.584 -0.234 17890 12825 1 17 . 1 1 16 16 ALA C C 16 177.552 177.552 175.690 1.862 17890 12826 1 17 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.160 0.273 17890 12827 1 17 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.526 -0.207 17890 12828 1 17 . 1 1 16 16 ALA H H 16 8.284 8.284 8.587 -0.303 17890 12829 1 17 . 1 1 17 17 VAL N N 17 119.504 119.504 117.642 1.862 17890 12830 1 17 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.331 -0.082 17890 12831 1 17 . 1 1 17 17 VAL C C 17 176.322 176.322 174.941 1.381 17890 12832 1 17 . 1 1 17 17 VAL CA C 17 62.278 62.278 60.741 1.537 17890 12833 1 17 . 1 1 17 17 VAL CB C 17 32.957 32.957 34.342 -1.385 17890 12834 1 17 . 1 1 17 17 VAL H H 17 8.046 8.046 7.422 0.624 17890 12835 1 17 . 1 1 18 18 THR N N 18 118.186 118.186 115.477 2.709 17890 12836 1 17 . 1 1 18 18 THR HA H 18 4.473 4.473 4.443 0.030 17890 12837 1 17 . 1 1 18 18 THR C C 18 174.248 174.248 174.761 -0.513 17890 12838 1 17 . 1 1 18 18 THR CA C 18 61.565 61.565 61.538 0.027 17890 12839 1 17 . 1 1 18 18 THR CB C 18 70.165 70.165 69.114 1.051 17890 12840 1 17 . 1 1 18 18 THR H H 18 8.276 8.276 8.376 -0.100 17890 12841 1 17 . 1 1 19 19 LEU N N 19 125.265 125.265 118.336 6.929 17890 12842 1 17 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.935 0.358 17890 12843 1 17 . 1 1 19 19 LEU C C 19 175.689 175.689 175.605 0.084 17890 12844 1 17 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.522 -0.095 17890 12845 1 17 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.332 1.947 17890 12846 1 17 . 1 1 19 19 LEU H H 19 8.091 8.091 7.893 0.198 17890 12847 1 17 . 1 1 20 20 SER N N 20 114.622 114.622 115.732 -1.110 17890 12848 1 17 . 1 1 20 20 SER HA H 20 4.947 4.947 4.864 0.083 17890 12849 1 17 . 1 1 20 20 SER C C 20 174.220 174.220 173.154 1.066 17890 12850 1 17 . 1 1 20 20 SER CA C 20 56.583 56.583 57.160 -0.577 17890 12851 1 17 . 1 1 20 20 SER CB C 20 65.653 65.653 66.154 -0.501 17890 12852 1 17 . 1 1 20 20 SER H H 20 7.316 7.316 8.087 -0.771 17890 12853 1 17 . 1 1 21 21 ALA N N 21 125.517 125.517 123.819 1.698 17890 12854 1 17 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.913 -0.245 17890 12855 1 17 . 1 1 21 21 ALA C C 21 177.960 177.960 177.389 0.571 17890 12856 1 17 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.331 1.679 17890 12857 1 17 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.620 -0.395 17890 12858 1 17 . 1 1 21 21 ALA H H 21 8.993 8.993 8.466 0.527 17890 12859 1 17 . 1 1 22 22 GLY N N 22 109.543 109.543 110.813 -1.270 17890 12860 1 17 . 1 1 22 22 GLY C C 22 170.422 170.422 171.674 -1.252 17890 12861 1 17 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.195 0.186 17890 12862 1 17 . 1 1 22 22 GLY H H 22 8.411 8.411 8.874 -0.463 17890 12863 1 17 . 1 1 23 23 ASN N N 23 119.649 119.649 119.222 0.427 17890 12864 1 17 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.577 0.310 17890 12865 1 17 . 1 1 23 23 ASN C C 23 175.207 175.207 174.527 0.680 17890 12866 1 17 . 1 1 23 23 ASN CA C 23 51.821 51.821 53.492 -1.671 17890 12867 1 17 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.582 -0.827 17890 12868 1 17 . 1 1 23 23 ASN H H 23 8.092 8.092 8.457 -0.365 17890 12869 1 17 . 1 1 24 24 TYR N N 24 120.889 120.889 122.086 -1.197 17890 12870 1 17 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.201 0.054 17890 12871 1 17 . 1 1 24 24 TYR C C 24 175.667 175.667 174.414 1.253 17890 12872 1 17 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.133 0.980 17890 12873 1 17 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.607 0.219 17890 12874 1 17 . 1 1 24 24 TYR H H 24 9.914 9.914 8.801 1.113 17890 12875 1 17 . 1 1 25 25 ILE N N 25 115.978 115.978 113.550 2.428 17890 12876 1 17 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.080 0.006 17890 12877 1 17 . 1 1 25 25 ILE C C 25 175.200 175.200 174.314 0.886 17890 12878 1 17 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.528 1.017 17890 12879 1 17 . 1 1 25 25 ILE CB C 25 41.122 41.122 42.002 -0.880 17890 12880 1 17 . 1 1 25 25 ILE H H 25 9.216 9.216 9.290 -0.074 17890 12881 1 17 . 1 1 26 26 ILE N N 26 123.957 123.957 122.412 1.545 17890 12882 1 17 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.218 -0.242 17890 12883 1 17 . 1 1 26 26 ILE C C 26 174.810 174.810 174.832 -0.022 17890 12884 1 17 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.315 0.294 17890 12885 1 17 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.090 1.032 17890 12886 1 17 . 1 1 26 26 ILE H H 26 9.559 9.559 9.065 0.494 17890 12887 1 17 . 1 1 27 27 TYR N N 27 121.371 121.371 123.924 -2.553 17890 12888 1 17 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.588 0.602 17890 12889 1 17 . 1 1 27 27 TYR C C 27 173.963 173.963 173.132 0.831 17890 12890 1 17 . 1 1 27 27 TYR CA C 27 54.669 54.669 55.130 -0.461 17890 12891 1 17 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.112 0.586 17890 12892 1 17 . 1 1 27 27 TYR H H 27 9.378 9.378 9.178 0.200 17890 12893 1 17 . 1 1 28 28 ASN N N 28 121.991 121.991 119.314 2.677 17890 12894 1 17 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.655 -0.887 17890 12895 1 17 . 1 1 28 28 ASN C C 28 174.352 174.352 176.052 -1.700 17890 12896 1 17 . 1 1 28 28 ASN CA C 28 55.120 55.120 51.638 3.482 17890 12897 1 17 . 1 1 28 28 ASN CB C 28 41.446 41.446 40.045 1.401 17890 12898 1 17 . 1 1 28 28 ASN H H 28 8.466 8.466 8.594 -0.128 17890 12899 1 17 . 1 1 29 29 ARG N N 29 121.103 121.103 127.367 -6.264 17890 12900 1 17 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.135 -0.274 17890 12901 1 17 . 1 1 29 29 ARG C C 29 173.635 173.635 177.320 -3.685 17890 12902 1 17 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.374 0.919 17890 12903 1 17 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.025 0.374 17890 12904 1 17 . 1 1 29 29 ARG H H 29 7.756 7.756 8.688 -0.932 17890 12905 1 17 . 1 1 30 30 VAL N N 30 118.412 118.412 118.918 -0.506 17890 12906 1 17 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.772 0.172 17890 12907 1 17 . 1 1 30 30 VAL C C 30 176.199 176.199 176.169 0.030 17890 12908 1 17 . 1 1 30 30 VAL CA C 30 62.577 62.577 64.557 -1.980 17890 12909 1 17 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.083 -1.861 17890 12910 1 17 . 1 1 30 30 VAL H H 30 8.976 8.976 7.600 1.376 17890 12911 1 17 . 1 1 31 31 LEU N N 31 125.418 125.418 115.472 9.946 17890 12912 1 17 . 1 1 31 31 LEU HA H 31 4.485 4.485 3.924 0.561 17890 12913 1 17 . 1 1 31 31 LEU C C 31 179.123 179.123 176.357 2.766 17890 12914 1 17 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.918 -1.893 17890 12915 1 17 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.220 4.361 17890 12916 1 17 . 1 1 31 31 LEU H H 31 8.856 8.856 7.905 0.951 17890 12917 1 17 . 1 1 32 32 SER N N 32 116.890 116.890 112.926 3.964 17890 12918 1 17 . 1 1 32 32 SER HA H 32 5.365 5.365 5.426 -0.061 17890 12919 1 17 . 1 1 32 32 SER CA C 32 57.269 57.269 55.438 1.831 17890 12920 1 17 . 1 1 32 32 SER CB C 32 62.213 62.213 64.943 -2.730 17890 12921 1 17 . 1 1 32 32 SER H H 32 9.307 9.307 8.023 1.284 17890 12922 1 17 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.300 -0.420 17890 12923 1 17 . 1 1 33 33 PRO C C 33 175.137 175.137 177.431 -2.294 17890 12924 1 17 . 1 1 33 33 PRO CA C 33 65.285 65.285 65.579 -0.294 17890 12925 1 17 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.544 0.487 17890 12926 1 17 . 1 1 34 34 ARG N N 34 110.279 110.279 118.715 -8.436 17890 12927 1 17 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.212 0.280 17890 12928 1 17 . 1 1 34 34 ARG C C 34 176.844 176.844 177.135 -0.291 17890 12929 1 17 . 1 1 34 34 ARG CA C 34 54.436 54.436 56.179 -1.744 17890 12930 1 17 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.178 0.406 17890 12931 1 17 . 1 1 34 34 ARG H H 34 7.257 7.257 8.040 -0.783 17890 12932 1 17 . 1 1 35 35 GLY N N 35 110.288 110.288 105.983 4.305 17890 12933 1 17 . 1 1 35 35 GLY C C 35 173.336 173.336 174.071 -0.735 17890 12934 1 17 . 1 1 35 35 GLY CA C 35 47.030 47.030 45.063 1.967 17890 12935 1 17 . 1 1 35 35 GLY H H 35 8.589 8.589 7.920 0.669 17890 12936 1 17 . 1 1 36 36 GLU N N 36 116.838 116.838 118.735 -1.897 17890 12937 1 17 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.710 -0.362 17890 12938 1 17 . 1 1 36 36 GLU C C 36 176.915 176.915 175.410 1.505 17890 12939 1 17 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.106 0.801 17890 12940 1 17 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.350 -2.935 17890 12941 1 17 . 1 1 36 36 GLU H H 36 7.769 7.769 7.715 0.054 17890 12942 1 17 . 1 1 37 37 LYS N N 37 123.775 123.775 120.417 3.358 17890 12943 1 17 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.150 0.273 17890 12944 1 17 . 1 1 37 37 LYS C C 37 176.067 176.067 175.614 0.453 17890 12945 1 17 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.646 -0.745 17890 12946 1 17 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.813 0.861 17890 12947 1 17 . 1 1 37 37 LYS H H 37 8.667 8.667 8.653 0.014 17890 12948 1 17 . 1 1 38 38 LEU N N 38 126.658 126.658 125.524 1.134 17890 12949 1 17 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.917 -0.690 17890 12950 1 17 . 1 1 38 38 LEU C C 38 174.332 174.332 175.216 -0.884 17890 12951 1 17 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.590 -0.247 17890 12952 1 17 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.864 -1.213 17890 12953 1 17 . 1 1 38 38 LEU H H 38 10.455 10.455 8.865 1.590 17890 12954 1 17 . 1 1 39 39 ALA N N 39 127.018 127.018 126.989 0.029 17890 12955 1 17 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.318 -0.089 17890 12956 1 17 . 1 1 39 39 ALA C C 39 178.694 178.694 175.944 2.750 17890 12957 1 17 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.154 0.071 17890 12958 1 17 . 1 1 39 39 ALA CB C 39 21.349 21.349 21.074 0.275 17890 12959 1 17 . 1 1 39 39 ALA H H 39 8.773 8.773 8.511 0.262 17890 12960 1 17 . 1 1 40 40 LEU N N 40 126.771 126.771 122.162 4.609 17890 12961 1 17 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.607 -0.253 17890 12962 1 17 . 1 1 40 40 LEU C C 40 178.309 178.309 176.579 1.730 17890 12963 1 17 . 1 1 40 40 LEU CA C 40 56.845 56.845 55.909 0.936 17890 12964 1 17 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.956 0.367 17890 12965 1 17 . 1 1 40 40 LEU H H 40 9.665 9.665 8.650 1.015 17890 12966 1 17 . 1 1 41 41 THR N N 41 126.578 126.578 124.489 2.089 17890 12967 1 17 . 1 1 41 41 THR HA H 41 4.916 4.916 5.240 -0.324 17890 12968 1 17 . 1 1 41 41 THR C C 41 172.547 172.547 173.538 -0.991 17890 12969 1 17 . 1 1 41 41 THR CA C 41 63.253 63.253 61.585 1.668 17890 12970 1 17 . 1 1 41 41 THR CB C 41 71.832 71.832 70.602 1.230 17890 12971 1 17 . 1 1 41 41 THR H H 41 9.802 9.802 9.102 0.700 17890 12972 1 17 . 1 1 42 42 TYR N N 42 130.506 130.506 129.478 1.028 17890 12973 1 17 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.603 0.499 17890 12974 1 17 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.584 -3.598 17890 12975 1 17 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.649 -0.494 17890 12976 1 17 . 1 1 42 42 TYR H H 42 9.428 9.428 8.537 0.891 17890 12977 1 17 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.411 0.079 17890 12978 1 17 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.024 0.549 17890 12979 1 17 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.574 0.070 17890 12980 1 17 . 1 1 44 44 GLY N N 44 113.736 113.736 106.501 7.235 17890 12981 1 17 . 1 1 44 44 GLY C C 44 171.790 171.790 173.375 -1.585 17890 12982 1 17 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.133 0.583 17890 12983 1 17 . 1 1 44 44 GLY H H 44 8.337 8.337 7.721 0.616 17890 12984 1 17 . 1 1 45 45 ARG N N 45 113.899 113.899 116.355 -2.456 17890 12985 1 17 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.523 0.053 17890 12986 1 17 . 1 1 45 45 ARG C C 45 175.151 175.151 173.470 1.681 17890 12987 1 17 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.085 0.080 17890 12988 1 17 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.616 1.603 17890 12989 1 17 . 1 1 45 45 ARG H H 45 6.463 6.463 7.382 -0.919 17890 12990 1 17 . 1 1 46 46 GLN N N 46 119.000 119.000 117.918 1.082 17890 12991 1 17 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.503 -0.054 17890 12992 1 17 . 1 1 46 46 GLN C C 46 177.282 177.282 176.303 0.979 17890 12993 1 17 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.253 1.360 17890 12994 1 17 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.695 0.801 17890 12995 1 17 . 1 1 46 46 GLN H H 46 8.683 8.683 8.522 0.161 17890 12996 1 17 . 1 1 47 47 ARG N N 47 113.526 113.526 120.894 -7.368 17890 12997 1 17 . 1 1 47 47 ARG HA H 47 3.530 3.530 3.997 -0.467 17890 12998 1 17 . 1 1 47 47 ARG C C 47 174.130 174.130 174.883 -0.753 17890 12999 1 17 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.255 1.561 17890 13000 1 17 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.431 0.638 17890 13001 1 17 . 1 1 47 47 ARG H H 47 9.677 9.677 8.533 1.145 17890 13002 1 17 . 1 1 48 48 THR N N 48 114.672 114.672 114.668 0.004 17890 13003 1 17 . 1 1 48 48 THR HA H 48 4.938 4.938 4.678 0.260 17890 13004 1 17 . 1 1 48 48 THR CA C 48 59.987 59.987 60.220 -0.233 17890 13005 1 17 . 1 1 48 48 THR CB C 48 71.947 71.947 71.001 0.946 17890 13006 1 17 . 1 1 48 48 THR H H 48 8.104 8.104 7.585 0.519 17890 13007 1 17 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.563 -0.195 17890 13008 1 17 . 1 1 49 49 PRO C C 49 175.651 175.651 176.272 -0.621 17890 13009 1 17 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.374 0.807 17890 13010 1 17 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.270 0.427 17890 13011 1 17 . 1 1 50 50 VAL N N 50 122.562 122.562 121.109 1.453 17890 13012 1 17 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.227 -0.280 17890 13013 1 17 . 1 1 50 50 VAL C C 50 174.493 174.493 175.591 -1.098 17890 13014 1 17 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.165 2.646 17890 13015 1 17 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.758 -2.590 17890 13016 1 17 . 1 1 50 50 VAL H H 50 8.123 8.123 8.404 -0.281 17890 13017 1 17 . 1 1 51 51 THR N N 51 113.549 113.549 119.631 -6.082 17890 13018 1 17 . 1 1 51 51 THR HA H 51 5.372 5.372 4.719 0.653 17890 13019 1 17 . 1 1 51 51 THR C C 51 174.841 174.841 173.024 1.817 17890 13020 1 17 . 1 1 51 51 THR CA C 51 59.196 59.196 60.866 -1.670 17890 13021 1 17 . 1 1 51 51 THR CB C 51 72.703 72.703 71.700 1.003 17890 13022 1 17 . 1 1 51 51 THR H H 51 7.057 7.057 8.147 -1.090 17890 13023 1 17 . 1 1 52 52 VAL N N 52 107.374 107.374 117.357 -9.983 17890 13024 1 17 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.319 0.195 17890 13025 1 17 . 1 1 52 52 VAL C C 52 175.697 175.697 174.206 1.491 17890 13026 1 17 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.994 -1.522 17890 13027 1 17 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.889 -0.115 17890 13028 1 17 . 1 1 52 52 VAL H H 52 8.062 8.062 8.574 -0.512 17890 13029 1 17 . 1 1 53 53 SER N N 53 114.662 114.662 119.675 -5.013 17890 13030 1 17 . 1 1 53 53 SER HA H 53 4.690 4.690 5.029 -0.339 17890 13031 1 17 . 1 1 53 53 SER CA C 53 56.828 56.828 56.197 0.631 17890 13032 1 17 . 1 1 53 53 SER CB C 53 64.789 64.789 65.673 -0.884 17890 13033 1 17 . 1 1 53 53 SER H H 53 8.681 8.681 8.931 -0.250 17890 13034 1 17 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.839 -0.063 17890 13035 1 17 . 1 1 54 54 PRO C C 54 177.724 177.724 176.194 1.530 17890 13036 1 17 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.184 0.241 17890 13037 1 17 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.398 -0.300 17890 13038 1 17 . 1 1 55 55 LEU N N 55 128.655 128.655 120.664 7.991 17890 13039 1 17 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.651 -0.124 17890 13040 1 17 . 1 1 55 55 LEU C C 55 178.696 178.696 175.958 2.738 17890 13041 1 17 . 1 1 55 55 LEU CA C 55 56.246 56.246 54.166 2.080 17890 13042 1 17 . 1 1 55 55 LEU CB C 55 43.606 43.606 45.018 -1.412 17890 13043 1 17 . 1 1 55 55 LEU H H 55 8.675 8.675 8.114 0.561 17890 13044 1 17 . 1 1 56 56 ASP N N 56 126.651 126.651 123.675 2.976 17890 13045 1 17 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.645 0.064 17890 13046 1 17 . 1 1 56 56 ASP C C 56 177.729 177.729 176.347 1.382 17890 13047 1 17 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.762 -1.139 17890 13048 1 17 . 1 1 56 56 ASP CB C 56 41.632 41.632 41.886 -0.254 17890 13049 1 17 . 1 1 56 56 ASP H H 56 9.683 9.683 8.723 0.960 17890 13050 1 17 . 1 1 57 57 GLY N N 57 109.299 109.299 108.126 1.173 17890 13051 1 17 . 1 1 57 57 GLY C C 57 174.558 174.558 174.446 0.112 17890 13052 1 17 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.730 1.224 17890 13053 1 17 . 1 1 57 57 GLY H H 57 8.157 8.157 8.133 0.024 17890 13054 1 17 . 1 1 58 58 SER N N 58 116.740 116.740 117.295 -0.555 17890 13055 1 17 . 1 1 58 58 SER HA H 58 4.288 4.288 4.645 -0.357 17890 13056 1 17 . 1 1 58 58 SER C C 58 177.252 177.252 176.156 1.096 17890 13057 1 17 . 1 1 58 58 SER CA C 58 58.737 58.737 56.926 1.811 17890 13058 1 17 . 1 1 58 58 SER CB C 58 64.576 64.576 63.894 0.682 17890 13059 1 17 . 1 1 58 58 SER H H 58 8.328 8.328 7.897 0.431 17890 13060 1 17 . 1 1 59 59 SER N N 59 119.768 119.768 122.750 -2.982 17890 13061 1 17 . 1 1 59 59 SER HA H 59 4.046 4.046 4.215 -0.169 17890 13062 1 17 . 1 1 59 59 SER C C 59 176.671 176.671 176.137 0.534 17890 13063 1 17 . 1 1 59 59 SER CA C 59 61.691 61.691 59.800 1.891 17890 13064 1 17 . 1 1 59 59 SER CB C 59 63.154 63.154 62.925 0.230 17890 13065 1 17 . 1 1 59 59 SER H H 59 9.020 9.020 8.909 0.111 17890 13066 1 17 . 1 1 60 60 GLU N N 60 119.133 119.133 121.954 -2.821 17890 13067 1 17 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.026 0.160 17890 13068 1 17 . 1 1 60 60 GLU C C 60 177.435 177.435 177.242 0.193 17890 13069 1 17 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.472 1.561 17890 13070 1 17 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.495 -1.269 17890 13071 1 17 . 1 1 60 60 GLU H H 60 8.832 8.832 7.599 1.233 17890 13072 1 17 . 1 1 61 61 GLN N N 61 118.818 118.818 115.680 3.138 17890 13073 1 17 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.017 0.160 17890 13074 1 17 . 1 1 61 61 GLN C C 61 173.254 173.254 175.220 -1.966 17890 13075 1 17 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.838 -0.465 17890 13076 1 17 . 1 1 61 61 GLN CB C 61 27.922 27.922 29.678 -1.756 17890 13077 1 17 . 1 1 61 61 GLN H H 61 7.648 7.648 7.493 0.155 17890 13078 1 17 . 1 1 62 62 ALA N N 62 122.562 122.562 121.946 0.616 17890 13079 1 17 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.523 0.541 17890 13080 1 17 . 1 1 62 62 ALA C C 62 176.637 176.637 175.381 1.256 17890 13081 1 17 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.134 0.045 17890 13082 1 17 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.138 -0.543 17890 13083 1 17 . 1 1 62 62 ALA H H 62 7.315 7.315 7.038 0.277 17890 13084 1 17 . 1 1 63 63 TRP N N 63 124.787 124.787 120.010 4.777 17890 13085 1 17 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.262 -0.298 17890 13086 1 17 . 1 1 63 63 TRP C C 63 174.351 174.351 175.249 -0.898 17890 13087 1 17 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.212 -0.310 17890 13088 1 17 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.792 -1.675 17890 13089 1 17 . 1 1 63 63 TRP H H 63 9.544 9.544 8.948 0.596 17890 13090 1 17 . 1 1 64 64 ILE N N 64 122.482 122.482 119.233 3.249 17890 13091 1 17 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.963 -0.269 17890 13092 1 17 . 1 1 64 64 ILE C C 64 177.078 177.078 174.277 2.801 17890 13093 1 17 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.585 0.446 17890 13094 1 17 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.300 -0.931 17890 13095 1 17 . 1 1 64 64 ILE H H 64 10.235 10.235 9.389 0.846 17890 13096 1 17 . 1 1 65 65 LEU N N 65 132.183 132.183 128.790 3.393 17890 13097 1 17 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.496 -0.031 17890 13098 1 17 . 1 1 65 65 LEU C C 65 177.048 177.048 174.467 2.581 17890 13099 1 17 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.845 0.504 17890 13100 1 17 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.118 -3.774 17890 13101 1 17 . 1 1 65 65 LEU H H 65 9.432 9.432 9.224 0.208 17890 13102 1 17 . 1 1 66 66 ARG N N 66 120.807 120.807 125.185 -4.378 17890 13103 1 17 . 1 1 66 66 ARG HA H 66 4.888 4.888 5.039 -0.151 17890 13104 1 17 . 1 1 66 66 ARG C C 66 175.275 175.275 174.723 0.552 17890 13105 1 17 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.634 0.421 17890 13106 1 17 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.584 -1.593 17890 13107 1 17 . 1 1 66 66 ARG H H 66 8.491 8.491 8.405 0.086 17890 13108 1 17 . 1 1 67 67 SER N N 67 119.709 119.709 117.982 1.727 17890 13109 1 17 . 1 1 67 67 SER HA H 67 3.186 3.186 3.307 -0.121 17890 13110 1 17 . 1 1 67 67 SER C C 67 174.508 174.508 173.603 0.905 17890 13111 1 17 . 1 1 67 67 SER CA C 67 58.521 58.521 58.935 -0.414 17890 13112 1 17 . 1 1 67 67 SER CB C 67 62.590 62.590 63.178 -0.588 17890 13113 1 17 . 1 1 67 67 SER H H 67 8.557 8.557 8.693 -0.136 17890 13114 1 17 . 1 1 68 68 TYR N N 68 131.011 131.011 127.618 3.393 17890 13115 1 17 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.650 -0.202 17890 13116 1 17 . 1 1 68 68 TYR C C 68 174.687 174.687 174.794 -0.107 17890 13117 1 17 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.750 1.015 17890 13118 1 17 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.974 -1.986 17890 13119 1 17 . 1 1 68 68 TYR H H 68 8.531 8.531 8.640 -0.109 17890 13120 1 17 . 1 1 69 69 ASP N N 69 117.066 117.066 120.046 -2.980 17890 13121 1 17 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.816 -0.191 17890 13122 1 17 . 1 1 69 69 ASP C C 69 176.455 176.455 176.520 -0.065 17890 13123 1 17 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.873 -0.782 17890 13124 1 17 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.838 -0.691 17890 13125 1 17 . 1 1 69 69 ASP H H 69 7.122 7.122 7.745 -0.623 17890 13126 1 17 . 1 1 70 70 SER N N 70 122.869 122.869 119.625 3.244 17890 13127 1 17 . 1 1 70 70 SER HA H 70 4.270 4.270 4.123 0.147 17890 13128 1 17 . 1 1 70 70 SER C C 70 177.010 177.010 176.196 0.814 17890 13129 1 17 . 1 1 70 70 SER CA C 70 60.837 60.837 61.873 -1.036 17890 13130 1 17 . 1 1 70 70 SER CB C 70 62.722 62.722 63.102 -0.381 17890 13131 1 17 . 1 1 70 70 SER H H 70 8.757 8.757 8.822 -0.065 17890 13132 1 17 . 1 1 71 71 ASN N N 71 119.873 119.873 119.362 0.511 17890 13133 1 17 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.601 -0.030 17890 13134 1 17 . 1 1 71 71 ASN C C 71 176.226 176.226 176.044 0.182 17890 13135 1 17 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.367 0.347 17890 13136 1 17 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.386 0.255 17890 13137 1 17 . 1 1 71 71 ASN H H 71 8.342 8.342 8.610 -0.268 17890 13138 1 17 . 1 1 72 72 SER N N 72 112.202 112.202 113.027 -0.825 17890 13139 1 17 . 1 1 72 72 SER HA H 72 4.567 4.567 4.722 -0.155 17890 13140 1 17 . 1 1 72 72 SER C C 72 173.789 173.789 173.699 0.090 17890 13141 1 17 . 1 1 72 72 SER CA C 72 57.816 57.816 58.131 -0.315 17890 13142 1 17 . 1 1 72 72 SER CB C 72 63.935 63.935 64.709 -0.774 17890 13143 1 17 . 1 1 72 72 SER H H 72 7.560 7.560 7.779 -0.219 17890 13144 1 17 . 1 1 73 73 ASN N N 73 117.437 117.437 118.750 -1.313 17890 13145 1 17 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.421 0.113 17890 13146 1 17 . 1 1 73 73 ASN C C 73 173.647 173.647 174.025 -0.378 17890 13147 1 17 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.501 0.022 17890 13148 1 17 . 1 1 73 73 ASN CB C 73 37.213 37.213 36.534 0.679 17890 13149 1 17 . 1 1 73 73 ASN H H 73 7.940 7.940 7.995 -0.055 17890 13150 1 17 . 1 1 74 74 THR N N 74 104.227 104.227 108.473 -4.246 17890 13151 1 17 . 1 1 74 74 THR HA H 74 5.477 5.477 5.208 0.269 17890 13152 1 17 . 1 1 74 74 THR C C 74 176.824 176.824 173.856 2.968 17890 13153 1 17 . 1 1 74 74 THR CA C 74 59.768 59.768 61.190 -1.422 17890 13154 1 17 . 1 1 74 74 THR CB C 74 71.985 71.985 70.435 1.550 17890 13155 1 17 . 1 1 74 74 THR H H 74 7.737 7.737 7.857 -0.120 17890 13156 1 17 . 1 1 75 75 TRP N N 75 124.636 124.636 123.477 1.159 17890 13157 1 17 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.407 -0.200 17890 13158 1 17 . 1 1 75 75 TRP C C 75 175.876 175.876 176.181 -0.305 17890 13159 1 17 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.294 1.312 17890 13160 1 17 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.390 0.126 17890 13161 1 17 . 1 1 75 75 TRP H H 75 9.442 9.442 9.336 0.106 17890 13162 1 17 . 1 1 76 76 THR N N 76 110.544 110.544 114.514 -3.970 17890 13163 1 17 . 1 1 76 76 THR HA H 76 5.129 5.129 4.977 0.152 17890 13164 1 17 . 1 1 76 76 THR C C 76 174.506 174.506 174.557 -0.051 17890 13165 1 17 . 1 1 76 76 THR CA C 76 60.561 60.561 61.464 -0.903 17890 13166 1 17 . 1 1 76 76 THR CB C 76 71.688 71.688 69.979 1.709 17890 13167 1 17 . 1 1 76 76 THR H H 76 9.415 9.415 9.358 0.057 17890 13168 1 17 . 1 1 77 77 ILE N N 77 121.567 121.567 124.169 -2.602 17890 13169 1 17 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.205 -0.066 17890 13170 1 17 . 1 1 77 77 ILE C C 77 176.148 176.148 175.201 0.947 17890 13171 1 17 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.761 1.948 17890 13172 1 17 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.554 1.433 17890 13173 1 17 . 1 1 77 77 ILE H H 77 9.255 9.255 8.384 0.871 17890 13174 1 17 . 1 1 78 78 SER N N 78 122.269 122.269 121.692 0.577 17890 13175 1 17 . 1 1 78 78 SER HA H 78 5.601 5.601 5.228 0.373 17890 13176 1 17 . 1 1 78 78 SER CA C 78 55.835 55.835 55.810 0.024 17890 13177 1 17 . 1 1 78 78 SER CB C 78 65.858 65.858 66.217 -0.359 17890 13178 1 17 . 1 1 78 78 SER H H 78 9.226 9.226 8.652 0.574 17890 13179 1 17 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.387 -0.523 17890 13180 1 17 . 1 1 79 79 PRO C C 79 178.175 178.175 177.253 0.922 17890 13181 1 17 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.146 0.738 17890 13182 1 17 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.003 -1.731 17890 13183 1 17 . 1 1 80 80 VAL N N 80 121.906 121.906 116.716 5.190 17890 13184 1 17 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.786 -0.205 17890 13185 1 17 . 1 1 80 80 VAL C C 80 177.751 177.751 176.991 0.760 17890 13186 1 17 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.892 1.175 17890 13187 1 17 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.196 0.289 17890 13188 1 17 . 1 1 80 80 VAL H H 80 7.328 7.328 7.681 -0.353 17890 13189 1 17 . 1 1 81 81 GLY N N 81 104.643 104.643 107.322 -2.679 17890 13190 1 17 . 1 1 81 81 GLY C C 81 174.979 174.979 174.736 0.243 17890 13191 1 17 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.401 -0.312 17890 13192 1 17 . 1 1 81 81 GLY H H 81 8.949 8.949 8.395 0.554 17890 13193 1 17 . 1 1 82 82 SER N N 82 111.865 111.865 116.178 -4.313 17890 13194 1 17 . 1 1 82 82 SER HA H 82 4.646 4.646 4.802 -0.156 17890 13195 1 17 . 1 1 82 82 SER CA C 82 55.441 55.441 55.095 0.346 17890 13196 1 17 . 1 1 82 82 SER CB C 82 62.277 62.277 63.768 -1.491 17890 13197 1 17 . 1 1 82 82 SER H H 82 6.968 6.968 7.273 -0.305 17890 13198 1 17 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.449 -0.102 17890 13199 1 17 . 1 1 83 83 PRO C C 83 176.660 176.660 176.663 -0.003 17890 13200 1 17 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.613 0.590 17890 13201 1 17 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.864 0.955 17890 13202 1 17 . 1 1 84 84 ASN N N 84 116.542 116.542 114.441 2.101 17890 13203 1 17 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.561 0.440 17890 13204 1 17 . 1 1 84 84 ASN C C 84 175.825 175.825 174.762 1.063 17890 13205 1 17 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.611 -0.720 17890 13206 1 17 . 1 1 84 84 ASN CB C 84 38.744 38.744 37.989 0.755 17890 13207 1 17 . 1 1 84 84 ASN H H 84 8.502 8.502 8.396 0.106 17890 13208 1 17 . 1 1 85 85 SER N N 85 114.633 114.633 113.016 1.617 17890 13209 1 17 . 1 1 85 85 SER HA H 85 4.624 4.624 5.018 -0.394 17890 13210 1 17 . 1 1 85 85 SER C C 85 172.963 172.963 172.576 0.387 17890 13211 1 17 . 1 1 85 85 SER CA C 85 59.210 59.210 57.284 1.926 17890 13212 1 17 . 1 1 85 85 SER CB C 85 64.697 64.697 66.098 -1.401 17890 13213 1 17 . 1 1 85 85 SER H H 85 7.980 7.980 7.700 0.280 17890 13214 1 17 . 1 1 86 86 GLN N N 86 119.016 119.016 116.901 2.115 17890 13215 1 17 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.283 0.163 17890 13216 1 17 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.427 0.025 17890 13217 1 17 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.319 0.079 17890 13218 1 17 . 1 1 86 86 GLN H H 86 9.399 9.399 9.021 0.378 17890 13219 1 17 . 1 1 87 87 ILE N N 87 119.691 119.691 119.376 0.315 17890 13220 1 17 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.156 -0.581 17890 13221 1 17 . 1 1 87 87 ILE C C 87 176.505 176.505 176.134 0.371 17890 13222 1 17 . 1 1 87 87 ILE CA C 87 63.494 63.494 59.005 4.489 17890 13223 1 17 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.701 -0.504 17890 13224 1 17 . 1 1 87 87 ILE H H 87 8.970 8.970 8.338 0.632 17890 13225 1 17 . 1 1 88 88 GLY N N 88 118.378 118.378 114.177 4.201 17890 13226 1 17 . 1 1 88 88 GLY C C 88 171.397 171.397 172.048 -0.651 17890 13227 1 17 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.612 -1.008 17890 13228 1 17 . 1 1 88 88 GLY H H 88 9.752 9.752 9.094 0.658 17890 13229 1 17 . 1 1 89 89 TRP N N 89 122.749 122.749 122.149 0.600 17890 13230 1 17 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.310 -0.712 17890 13231 1 17 . 1 1 89 89 TRP C C 89 175.924 175.924 174.767 1.157 17890 13232 1 17 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.236 0.047 17890 13233 1 17 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.763 -2.677 17890 13234 1 17 . 1 1 89 89 TRP H H 89 8.215 8.215 8.408 -0.193 17890 13235 1 17 . 1 1 90 90 GLY N N 90 116.305 116.305 110.551 5.754 17890 13236 1 17 . 1 1 90 90 GLY C C 90 173.725 173.725 172.913 0.812 17890 13237 1 17 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.694 0.361 17890 13238 1 17 . 1 1 90 90 GLY H H 90 8.922 8.922 8.142 0.780 17890 13239 1 17 . 1 1 91 91 ALA N N 91 123.795 123.795 122.192 1.603 17890 13240 1 17 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.163 0.080 17890 13241 1 17 . 1 1 91 91 ALA C C 91 178.510 178.510 178.924 -0.414 17890 13242 1 17 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.467 0.023 17890 13243 1 17 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.764 -0.355 17890 13244 1 17 . 1 1 91 91 ALA H H 91 8.367 8.367 8.156 0.211 17890 13245 1 17 . 1 1 92 92 GLY N N 92 108.871 108.871 112.763 -3.892 17890 13246 1 17 . 1 1 92 92 GLY C C 92 174.528 174.528 174.871 -0.343 17890 13247 1 17 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.744 0.514 17890 13248 1 17 . 1 1 92 92 GLY H H 92 8.776 8.776 8.619 0.157 17890 13249 1 17 . 1 1 93 93 ASN N N 93 114.921 114.921 116.810 -1.889 17890 13250 1 17 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.724 -0.275 17890 13251 1 17 . 1 1 93 93 ASN C C 93 172.774 172.774 173.821 -1.047 17890 13252 1 17 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.174 0.799 17890 13253 1 17 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.151 -0.822 17890 13254 1 17 . 1 1 93 93 ASN H H 93 8.647 8.647 8.360 0.287 17890 13255 1 17 . 1 1 94 94 VAL N N 94 112.437 112.437 118.956 -6.519 17890 13256 1 17 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.587 0.478 17890 13257 1 17 . 1 1 94 94 VAL CA C 94 56.915 56.915 57.889 -0.974 17890 13258 1 17 . 1 1 94 94 VAL CB C 94 34.155 34.155 36.204 -2.049 17890 13259 1 17 . 1 1 94 94 VAL H H 94 6.989 6.989 7.506 -0.517 17890 13260 1 17 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.922 0.006 17890 13261 1 17 . 1 1 95 95 PRO C C 95 176.041 176.041 175.582 0.459 17890 13262 1 17 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.525 -1.324 17890 13263 1 17 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.537 -0.812 17890 13264 1 17 . 1 1 96 96 VAL N N 96 113.564 113.564 117.146 -3.582 17890 13265 1 17 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.944 -0.209 17890 13266 1 17 . 1 1 96 96 VAL C C 96 173.656 173.656 175.111 -1.455 17890 13267 1 17 . 1 1 96 96 VAL CA C 96 58.853 58.853 58.993 -0.140 17890 13268 1 17 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.336 1.817 17890 13269 1 17 . 1 1 96 96 VAL H H 96 8.199 8.199 8.920 -0.721 17890 13270 1 17 . 1 1 97 97 VAL N N 97 122.328 122.328 123.941 -1.613 17890 13271 1 17 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.755 -0.124 17890 13272 1 17 . 1 1 97 97 VAL C C 97 174.776 174.776 175.762 -0.986 17890 13273 1 17 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.382 0.275 17890 13274 1 17 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.863 -0.735 17890 13275 1 17 . 1 1 97 97 VAL H H 97 8.957 8.957 8.289 0.668 17890 13276 1 17 . 1 1 98 98 LEU N N 98 130.258 130.258 125.732 4.526 17890 13277 1 17 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.969 0.081 17890 13278 1 17 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.677 1.146 17890 13279 1 17 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.336 0.782 17890 13280 1 17 . 1 1 98 98 LEU H H 98 9.245 9.245 9.102 0.143 17890 13281 1 17 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.779 -0.000 17890 13282 1 17 . 1 1 99 99 PRO CA C 99 61.489 61.489 60.853 0.635 17890 13283 1 17 . 1 1 99 99 PRO CB C 99 30.454 30.454 30.796 -0.341 17890 13284 1 17 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.502 -0.517 17890 13285 1 17 . 1 1 100 100 PRO C C 100 177.309 177.309 175.771 1.538 17890 13286 1 17 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.850 -0.026 17890 13287 1 17 . 1 1 100 100 PRO CB C 100 32.105 32.105 31.724 0.381 17890 13288 1 17 . 1 1 101 101 ASN N N 101 119.284 119.284 124.143 -4.859 17890 13289 1 17 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.648 -0.106 17890 13290 1 17 . 1 1 101 101 ASN C C 101 171.920 171.920 173.758 -1.838 17890 13291 1 17 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.364 -0.163 17890 13292 1 17 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.644 -2.019 17890 13293 1 17 . 1 1 101 101 ASN H H 101 7.273 7.273 9.333 -2.060 17890 13294 1 17 . 1 1 102 102 ASN N N 102 115.674 115.674 117.895 -2.221 17890 13295 1 17 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.793 -0.875 17890 13296 1 17 . 1 1 102 102 ASN C C 102 173.264 173.264 173.863 -0.599 17890 13297 1 17 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.740 1.299 17890 13298 1 17 . 1 1 102 102 ASN CB C 102 36.982 36.982 39.969 -2.987 17890 13299 1 17 . 1 1 102 102 ASN H H 102 8.197 8.197 7.757 0.440 17890 13300 1 17 . 1 1 103 103 TYR N N 103 118.775 118.775 120.402 -1.627 17890 13301 1 17 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.290 0.195 17890 13302 1 17 . 1 1 103 103 TYR C C 103 175.248 175.248 174.987 0.261 17890 13303 1 17 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.346 -1.856 17890 13304 1 17 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.255 -0.723 17890 13305 1 17 . 1 1 103 103 TYR H H 103 7.745 7.745 7.387 0.358 17890 13306 1 17 . 1 1 104 104 VAL N N 104 116.205 116.205 116.469 -0.264 17890 13307 1 17 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.936 0.041 17890 13308 1 17 . 1 1 104 104 VAL C C 104 174.361 174.361 173.602 0.759 17890 13309 1 17 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.771 -1.520 17890 13310 1 17 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.330 0.213 17890 13311 1 17 . 1 1 104 104 VAL H H 104 7.498 7.498 8.001 -0.503 17890 13312 1 17 . 1 1 105 105 TRP N N 105 119.557 119.557 119.091 0.466 17890 13313 1 17 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.034 -0.159 17890 13314 1 17 . 1 1 105 105 TRP C C 105 175.526 175.526 175.914 -0.388 17890 13315 1 17 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.506 -0.622 17890 13316 1 17 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.820 -0.281 17890 13317 1 17 . 1 1 105 105 TRP H H 105 8.926 8.926 9.072 -0.146 17890 13318 1 17 . 1 1 106 106 THR N N 106 120.480 120.480 119.015 1.465 17890 13319 1 17 . 1 1 106 106 THR HA H 106 4.966 4.966 4.966 0.000 17890 13320 1 17 . 1 1 106 106 THR C C 106 174.177 174.177 174.444 -0.267 17890 13321 1 17 . 1 1 106 106 THR CA C 106 62.091 62.091 64.038 -1.947 17890 13322 1 17 . 1 1 106 106 THR CB C 106 69.649 69.649 69.346 0.303 17890 13323 1 17 . 1 1 106 106 THR H H 106 9.525 9.525 9.236 0.289 17890 13324 1 17 . 1 1 107 107 LEU N N 107 127.146 127.146 129.212 -2.066 17890 13325 1 17 . 1 1 107 107 LEU HA H 107 4.827 4.827 4.988 -0.161 17890 13326 1 17 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.328 0.381 17890 13327 1 17 . 1 1 107 107 LEU CB C 107 41.523 41.523 40.400 1.123 17890 13328 1 17 . 1 1 107 107 LEU H H 107 7.591 7.591 8.742 -1.151 17890 13329 1 17 . 1 1 108 108 THR N N 108 119.928 119.928 119.572 0.356 17890 13330 1 17 . 1 1 108 108 THR HA H 108 4.411 4.411 4.418 -0.007 17890 13331 1 17 . 1 1 108 108 THR C C 108 173.319 173.319 173.503 -0.184 17890 13332 1 17 . 1 1 108 108 THR CA C 108 62.243 62.243 62.633 -0.390 17890 13333 1 17 . 1 1 108 108 THR CB C 108 70.138 70.138 69.760 0.378 17890 13334 1 17 . 1 1 108 108 THR H H 108 8.141 8.141 7.935 0.206 17890 13335 1 17 . 1 1 109 109 LEU N N 109 130.557 130.557 129.857 0.700 17890 13336 1 17 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.007 -0.462 17890 13337 1 17 . 1 1 109 109 LEU C C 109 175.217 175.217 176.339 -1.122 17890 13338 1 17 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.195 0.091 17890 13339 1 17 . 1 1 109 109 LEU CB C 109 40.606 40.606 43.199 -2.593 17890 13340 1 17 . 1 1 109 109 LEU H H 109 8.924 8.924 8.709 0.215 17890 13341 1 17 . 1 1 110 110 THR N N 110 120.160 120.160 115.508 4.652 17890 13342 1 17 . 1 1 110 110 THR HA H 110 4.911 4.911 4.743 0.168 17890 13343 1 17 . 1 1 110 110 THR CA C 110 60.141 60.141 60.416 -0.275 17890 13344 1 17 . 1 1 110 110 THR CB C 110 72.785 72.785 70.797 1.988 17890 13345 1 17 . 1 1 110 110 THR H H 110 7.677 7.677 8.579 -0.902 17890 13346 1 17 . 1 1 111 111 SER HA H 111 4.204 4.204 4.290 -0.086 17890 13347 1 17 . 1 1 111 111 SER C C 111 174.755 174.755 175.027 -0.272 17890 13348 1 17 . 1 1 111 111 SER CA C 111 60.710 60.710 59.569 1.141 17890 13349 1 17 . 1 1 111 111 SER CB C 111 62.660 62.660 62.933 -0.273 17890 13350 1 17 . 1 1 112 112 GLY N N 112 107.313 107.313 107.114 0.199 17890 13351 1 17 . 1 1 112 112 GLY C C 112 173.023 173.023 173.107 -0.084 17890 13352 1 17 . 1 1 112 112 GLY CA C 112 44.150 44.150 44.759 -0.609 17890 13353 1 17 . 1 1 112 112 GLY H H 112 8.249 8.249 7.441 0.808 17890 13354 1 17 . 1 1 113 113 GLY N N 113 105.618 105.618 108.078 -2.460 17890 13355 1 17 . 1 1 113 113 GLY C C 113 175.844 175.844 171.895 3.949 17890 13356 1 17 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.854 -3.095 17890 13357 1 17 . 1 1 113 113 GLY H H 113 7.444 7.444 7.408 0.036 17890 13358 1 17 . 1 1 114 114 TYR N N 114 121.548 121.548 118.280 3.268 17890 13359 1 17 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.426 -0.574 17890 13360 1 17 . 1 1 114 114 TYR C C 114 175.605 175.605 174.067 1.538 17890 13361 1 17 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.847 4.416 17890 13362 1 17 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.546 -4.613 17890 13363 1 17 . 1 1 114 114 TYR H H 114 9.677 9.677 8.977 0.700 17890 13364 1 17 . 1 1 115 115 ASN N N 115 123.274 123.274 117.236 6.038 17890 13365 1 17 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.240 -0.142 17890 13366 1 17 . 1 1 115 115 ASN C C 115 174.355 174.355 173.395 0.960 17890 13367 1 17 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.206 -1.160 17890 13368 1 17 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.874 -2.525 17890 13369 1 17 . 1 1 115 115 ASN H H 115 9.350 9.350 9.056 0.294 17890 13370 1 17 . 1 1 116 116 ILE N N 116 130.611 130.611 123.005 7.606 17890 13371 1 17 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.698 -0.459 17890 13372 1 17 . 1 1 116 116 ILE C C 116 173.998 173.998 173.993 0.005 17890 13373 1 17 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.862 2.337 17890 13374 1 17 . 1 1 116 116 ILE CB C 116 37.100 37.100 38.693 -1.593 17890 13375 1 17 . 1 1 116 116 ILE H H 116 9.473 9.473 8.271 1.202 17890 13376 1 17 . 1 1 117 117 GLN N N 117 121.633 121.633 124.725 -3.092 17890 13377 1 17 . 1 1 117 117 GLN HA H 117 5.935 5.935 4.979 0.956 17890 13378 1 17 . 1 1 117 117 GLN C C 117 177.902 177.902 175.257 2.645 17890 13379 1 17 . 1 1 117 117 GLN CA C 117 53.320 53.320 54.070 -0.750 17890 13380 1 17 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.331 4.126 17890 13381 1 17 . 1 1 117 117 GLN H H 117 8.781 8.781 7.929 0.852 17890 13382 1 17 . 1 1 118 118 ASP N N 118 116.836 116.836 121.907 -5.071 17890 13383 1 17 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.936 0.847 17890 13384 1 17 . 1 1 118 118 ASP C C 118 178.084 178.084 177.004 1.080 17890 13385 1 17 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.841 -2.071 17890 13386 1 17 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.231 -0.863 17890 13387 1 17 . 1 1 118 118 ASP H H 118 9.330 9.330 9.210 0.120 17890 13388 1 17 . 1 1 119 119 GLY N N 119 111.037 111.037 105.834 5.203 17890 13389 1 17 . 1 1 119 119 GLY C C 119 174.196 174.196 175.728 -1.532 17890 13390 1 17 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.160 1.816 17890 13391 1 17 . 1 1 119 119 GLY H H 119 8.986 8.986 8.387 0.599 17890 13392 1 17 . 1 1 120 120 LYS N N 120 114.809 114.809 122.503 -7.694 17890 13393 1 17 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.354 -0.005 17890 13394 1 17 . 1 1 120 120 LYS C C 120 175.174 175.174 176.420 -1.246 17890 13395 1 17 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.381 0.552 17890 13396 1 17 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.345 0.131 17890 13397 1 17 . 1 1 120 120 LYS H H 120 7.045 7.045 7.973 -0.928 17890 13398 1 17 . 1 1 121 121 ARG N N 121 116.291 116.291 114.453 1.838 17890 13399 1 17 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.078 -0.492 17890 13400 1 17 . 1 1 121 121 ARG C C 121 175.097 175.097 176.933 -1.836 17890 13401 1 17 . 1 1 121 121 ARG CA C 121 58.069 58.069 56.759 1.310 17890 13402 1 17 . 1 1 121 121 ARG CB C 121 26.623 26.623 27.704 -1.081 17890 13403 1 17 . 1 1 121 121 ARG H H 121 7.683 7.683 8.537 -0.854 17890 13404 1 17 . 1 1 122 122 THR N N 122 113.730 113.730 109.585 4.145 17890 13405 1 17 . 1 1 122 122 THR HA H 122 4.540 4.540 4.189 0.351 17890 13406 1 17 . 1 1 122 122 THR C C 122 175.302 175.302 174.813 0.489 17890 13407 1 17 . 1 1 122 122 THR CA C 122 62.871 62.871 63.849 -0.979 17890 13408 1 17 . 1 1 122 122 THR CB C 122 71.552 71.552 69.576 1.976 17890 13409 1 17 . 1 1 122 122 THR H H 122 11.059 11.059 8.357 2.702 17890 13410 1 17 . 1 1 123 123 VAL N N 123 118.350 118.350 112.956 5.394 17890 13411 1 17 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.835 -0.025 17890 13412 1 17 . 1 1 123 123 VAL C C 123 174.730 174.730 173.541 1.189 17890 13413 1 17 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.745 0.566 17890 13414 1 17 . 1 1 123 123 VAL CB C 123 37.082 37.082 35.054 2.028 17890 13415 1 17 . 1 1 123 123 VAL H H 123 8.181 8.181 7.303 0.878 17890 13416 1 17 . 1 1 124 124 SER N N 124 113.053 113.053 114.050 -0.997 17890 13417 1 17 . 1 1 124 124 SER HA H 124 5.820 5.820 5.162 0.658 17890 13418 1 17 . 1 1 124 124 SER C C 124 175.521 175.521 173.509 2.012 17890 13419 1 17 . 1 1 124 124 SER CA C 124 58.087 58.087 56.414 1.673 17890 13420 1 17 . 1 1 124 124 SER CB C 124 67.405 67.405 65.662 1.743 17890 13421 1 17 . 1 1 124 124 SER H H 124 9.138 9.138 8.645 0.493 17890 13422 1 17 . 1 1 125 125 TRP N N 125 124.900 124.900 123.638 1.262 17890 13423 1 17 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.042 0.568 17890 13424 1 17 . 1 1 125 125 TRP C C 125 178.114 178.114 177.361 0.753 17890 13425 1 17 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.136 -0.662 17890 13426 1 17 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.965 1.058 17890 13427 1 17 . 1 1 125 125 TRP H H 125 8.843 8.843 8.342 0.501 17890 13428 1 17 . 1 1 126 126 SER N N 126 119.243 119.243 114.548 4.695 17890 13429 1 17 . 1 1 126 126 SER HA H 126 5.443 5.443 5.316 0.127 17890 13430 1 17 . 1 1 126 126 SER C C 126 171.668 171.668 172.832 -1.164 17890 13431 1 17 . 1 1 126 126 SER CA C 126 58.696 58.696 56.946 1.750 17890 13432 1 17 . 1 1 126 126 SER CB C 126 66.176 66.176 66.481 -0.305 17890 13433 1 17 . 1 1 126 126 SER H H 126 9.835 9.835 9.283 0.552 17890 13434 1 17 . 1 1 127 127 LEU N N 127 113.708 113.708 118.609 -4.901 17890 13435 1 17 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.722 0.433 17890 13436 1 17 . 1 1 127 127 LEU C C 127 176.563 176.563 177.093 -0.530 17890 13437 1 17 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.282 -0.637 17890 13438 1 17 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.354 -1.658 17890 13439 1 17 . 1 1 127 127 LEU H H 127 6.559 6.559 7.989 -1.430 17890 13440 1 17 . 1 1 128 128 ASN N N 128 121.739 121.739 121.137 0.602 17890 13441 1 17 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.755 -0.066 17890 13442 1 17 . 1 1 128 128 ASN C C 128 175.452 175.452 175.567 -0.115 17890 13443 1 17 . 1 1 128 128 ASN CA C 128 56.007 56.007 55.650 0.357 17890 13444 1 17 . 1 1 128 128 ASN CB C 128 39.291 39.291 39.428 -0.137 17890 13445 1 17 . 1 1 128 128 ASN H H 128 8.662 8.662 9.026 -0.364 17890 13446 1 17 . 1 1 129 129 ASN N N 129 119.586 119.586 115.337 4.249 17890 13447 1 17 . 1 1 129 129 ASN HA H 129 4.997 4.997 5.016 -0.019 17890 13448 1 17 . 1 1 129 129 ASN C C 129 175.900 175.900 174.761 1.139 17890 13449 1 17 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.143 1.090 17890 13450 1 17 . 1 1 129 129 ASN CB C 129 41.256 41.256 40.906 0.350 17890 13451 1 17 . 1 1 129 129 ASN H H 129 10.962 10.962 8.710 2.252 17890 13452 1 17 . 1 1 130 130 ALA N N 130 128.292 128.292 122.177 6.115 17890 13453 1 17 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.044 -0.474 17890 13454 1 17 . 1 1 130 130 ALA C C 130 172.620 172.620 175.882 -3.262 17890 13455 1 17 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.274 -0.635 17890 13456 1 17 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.280 -1.180 17890 13457 1 17 . 1 1 130 130 ALA H H 130 10.629 10.629 8.454 2.175 17890 13458 1 17 . 1 1 131 131 THR N N 131 105.584 105.584 109.612 -4.028 17890 13459 1 17 . 1 1 131 131 THR HA H 131 4.462 4.462 4.410 0.052 17890 13460 1 17 . 1 1 131 131 THR C C 131 173.552 173.552 174.158 -0.606 17890 13461 1 17 . 1 1 131 131 THR CA C 131 58.338 58.338 59.992 -1.654 17890 13462 1 17 . 1 1 131 131 THR CB C 131 71.569 71.569 70.082 1.487 17890 13463 1 17 . 1 1 131 131 THR H H 131 7.092 7.092 7.773 -0.681 17890 13464 1 17 . 1 1 132 132 ALA N N 132 121.773 121.773 123.662 -1.889 17890 13465 1 17 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.107 -0.358 17890 13466 1 17 . 1 1 132 132 ALA C C 132 178.819 178.819 178.387 0.432 17890 13467 1 17 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.934 1.350 17890 13468 1 17 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.453 -0.226 17890 13469 1 17 . 1 1 132 132 ALA H H 132 8.952 8.952 8.411 0.541 17890 13470 1 17 . 1 1 133 133 GLY N N 133 113.965 113.965 110.495 3.470 17890 13471 1 17 . 1 1 133 133 GLY C C 133 173.453 173.453 174.590 -1.137 17890 13472 1 17 . 1 1 133 133 GLY CA C 133 45.166 45.166 45.062 0.103 17890 13473 1 17 . 1 1 133 133 GLY H H 133 9.016 9.016 8.374 0.642 17890 13474 1 17 . 1 1 134 134 GLU N N 134 123.460 123.460 120.701 2.759 17890 13475 1 17 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.258 -0.300 17890 13476 1 17 . 1 1 134 134 GLU C C 134 176.120 176.120 175.411 0.709 17890 13477 1 17 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.039 1.360 17890 13478 1 17 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.797 0.589 17890 13479 1 17 . 1 1 134 134 GLU H H 134 7.598 7.598 7.455 0.143 17890 13480 1 17 . 1 1 135 135 GLU N N 135 122.633 122.633 124.408 -1.775 17890 13481 1 17 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.261 0.050 17890 13482 1 17 . 1 1 135 135 GLU C C 135 176.014 176.014 176.221 -0.207 17890 13483 1 17 . 1 1 135 135 GLU CA C 135 56.182 56.182 55.943 0.239 17890 13484 1 17 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.206 -0.753 17890 13485 1 17 . 1 1 135 135 GLU H H 135 8.258 8.258 8.672 -0.414 17890 13486 1 17 . 1 1 136 136 VAL N N 136 123.635 123.635 126.060 -2.425 17890 13487 1 17 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.792 -0.100 17890 13488 1 17 . 1 1 136 136 VAL C C 136 173.932 173.932 174.590 -0.658 17890 13489 1 17 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.189 0.643 17890 13490 1 17 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.651 -0.787 17890 13491 1 17 . 1 1 136 136 VAL H H 136 7.267 7.267 8.420 -1.153 17890 13492 1 17 . 1 1 137 137 SER N N 137 118.950 118.950 120.852 -1.902 17890 13493 1 17 . 1 1 137 137 SER HA H 137 4.887 4.887 5.216 -0.329 17890 13494 1 17 . 1 1 137 137 SER C C 137 173.780 173.780 173.178 0.602 17890 13495 1 17 . 1 1 137 137 SER CA C 137 57.895 57.895 55.852 2.043 17890 13496 1 17 . 1 1 137 137 SER CB C 137 65.027 65.027 65.668 -0.641 17890 13497 1 17 . 1 1 137 137 SER H H 137 8.454 8.454 8.628 -0.174 17890 13498 1 17 . 1 1 138 138 ILE N N 138 123.511 123.511 120.400 3.111 17890 13499 1 17 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.040 -0.792 17890 13500 1 17 . 1 1 138 138 ILE C C 138 176.142 176.142 175.412 0.730 17890 13501 1 17 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.517 1.333 17890 13502 1 17 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.716 -3.121 17890 13503 1 17 . 1 1 138 138 ILE H H 138 7.915 7.915 8.000 -0.085 17890 13504 1 17 . 1 1 139 139 GLY N N 139 115.638 115.638 111.207 4.431 17890 13505 1 17 . 1 1 139 139 GLY C C 139 171.947 171.947 172.236 -0.289 17890 13506 1 17 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.189 1.897 17890 13507 1 17 . 1 1 139 139 GLY H H 139 8.490 8.490 8.164 0.326 17890 13508 1 17 . 1 1 140 140 ALA N N 140 128.563 128.563 121.713 6.850 17890 13509 1 17 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.306 0.090 17890 13510 1 17 . 1 1 140 140 ALA C C 140 177.956 177.956 177.181 0.775 17890 13511 1 17 . 1 1 140 140 ALA CA C 140 52.646 52.646 52.301 0.345 17890 13512 1 17 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.463 -0.259 17890 13513 1 17 . 1 1 140 140 ALA H H 140 8.531 8.531 8.115 0.416 17890 13514 1 17 . 1 1 141 141 ASP N N 141 120.886 120.886 119.858 1.028 17890 13515 1 17 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.430 0.168 17890 13516 1 17 . 1 1 141 141 ASP C C 141 175.411 175.411 175.490 -0.079 17890 13517 1 17 . 1 1 141 141 ASP CA C 141 53.916 53.916 55.102 -1.185 17890 13518 1 17 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.289 -0.598 17890 13519 1 17 . 1 1 141 141 ASP H H 141 8.507 8.507 8.368 0.139 17890 13520 1 17 . 1 1 142 142 ALA N N 142 125.604 125.604 125.825 -0.221 17890 13521 1 17 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.601 -0.084 17890 13522 1 17 . 1 1 142 142 ALA C C 142 177.671 177.671 177.323 0.348 17890 13523 1 17 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.435 0.558 17890 13524 1 17 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.080 0.455 17890 13525 1 17 . 1 1 142 142 ALA H H 142 7.894 7.894 8.291 -0.397 17890 13526 1 17 . 1 1 143 143 THR N N 143 118.085 118.085 114.101 3.984 17890 13527 1 17 . 1 1 143 143 THR HA H 143 3.744 3.744 4.377 -0.633 17890 13528 1 17 . 1 1 143 143 THR C C 143 175.464 175.464 174.974 0.490 17890 13529 1 17 . 1 1 143 143 THR CA C 143 64.548 64.548 63.900 0.648 17890 13530 1 17 . 1 1 143 143 THR CB C 143 69.305 69.305 68.728 0.577 17890 13531 1 17 . 1 1 143 143 THR H H 143 8.268 8.268 8.773 -0.505 17890 13532 1 17 . 1 1 144 144 PHE N N 144 118.635 118.635 118.435 0.200 17890 13533 1 17 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.801 -0.455 17890 13534 1 17 . 1 1 144 144 PHE C C 144 176.209 176.209 175.421 0.788 17890 13535 1 17 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.296 4.166 17890 13536 1 17 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.190 0.414 17890 13537 1 17 . 1 1 144 144 PHE H H 144 8.719 8.719 7.725 0.994 17890 13538 1 17 . 1 1 145 145 SER N N 145 113.446 113.446 116.402 -2.956 17890 13539 1 17 . 1 1 145 145 SER HA H 145 4.866 4.866 4.221 0.645 17890 13540 1 17 . 1 1 145 145 SER C C 145 176.605 176.605 175.941 0.664 17890 13541 1 17 . 1 1 145 145 SER CA C 145 59.432 59.432 57.331 2.101 17890 13542 1 17 . 1 1 145 145 SER CB C 145 62.167 62.167 63.018 -0.851 17890 13543 1 17 . 1 1 145 145 SER H H 145 8.657 8.657 7.183 1.474 17890 13544 1 17 . 1 1 146 146 GLY N N 146 109.277 109.277 110.126 -0.849 17890 13545 1 17 . 1 1 146 146 GLY C C 146 174.293 174.293 173.790 0.503 17890 13546 1 17 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.277 -0.337 17890 13547 1 17 . 1 1 146 146 GLY H H 146 7.467 7.467 8.187 -0.720 17890 13548 1 17 . 1 1 147 147 ARG N N 147 122.863 122.863 117.571 5.292 17890 13549 1 17 . 1 1 147 147 ARG HA H 147 5.441 5.441 5.074 0.367 17890 13550 1 17 . 1 1 147 147 ARG C C 147 173.849 173.849 174.806 -0.957 17890 13551 1 17 . 1 1 147 147 ARG CA C 147 52.227 52.227 53.968 -1.741 17890 13552 1 17 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.315 -0.718 17890 13553 1 17 . 1 1 147 147 ARG H H 147 7.556 7.556 7.217 0.339 17890 13554 1 17 . 1 1 148 148 TRP N N 148 118.465 118.465 119.957 -1.492 17890 13555 1 17 . 1 1 148 148 TRP HA H 148 4.846 4.846 4.958 -0.112 17890 13556 1 17 . 1 1 148 148 TRP C C 148 174.353 174.353 174.450 -0.097 17890 13557 1 17 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.734 -1.073 17890 13558 1 17 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.047 -1.048 17890 13559 1 17 . 1 1 148 148 TRP H H 148 8.709 8.709 9.124 -0.415 17890 13560 1 17 . 1 1 149 149 VAL N N 149 125.852 125.852 118.316 7.536 17890 13561 1 17 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.599 -0.456 17890 13562 1 17 . 1 1 149 149 VAL C C 149 173.613 173.613 173.401 0.212 17890 13563 1 17 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.880 1.860 17890 13564 1 17 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.191 -2.808 17890 13565 1 17 . 1 1 149 149 VAL H H 149 9.700 9.700 8.922 0.778 17890 13566 1 17 . 1 1 150 150 ILE N N 150 125.140 125.140 127.578 -2.438 17890 13567 1 17 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.124 -0.262 17890 13568 1 17 . 1 1 150 150 ILE C C 150 175.661 175.661 174.112 1.549 17890 13569 1 17 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.519 1.302 17890 13570 1 17 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.741 -0.921 17890 13571 1 17 . 1 1 150 150 ILE H H 150 7.747 7.747 7.954 -0.207 17890 13572 1 17 . 1 1 151 151 GLU N N 151 126.762 126.762 126.855 -0.093 17890 13573 1 17 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.871 0.009 17890 13574 1 17 . 1 1 151 151 GLU C C 151 174.424 174.424 174.802 -0.378 17890 13575 1 17 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.049 0.747 17890 13576 1 17 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.819 0.432 17890 13577 1 17 . 1 1 151 151 GLU H H 151 8.892 8.892 8.743 0.149 17890 13578 1 17 . 1 1 152 152 LYS N N 152 126.299 126.299 122.556 3.743 17890 13579 1 17 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.828 0.033 17890 13580 1 17 . 1 1 152 152 LYS C C 152 176.282 176.282 176.836 -0.554 17890 13581 1 17 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.833 0.672 17890 13582 1 17 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.569 0.767 17890 13583 1 17 . 1 1 152 152 LYS H H 152 8.640 8.640 8.308 0.332 17890 13584 1 18 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.441 -2.147 17890 13585 1 18 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.608 0.014 17890 13586 1 18 . 1 1 8 8 HIS CA C 8 55.661 55.661 55.604 0.057 17890 13587 1 18 . 1 1 8 8 HIS CB C 8 29.880 29.880 30.233 -0.353 17890 13588 1 18 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.180 0.466 17890 13589 1 18 . 1 1 9 9 HIS CA C 9 55.684 55.684 56.209 -0.525 17890 13590 1 18 . 1 1 9 9 HIS CB C 9 29.831 29.831 30.393 -0.562 17890 13591 1 18 . 1 1 10 10 HIS N N 10 120.811 120.811 119.553 1.258 17890 13592 1 18 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.317 0.363 17890 13593 1 18 . 1 1 10 10 HIS C C 10 174.875 174.875 175.418 -0.543 17890 13594 1 18 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.721 -0.975 17890 13595 1 18 . 1 1 10 10 HIS CB C 10 29.889 29.889 29.621 0.268 17890 13596 1 18 . 1 1 10 10 HIS H H 10 8.583 8.583 7.329 1.254 17890 13597 1 18 . 1 1 11 11 SER N N 11 118.009 118.009 115.229 2.780 17890 13598 1 18 . 1 1 11 11 SER HA H 11 4.424 4.424 4.374 0.050 17890 13599 1 18 . 1 1 11 11 SER C C 11 174.962 174.962 175.071 -0.109 17890 13600 1 18 . 1 1 11 11 SER CA C 11 58.660 58.660 58.961 -0.301 17890 13601 1 18 . 1 1 11 11 SER CB C 11 63.822 63.822 63.990 -0.168 17890 13602 1 18 . 1 1 11 11 SER H H 11 8.438 8.438 7.740 0.698 17890 13603 1 18 . 1 1 12 12 GLY N N 12 111.011 111.011 111.065 -0.054 17890 13604 1 18 . 1 1 12 12 GLY C C 12 173.907 173.907 172.341 1.566 17890 13605 1 18 . 1 1 12 12 GLY CA C 12 45.421 45.421 44.543 0.878 17890 13606 1 18 . 1 1 12 12 GLY H H 12 8.433 8.433 8.828 -0.395 17890 13607 1 18 . 1 1 13 13 ASP N N 13 120.291 120.291 118.375 1.916 17890 13608 1 18 . 1 1 13 13 ASP HA H 13 4.662 4.662 5.411 -0.749 17890 13609 1 18 . 1 1 13 13 ASP C C 13 176.115 176.115 174.968 1.147 17890 13610 1 18 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.301 1.002 17890 13611 1 18 . 1 1 13 13 ASP CB C 13 41.465 41.465 43.185 -1.720 17890 13612 1 18 . 1 1 13 13 ASP H H 13 8.153 8.153 8.688 -0.535 17890 13613 1 18 . 1 1 14 14 SER N N 14 116.987 116.987 115.050 1.937 17890 13614 1 18 . 1 1 14 14 SER HA H 14 4.754 4.754 5.055 -0.301 17890 13615 1 18 . 1 1 14 14 SER CA C 14 56.469 56.469 57.123 -0.654 17890 13616 1 18 . 1 1 14 14 SER CB C 14 63.553 63.553 64.422 -0.869 17890 13617 1 18 . 1 1 14 14 SER H H 14 8.210 8.210 8.678 -0.468 17890 13618 1 18 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.587 -0.145 17890 13619 1 18 . 1 1 15 15 PRO C C 15 176.424 176.424 175.994 0.430 17890 13620 1 18 . 1 1 15 15 PRO CA C 15 63.233 63.233 62.898 0.336 17890 13621 1 18 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.481 -0.333 17890 13622 1 18 . 1 1 16 16 ALA N N 16 124.219 124.219 121.259 2.960 17890 13623 1 18 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.502 -0.152 17890 13624 1 18 . 1 1 16 16 ALA C C 16 177.552 177.552 175.681 1.871 17890 13625 1 18 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.039 0.394 17890 13626 1 18 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.294 0.025 17890 13627 1 18 . 1 1 16 16 ALA H H 16 8.284 8.284 8.641 -0.357 17890 13628 1 18 . 1 1 17 17 VAL N N 17 119.504 119.504 117.322 2.182 17890 13629 1 18 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.301 -0.052 17890 13630 1 18 . 1 1 17 17 VAL C C 17 176.322 176.322 174.205 2.117 17890 13631 1 18 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.459 -0.181 17890 13632 1 18 . 1 1 17 17 VAL CB C 17 32.957 32.957 35.676 -2.719 17890 13633 1 18 . 1 1 17 17 VAL H H 17 8.046 8.046 7.523 0.523 17890 13634 1 18 . 1 1 18 18 THR N N 18 118.186 118.186 120.365 -2.179 17890 13635 1 18 . 1 1 18 18 THR HA H 18 4.473 4.473 4.527 -0.054 17890 13636 1 18 . 1 1 18 18 THR C C 18 174.248 174.248 174.060 0.188 17890 13637 1 18 . 1 1 18 18 THR CA C 18 61.565 61.565 62.127 -0.562 17890 13638 1 18 . 1 1 18 18 THR CB C 18 70.165 70.165 68.856 1.309 17890 13639 1 18 . 1 1 18 18 THR H H 18 8.276 8.276 8.671 -0.395 17890 13640 1 18 . 1 1 19 19 LEU N N 19 125.265 125.265 122.240 3.025 17890 13641 1 18 . 1 1 19 19 LEU HA H 19 4.293 4.293 4.272 0.021 17890 13642 1 18 . 1 1 19 19 LEU C C 19 175.689 175.689 176.545 -0.856 17890 13643 1 18 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.372 0.055 17890 13644 1 18 . 1 1 19 19 LEU CB C 19 43.279 43.279 42.040 1.239 17890 13645 1 18 . 1 1 19 19 LEU H H 19 8.091 8.091 7.947 0.144 17890 13646 1 18 . 1 1 20 20 SER N N 20 114.622 114.622 114.819 -0.197 17890 13647 1 18 . 1 1 20 20 SER HA H 20 4.947 4.947 4.823 0.124 17890 13648 1 18 . 1 1 20 20 SER C C 20 174.220 174.220 173.458 0.762 17890 13649 1 18 . 1 1 20 20 SER CA C 20 56.583 56.583 57.002 -0.419 17890 13650 1 18 . 1 1 20 20 SER CB C 20 65.653 65.653 64.891 0.761 17890 13651 1 18 . 1 1 20 20 SER H H 20 7.316 7.316 7.760 -0.444 17890 13652 1 18 . 1 1 21 21 ALA N N 21 125.517 125.517 123.283 2.234 17890 13653 1 18 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.940 -0.272 17890 13654 1 18 . 1 1 21 21 ALA C C 21 177.960 177.960 177.725 0.235 17890 13655 1 18 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.437 1.573 17890 13656 1 18 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.587 -0.362 17890 13657 1 18 . 1 1 21 21 ALA H H 21 8.993 8.993 8.513 0.480 17890 13658 1 18 . 1 1 22 22 GLY N N 22 109.543 109.543 111.090 -1.547 17890 13659 1 18 . 1 1 22 22 GLY C C 22 170.422 170.422 171.906 -1.484 17890 13660 1 18 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.261 0.120 17890 13661 1 18 . 1 1 22 22 GLY H H 22 8.411 8.411 9.033 -0.622 17890 13662 1 18 . 1 1 23 23 ASN N N 23 119.649 119.649 119.114 0.535 17890 13663 1 18 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.687 0.200 17890 13664 1 18 . 1 1 23 23 ASN C C 23 175.207 175.207 174.555 0.652 17890 13665 1 18 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.622 -0.801 17890 13666 1 18 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.482 -0.727 17890 13667 1 18 . 1 1 23 23 ASN H H 23 8.092 8.092 8.419 -0.327 17890 13668 1 18 . 1 1 24 24 TYR N N 24 120.889 120.889 121.643 -0.754 17890 13669 1 18 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.156 0.099 17890 13670 1 18 . 1 1 24 24 TYR C C 24 175.667 175.667 174.436 1.231 17890 13671 1 18 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.265 0.848 17890 13672 1 18 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.680 0.146 17890 13673 1 18 . 1 1 24 24 TYR H H 24 9.914 9.914 9.020 0.894 17890 13674 1 18 . 1 1 25 25 ILE N N 25 115.978 115.978 113.367 2.611 17890 13675 1 18 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.063 0.023 17890 13676 1 18 . 1 1 25 25 ILE C C 25 175.200 175.200 174.189 1.011 17890 13677 1 18 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.569 0.976 17890 13678 1 18 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.954 -0.832 17890 13679 1 18 . 1 1 25 25 ILE H H 25 9.216 9.216 9.312 -0.096 17890 13680 1 18 . 1 1 26 26 ILE N N 26 123.957 123.957 122.401 1.556 17890 13681 1 18 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.263 -0.287 17890 13682 1 18 . 1 1 26 26 ILE C C 26 174.810 174.810 174.936 -0.126 17890 13683 1 18 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.182 0.427 17890 13684 1 18 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.320 0.802 17890 13685 1 18 . 1 1 26 26 ILE H H 26 9.559 9.559 8.967 0.592 17890 13686 1 18 . 1 1 27 27 TYR N N 27 121.371 121.371 123.916 -2.545 17890 13687 1 18 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.559 0.631 17890 13688 1 18 . 1 1 27 27 TYR C C 27 173.963 173.963 173.330 0.633 17890 13689 1 18 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.946 -0.277 17890 13690 1 18 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.010 0.688 17890 13691 1 18 . 1 1 27 27 TYR H H 27 9.378 9.378 9.070 0.308 17890 13692 1 18 . 1 1 28 28 ASN N N 28 121.991 121.991 119.582 2.409 17890 13693 1 18 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.135 -0.367 17890 13694 1 18 . 1 1 28 28 ASN C C 28 174.352 174.352 176.349 -1.997 17890 13695 1 18 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.425 2.695 17890 13696 1 18 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.749 1.697 17890 13697 1 18 . 1 1 28 28 ASN H H 28 8.466 8.466 8.482 -0.016 17890 13698 1 18 . 1 1 29 29 ARG N N 29 121.103 121.103 126.222 -5.119 17890 13699 1 18 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.088 -0.227 17890 13700 1 18 . 1 1 29 29 ARG C C 29 173.635 173.635 177.419 -3.784 17890 13701 1 18 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.710 1.583 17890 13702 1 18 . 1 1 29 29 ARG CB C 29 30.399 30.399 29.615 0.784 17890 13703 1 18 . 1 1 29 29 ARG H H 29 7.756 7.756 8.282 -0.526 17890 13704 1 18 . 1 1 30 30 VAL N N 30 118.412 118.412 118.061 0.351 17890 13705 1 18 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.848 0.096 17890 13706 1 18 . 1 1 30 30 VAL C C 30 176.199 176.199 175.928 0.271 17890 13707 1 18 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.779 -1.202 17890 13708 1 18 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.193 -1.971 17890 13709 1 18 . 1 1 30 30 VAL H H 30 8.976 8.976 7.765 1.211 17890 13710 1 18 . 1 1 31 31 LEU N N 31 125.418 125.418 115.335 10.083 17890 13711 1 18 . 1 1 31 31 LEU HA H 31 4.485 4.485 3.999 0.486 17890 13712 1 18 . 1 1 31 31 LEU C C 31 179.123 179.123 176.305 2.818 17890 13713 1 18 . 1 1 31 31 LEU CA C 31 54.025 54.025 56.005 -1.980 17890 13714 1 18 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.843 3.737 17890 13715 1 18 . 1 1 31 31 LEU H H 31 8.856 8.856 7.652 1.204 17890 13716 1 18 . 1 1 32 32 SER N N 32 116.890 116.890 115.729 1.161 17890 13717 1 18 . 1 1 32 32 SER HA H 32 5.365 5.365 4.784 0.581 17890 13718 1 18 . 1 1 32 32 SER CA C 32 57.269 57.269 56.972 0.297 17890 13719 1 18 . 1 1 32 32 SER CB C 32 62.213 62.213 64.187 -1.974 17890 13720 1 18 . 1 1 32 32 SER H H 32 9.307 9.307 8.556 0.751 17890 13721 1 18 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.435 -0.555 17890 13722 1 18 . 1 1 33 33 PRO C C 33 175.137 175.137 177.668 -2.531 17890 13723 1 18 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.974 0.311 17890 13724 1 18 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.526 0.505 17890 13725 1 18 . 1 1 34 34 ARG N N 34 110.279 110.279 118.970 -8.691 17890 13726 1 18 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.240 0.252 17890 13727 1 18 . 1 1 34 34 ARG C C 34 176.844 176.844 176.797 0.047 17890 13728 1 18 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.824 -1.388 17890 13729 1 18 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.173 0.411 17890 13730 1 18 . 1 1 34 34 ARG H H 34 7.257 7.257 7.941 -0.684 17890 13731 1 18 . 1 1 35 35 GLY N N 35 110.288 110.288 106.345 3.943 17890 13732 1 18 . 1 1 35 35 GLY C C 35 173.336 173.336 174.084 -0.748 17890 13733 1 18 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.743 2.287 17890 13734 1 18 . 1 1 35 35 GLY H H 35 8.589 8.589 7.640 0.949 17890 13735 1 18 . 1 1 36 36 GLU N N 36 116.838 116.838 119.022 -2.184 17890 13736 1 18 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.651 -0.303 17890 13737 1 18 . 1 1 36 36 GLU C C 36 176.915 176.915 175.664 1.251 17890 13738 1 18 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.841 1.066 17890 13739 1 18 . 1 1 36 36 GLU CB C 36 30.415 30.415 33.476 -3.061 17890 13740 1 18 . 1 1 36 36 GLU H H 36 7.769 7.769 8.228 -0.459 17890 13741 1 18 . 1 1 37 37 LYS N N 37 123.775 123.775 120.611 3.164 17890 13742 1 18 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.116 0.307 17890 13743 1 18 . 1 1 37 37 LYS C C 37 176.067 176.067 175.532 0.535 17890 13744 1 18 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.704 -0.803 17890 13745 1 18 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.648 1.026 17890 13746 1 18 . 1 1 37 37 LYS H H 37 8.667 8.667 8.619 0.048 17890 13747 1 18 . 1 1 38 38 LEU N N 38 126.658 126.658 126.449 0.209 17890 13748 1 18 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.897 -0.670 17890 13749 1 18 . 1 1 38 38 LEU C C 38 174.332 174.332 174.962 -0.630 17890 13750 1 18 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.552 -0.209 17890 13751 1 18 . 1 1 38 38 LEU CB C 38 41.651 41.651 43.124 -1.473 17890 13752 1 18 . 1 1 38 38 LEU H H 38 10.455 10.455 8.944 1.511 17890 13753 1 18 . 1 1 39 39 ALA N N 39 127.018 127.018 127.382 -0.364 17890 13754 1 18 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.251 -0.022 17890 13755 1 18 . 1 1 39 39 ALA C C 39 178.694 178.694 176.186 2.508 17890 13756 1 18 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.247 -0.022 17890 13757 1 18 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.618 0.731 17890 13758 1 18 . 1 1 39 39 ALA H H 39 8.773 8.773 8.573 0.200 17890 13759 1 18 . 1 1 40 40 LEU N N 40 126.771 126.771 124.302 2.469 17890 13760 1 18 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.512 -0.158 17890 13761 1 18 . 1 1 40 40 LEU C C 40 178.309 178.309 176.448 1.861 17890 13762 1 18 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.027 0.818 17890 13763 1 18 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.848 0.475 17890 13764 1 18 . 1 1 40 40 LEU H H 40 9.665 9.665 8.776 0.889 17890 13765 1 18 . 1 1 41 41 THR N N 41 126.578 126.578 125.393 1.185 17890 13766 1 18 . 1 1 41 41 THR HA H 41 4.916 4.916 5.177 -0.261 17890 13767 1 18 . 1 1 41 41 THR C C 41 172.547 172.547 173.394 -0.847 17890 13768 1 18 . 1 1 41 41 THR CA C 41 63.253 63.253 61.409 1.844 17890 13769 1 18 . 1 1 41 41 THR CB C 41 71.832 71.832 70.308 1.524 17890 13770 1 18 . 1 1 41 41 THR H H 41 9.802 9.802 9.097 0.705 17890 13771 1 18 . 1 1 42 42 TYR N N 42 130.506 130.506 129.869 0.637 17890 13772 1 18 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.663 0.439 17890 13773 1 18 . 1 1 42 42 TYR CA C 42 53.986 53.986 58.201 -4.215 17890 13774 1 18 . 1 1 42 42 TYR CB C 42 39.155 39.155 38.736 0.419 17890 13775 1 18 . 1 1 42 42 TYR H H 42 9.428 9.428 9.062 0.366 17890 13776 1 18 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.428 0.062 17890 13777 1 18 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.054 0.519 17890 13778 1 18 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.723 -0.079 17890 13779 1 18 . 1 1 44 44 GLY N N 44 113.736 113.736 106.761 6.975 17890 13780 1 18 . 1 1 44 44 GLY C C 44 171.790 171.790 173.497 -1.707 17890 13781 1 18 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.886 0.830 17890 13782 1 18 . 1 1 44 44 GLY H H 44 8.337 8.337 7.263 1.074 17890 13783 1 18 . 1 1 45 45 ARG N N 45 113.899 113.899 116.821 -2.922 17890 13784 1 18 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.535 0.041 17890 13785 1 18 . 1 1 45 45 ARG C C 45 175.151 175.151 173.805 1.346 17890 13786 1 18 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.518 -0.353 17890 13787 1 18 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.959 1.260 17890 13788 1 18 . 1 1 45 45 ARG H H 45 6.463 6.463 7.347 -0.884 17890 13789 1 18 . 1 1 46 46 GLN N N 46 119.000 119.000 118.680 0.320 17890 13790 1 18 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.475 -0.026 17890 13791 1 18 . 1 1 46 46 GLN C C 46 177.282 177.282 176.690 0.592 17890 13792 1 18 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.278 1.335 17890 13793 1 18 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.470 1.026 17890 13794 1 18 . 1 1 46 46 GLN H H 46 8.683 8.683 8.480 0.203 17890 13795 1 18 . 1 1 47 47 ARG N N 47 113.526 113.526 116.550 -3.024 17890 13796 1 18 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.053 -0.523 17890 13797 1 18 . 1 1 47 47 ARG C C 47 174.130 174.130 175.239 -1.109 17890 13798 1 18 . 1 1 47 47 ARG CA C 47 58.816 58.816 56.968 1.847 17890 13799 1 18 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.041 2.029 17890 13800 1 18 . 1 1 47 47 ARG H H 47 9.677 9.677 8.915 0.762 17890 13801 1 18 . 1 1 48 48 THR N N 48 114.672 114.672 115.269 -0.597 17890 13802 1 18 . 1 1 48 48 THR HA H 48 4.938 4.938 4.743 0.195 17890 13803 1 18 . 1 1 48 48 THR CA C 48 59.987 59.987 59.744 0.243 17890 13804 1 18 . 1 1 48 48 THR CB C 48 71.947 71.947 70.822 1.125 17890 13805 1 18 . 1 1 48 48 THR H H 48 8.104 8.104 7.600 0.504 17890 13806 1 18 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.555 -0.187 17890 13807 1 18 . 1 1 49 49 PRO C C 49 175.651 175.651 176.323 -0.672 17890 13808 1 18 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.290 0.891 17890 13809 1 18 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.203 0.494 17890 13810 1 18 . 1 1 50 50 VAL N N 50 122.562 122.562 122.084 0.478 17890 13811 1 18 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.237 -0.290 17890 13812 1 18 . 1 1 50 50 VAL C C 50 174.493 174.493 175.751 -1.258 17890 13813 1 18 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.367 2.445 17890 13814 1 18 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.215 -2.047 17890 13815 1 18 . 1 1 50 50 VAL H H 50 8.123 8.123 8.622 -0.499 17890 13816 1 18 . 1 1 51 51 THR N N 51 113.549 113.549 120.007 -6.458 17890 13817 1 18 . 1 1 51 51 THR HA H 51 5.372 5.372 4.884 0.488 17890 13818 1 18 . 1 1 51 51 THR C C 51 174.841 174.841 172.723 2.118 17890 13819 1 18 . 1 1 51 51 THR CA C 51 59.196 59.196 60.903 -1.707 17890 13820 1 18 . 1 1 51 51 THR CB C 51 72.703 72.703 71.634 1.069 17890 13821 1 18 . 1 1 51 51 THR H H 51 7.057 7.057 8.286 -1.229 17890 13822 1 18 . 1 1 52 52 VAL N N 52 107.374 107.374 120.699 -13.325 17890 13823 1 18 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.065 0.449 17890 13824 1 18 . 1 1 52 52 VAL C C 52 175.697 175.697 174.011 1.686 17890 13825 1 18 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.912 -1.440 17890 13826 1 18 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.108 -0.334 17890 13827 1 18 . 1 1 52 52 VAL H H 52 8.062 8.062 8.584 -0.522 17890 13828 1 18 . 1 1 53 53 SER N N 53 114.662 114.662 121.859 -7.197 17890 13829 1 18 . 1 1 53 53 SER HA H 53 4.690 4.690 5.037 -0.347 17890 13830 1 18 . 1 1 53 53 SER CA C 53 56.828 56.828 55.792 1.036 17890 13831 1 18 . 1 1 53 53 SER CB C 53 64.789 64.789 65.879 -1.090 17890 13832 1 18 . 1 1 53 53 SER H H 53 8.681 8.681 8.947 -0.266 17890 13833 1 18 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.654 0.122 17890 13834 1 18 . 1 1 54 54 PRO C C 54 177.724 177.724 176.393 1.331 17890 13835 1 18 . 1 1 54 54 PRO CA C 54 63.425 63.425 62.912 0.513 17890 13836 1 18 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.166 -0.069 17890 13837 1 18 . 1 1 55 55 LEU N N 55 128.655 128.655 124.585 4.070 17890 13838 1 18 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.225 0.302 17890 13839 1 18 . 1 1 55 55 LEU C C 55 178.696 178.696 176.433 2.263 17890 13840 1 18 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.184 0.062 17890 13841 1 18 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.304 1.302 17890 13842 1 18 . 1 1 55 55 LEU H H 55 8.675 8.675 8.416 0.259 17890 13843 1 18 . 1 1 56 56 ASP N N 56 126.651 126.651 125.714 0.937 17890 13844 1 18 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.781 -0.072 17890 13845 1 18 . 1 1 56 56 ASP C C 56 177.729 177.729 176.864 0.865 17890 13846 1 18 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.077 -0.454 17890 13847 1 18 . 1 1 56 56 ASP CB C 56 41.632 41.632 44.080 -2.448 17890 13848 1 18 . 1 1 56 56 ASP H H 56 9.683 9.683 9.412 0.271 17890 13849 1 18 . 1 1 57 57 GLY N N 57 109.299 109.299 108.672 0.627 17890 13850 1 18 . 1 1 57 57 GLY C C 57 174.558 174.558 174.316 0.242 17890 13851 1 18 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.851 1.104 17890 13852 1 18 . 1 1 57 57 GLY H H 57 8.157 8.157 8.447 -0.290 17890 13853 1 18 . 1 1 58 58 SER N N 58 116.740 116.740 115.622 1.118 17890 13854 1 18 . 1 1 58 58 SER HA H 58 4.288 4.288 4.450 -0.162 17890 13855 1 18 . 1 1 58 58 SER C C 58 177.252 177.252 176.243 1.009 17890 13856 1 18 . 1 1 58 58 SER CA C 58 58.737 58.737 57.290 1.447 17890 13857 1 18 . 1 1 58 58 SER CB C 58 64.576 64.576 64.174 0.402 17890 13858 1 18 . 1 1 58 58 SER H H 58 8.328 8.328 7.893 0.435 17890 13859 1 18 . 1 1 59 59 SER N N 59 119.768 119.768 122.048 -2.280 17890 13860 1 18 . 1 1 59 59 SER HA H 59 4.046 4.046 4.128 -0.082 17890 13861 1 18 . 1 1 59 59 SER C C 59 176.671 176.671 176.105 0.566 17890 13862 1 18 . 1 1 59 59 SER CA C 59 61.691 61.691 60.645 1.046 17890 13863 1 18 . 1 1 59 59 SER CB C 59 63.154 63.154 62.922 0.232 17890 13864 1 18 . 1 1 59 59 SER H H 59 9.020 9.020 8.917 0.103 17890 13865 1 18 . 1 1 60 60 GLU N N 60 119.133 119.133 121.489 -2.356 17890 13866 1 18 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.034 0.152 17890 13867 1 18 . 1 1 60 60 GLU C C 60 177.435 177.435 177.365 0.070 17890 13868 1 18 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.537 1.496 17890 13869 1 18 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.453 -1.227 17890 13870 1 18 . 1 1 60 60 GLU H H 60 8.832 8.832 7.702 1.130 17890 13871 1 18 . 1 1 61 61 GLN N N 61 118.818 118.818 115.910 2.908 17890 13872 1 18 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.978 0.199 17890 13873 1 18 . 1 1 61 61 GLN C C 61 173.254 173.254 175.289 -2.035 17890 13874 1 18 . 1 1 61 61 GLN CA C 61 54.373 54.373 55.364 -0.991 17890 13875 1 18 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.098 -2.176 17890 13876 1 18 . 1 1 61 61 GLN H H 61 7.648 7.648 7.718 -0.070 17890 13877 1 18 . 1 1 62 62 ALA N N 62 122.562 122.562 122.294 0.268 17890 13878 1 18 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.578 0.486 17890 13879 1 18 . 1 1 62 62 ALA C C 62 176.637 176.637 175.158 1.479 17890 13880 1 18 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.048 0.131 17890 13881 1 18 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.374 -0.779 17890 13882 1 18 . 1 1 62 62 ALA H H 62 7.315 7.315 6.875 0.440 17890 13883 1 18 . 1 1 63 63 TRP N N 63 124.787 124.787 120.834 3.953 17890 13884 1 18 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.373 -0.409 17890 13885 1 18 . 1 1 63 63 TRP C C 63 174.351 174.351 175.301 -0.950 17890 13886 1 18 . 1 1 63 63 TRP CA C 63 55.902 55.902 55.977 -0.075 17890 13887 1 18 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.838 -1.721 17890 13888 1 18 . 1 1 63 63 TRP H H 63 9.544 9.544 9.038 0.506 17890 13889 1 18 . 1 1 64 64 ILE N N 64 122.482 122.482 119.167 3.315 17890 13890 1 18 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.986 -0.292 17890 13891 1 18 . 1 1 64 64 ILE C C 64 177.078 177.078 174.228 2.850 17890 13892 1 18 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.528 0.503 17890 13893 1 18 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.493 -1.124 17890 13894 1 18 . 1 1 64 64 ILE H H 64 10.235 10.235 9.390 0.845 17890 13895 1 18 . 1 1 65 65 LEU N N 65 132.183 132.183 128.510 3.673 17890 13896 1 18 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.505 -0.040 17890 13897 1 18 . 1 1 65 65 LEU C C 65 177.048 177.048 174.465 2.583 17890 13898 1 18 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.771 0.578 17890 13899 1 18 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.169 -3.825 17890 13900 1 18 . 1 1 65 65 LEU H H 65 9.432 9.432 9.306 0.126 17890 13901 1 18 . 1 1 66 66 ARG N N 66 120.807 120.807 125.761 -4.954 17890 13902 1 18 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.910 -0.022 17890 13903 1 18 . 1 1 66 66 ARG C C 66 175.275 175.275 174.459 0.816 17890 13904 1 18 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.564 0.491 17890 13905 1 18 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.355 -1.363 17890 13906 1 18 . 1 1 66 66 ARG H H 66 8.491 8.491 8.599 -0.108 17890 13907 1 18 . 1 1 67 67 SER N N 67 119.709 119.709 117.970 1.739 17890 13908 1 18 . 1 1 67 67 SER HA H 67 3.186 3.186 3.410 -0.224 17890 13909 1 18 . 1 1 67 67 SER C C 67 174.508 174.508 173.577 0.931 17890 13910 1 18 . 1 1 67 67 SER CA C 67 58.521 58.521 58.990 -0.469 17890 13911 1 18 . 1 1 67 67 SER CB C 67 62.590 62.590 63.220 -0.630 17890 13912 1 18 . 1 1 67 67 SER H H 67 8.557 8.557 8.706 -0.149 17890 13913 1 18 . 1 1 68 68 TYR N N 68 131.011 131.011 127.310 3.701 17890 13914 1 18 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.641 -0.193 17890 13915 1 18 . 1 1 68 68 TYR C C 68 174.687 174.687 174.797 -0.110 17890 13916 1 18 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.782 0.983 17890 13917 1 18 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.923 -1.935 17890 13918 1 18 . 1 1 68 68 TYR H H 68 8.531 8.531 8.595 -0.064 17890 13919 1 18 . 1 1 69 69 ASP N N 69 117.066 117.066 119.941 -2.875 17890 13920 1 18 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.817 -0.192 17890 13921 1 18 . 1 1 69 69 ASP C C 69 176.455 176.455 176.481 -0.026 17890 13922 1 18 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.845 -0.754 17890 13923 1 18 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.853 -0.706 17890 13924 1 18 . 1 1 69 69 ASP H H 69 7.122 7.122 7.648 -0.526 17890 13925 1 18 . 1 1 70 70 SER N N 70 122.869 122.869 119.565 3.304 17890 13926 1 18 . 1 1 70 70 SER HA H 70 4.270 4.270 4.107 0.163 17890 13927 1 18 . 1 1 70 70 SER C C 70 177.010 177.010 176.234 0.776 17890 13928 1 18 . 1 1 70 70 SER CA C 70 60.837 60.837 61.950 -1.113 17890 13929 1 18 . 1 1 70 70 SER CB C 70 62.722 62.722 63.114 -0.392 17890 13930 1 18 . 1 1 70 70 SER H H 70 8.757 8.757 8.822 -0.065 17890 13931 1 18 . 1 1 71 71 ASN N N 71 119.873 119.873 119.534 0.339 17890 13932 1 18 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.594 -0.023 17890 13933 1 18 . 1 1 71 71 ASN C C 71 176.226 176.226 176.036 0.190 17890 13934 1 18 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.369 0.345 17890 13935 1 18 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.345 0.296 17890 13936 1 18 . 1 1 71 71 ASN H H 71 8.342 8.342 8.627 -0.285 17890 13937 1 18 . 1 1 72 72 SER N N 72 112.202 112.202 112.990 -0.788 17890 13938 1 18 . 1 1 72 72 SER HA H 72 4.567 4.567 4.709 -0.142 17890 13939 1 18 . 1 1 72 72 SER C C 72 173.789 173.789 173.746 0.043 17890 13940 1 18 . 1 1 72 72 SER CA C 72 57.816 57.816 58.108 -0.292 17890 13941 1 18 . 1 1 72 72 SER CB C 72 63.935 63.935 64.680 -0.745 17890 13942 1 18 . 1 1 72 72 SER H H 72 7.560 7.560 7.794 -0.234 17890 13943 1 18 . 1 1 73 73 ASN N N 73 117.437 117.437 119.009 -1.572 17890 13944 1 18 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.390 0.144 17890 13945 1 18 . 1 1 73 73 ASN C C 73 173.647 173.647 174.087 -0.440 17890 13946 1 18 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.604 -0.081 17890 13947 1 18 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.036 0.177 17890 13948 1 18 . 1 1 73 73 ASN H H 73 7.940 7.940 8.050 -0.110 17890 13949 1 18 . 1 1 74 74 THR N N 74 104.227 104.227 109.597 -5.370 17890 13950 1 18 . 1 1 74 74 THR HA H 74 5.477 5.477 4.941 0.536 17890 13951 1 18 . 1 1 74 74 THR C C 74 176.824 176.824 173.890 2.934 17890 13952 1 18 . 1 1 74 74 THR CA C 74 59.768 59.768 61.687 -1.919 17890 13953 1 18 . 1 1 74 74 THR CB C 74 71.985 71.985 69.954 2.031 17890 13954 1 18 . 1 1 74 74 THR H H 74 7.737 7.737 7.765 -0.028 17890 13955 1 18 . 1 1 75 75 TRP N N 75 124.636 124.636 123.788 0.848 17890 13956 1 18 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.322 -0.115 17890 13957 1 18 . 1 1 75 75 TRP C C 75 175.876 175.876 176.117 -0.241 17890 13958 1 18 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.175 1.431 17890 13959 1 18 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.645 -0.129 17890 13960 1 18 . 1 1 75 75 TRP H H 75 9.442 9.442 9.103 0.339 17890 13961 1 18 . 1 1 76 76 THR N N 76 110.544 110.544 115.190 -4.646 17890 13962 1 18 . 1 1 76 76 THR HA H 76 5.129 5.129 5.067 0.062 17890 13963 1 18 . 1 1 76 76 THR C C 76 174.506 174.506 174.204 0.302 17890 13964 1 18 . 1 1 76 76 THR CA C 76 60.561 60.561 61.662 -1.101 17890 13965 1 18 . 1 1 76 76 THR CB C 76 71.688 71.688 70.220 1.468 17890 13966 1 18 . 1 1 76 76 THR H H 76 9.415 9.415 9.438 -0.023 17890 13967 1 18 . 1 1 77 77 ILE N N 77 121.567 121.567 124.131 -2.564 17890 13968 1 18 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.262 -0.123 17890 13969 1 18 . 1 1 77 77 ILE C C 77 176.148 176.148 175.118 1.030 17890 13970 1 18 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.634 2.074 17890 13971 1 18 . 1 1 77 77 ILE CB C 77 40.987 40.987 40.416 0.571 17890 13972 1 18 . 1 1 77 77 ILE H H 77 9.255 9.255 8.401 0.854 17890 13973 1 18 . 1 1 78 78 SER N N 78 122.269 122.269 120.957 1.312 17890 13974 1 18 . 1 1 78 78 SER HA H 78 5.601 5.601 5.235 0.366 17890 13975 1 18 . 1 1 78 78 SER CA C 78 55.835 55.835 56.142 -0.308 17890 13976 1 18 . 1 1 78 78 SER CB C 78 65.858 65.858 66.520 -0.662 17890 13977 1 18 . 1 1 78 78 SER H H 78 9.226 9.226 8.678 0.548 17890 13978 1 18 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.275 -0.411 17890 13979 1 18 . 1 1 79 79 PRO C C 79 178.175 178.175 176.570 1.605 17890 13980 1 18 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.404 0.480 17890 13981 1 18 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.062 -1.790 17890 13982 1 18 . 1 1 80 80 VAL N N 80 121.906 121.906 120.989 0.917 17890 13983 1 18 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.725 -0.144 17890 13984 1 18 . 1 1 80 80 VAL C C 80 177.751 177.751 177.388 0.363 17890 13985 1 18 . 1 1 80 80 VAL CA C 80 66.067 66.067 65.055 1.012 17890 13986 1 18 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.401 0.084 17890 13987 1 18 . 1 1 80 80 VAL H H 80 7.328 7.328 8.092 -0.764 17890 13988 1 18 . 1 1 81 81 GLY N N 81 104.643 104.643 105.781 -1.138 17890 13989 1 18 . 1 1 81 81 GLY C C 81 174.979 174.979 174.689 0.290 17890 13990 1 18 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.356 -0.268 17890 13991 1 18 . 1 1 81 81 GLY H H 81 8.949 8.949 8.301 0.648 17890 13992 1 18 . 1 1 82 82 SER N N 82 111.865 111.865 116.117 -4.252 17890 13993 1 18 . 1 1 82 82 SER HA H 82 4.646 4.646 4.884 -0.238 17890 13994 1 18 . 1 1 82 82 SER CA C 82 55.441 55.441 55.739 -0.298 17890 13995 1 18 . 1 1 82 82 SER CB C 82 62.277 62.277 64.030 -1.753 17890 13996 1 18 . 1 1 82 82 SER H H 82 6.968 6.968 7.131 -0.163 17890 13997 1 18 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.624 -0.277 17890 13998 1 18 . 1 1 83 83 PRO C C 83 176.660 176.660 176.404 0.256 17890 13999 1 18 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.287 0.916 17890 14000 1 18 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.866 0.952 17890 14001 1 18 . 1 1 84 84 ASN N N 84 116.542 116.542 115.905 0.637 17890 14002 1 18 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.716 0.285 17890 14003 1 18 . 1 1 84 84 ASN C C 84 175.825 175.825 175.216 0.609 17890 14004 1 18 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.964 -1.073 17890 14005 1 18 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.573 0.171 17890 14006 1 18 . 1 1 84 84 ASN H H 84 8.502 8.502 8.494 0.008 17890 14007 1 18 . 1 1 85 85 SER N N 85 114.633 114.633 113.403 1.230 17890 14008 1 18 . 1 1 85 85 SER HA H 85 4.624 4.624 4.876 -0.252 17890 14009 1 18 . 1 1 85 85 SER C C 85 172.963 172.963 172.235 0.728 17890 14010 1 18 . 1 1 85 85 SER CA C 85 59.210 59.210 57.780 1.430 17890 14011 1 18 . 1 1 85 85 SER CB C 85 64.697 64.697 66.696 -1.999 17890 14012 1 18 . 1 1 85 85 SER H H 85 7.980 7.980 7.936 0.044 17890 14013 1 18 . 1 1 86 86 GLN N N 86 119.016 119.016 118.556 0.460 17890 14014 1 18 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.521 -0.075 17890 14015 1 18 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.351 0.101 17890 14016 1 18 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.222 0.176 17890 14017 1 18 . 1 1 86 86 GLN H H 86 9.399 9.399 9.185 0.214 17890 14018 1 18 . 1 1 87 87 ILE N N 87 119.691 119.691 119.580 0.111 17890 14019 1 18 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.168 -0.593 17890 14020 1 18 . 1 1 87 87 ILE C C 87 176.505 176.505 176.062 0.443 17890 14021 1 18 . 1 1 87 87 ILE CA C 87 63.494 63.494 59.021 4.473 17890 14022 1 18 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.686 -0.489 17890 14023 1 18 . 1 1 87 87 ILE H H 87 8.970 8.970 8.313 0.657 17890 14024 1 18 . 1 1 88 88 GLY N N 88 118.378 118.378 114.988 3.390 17890 14025 1 18 . 1 1 88 88 GLY C C 88 171.397 171.397 171.757 -0.360 17890 14026 1 18 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.425 -0.821 17890 14027 1 18 . 1 1 88 88 GLY H H 88 9.752 9.752 9.032 0.720 17890 14028 1 18 . 1 1 89 89 TRP N N 89 122.749 122.749 121.782 0.967 17890 14029 1 18 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.388 -0.790 17890 14030 1 18 . 1 1 89 89 TRP C C 89 175.924 175.924 174.767 1.157 17890 14031 1 18 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.076 0.207 17890 14032 1 18 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.449 -2.363 17890 14033 1 18 . 1 1 89 89 TRP H H 89 8.215 8.215 8.202 0.013 17890 14034 1 18 . 1 1 90 90 GLY N N 90 116.305 116.305 110.847 5.458 17890 14035 1 18 . 1 1 90 90 GLY C C 90 173.725 173.725 172.452 1.273 17890 14036 1 18 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.497 0.558 17890 14037 1 18 . 1 1 90 90 GLY H H 90 8.922 8.922 8.202 0.720 17890 14038 1 18 . 1 1 91 91 ALA N N 91 123.795 123.795 122.102 1.693 17890 14039 1 18 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.167 0.076 17890 14040 1 18 . 1 1 91 91 ALA C C 91 178.510 178.510 178.915 -0.405 17890 14041 1 18 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.483 0.007 17890 14042 1 18 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.750 -0.341 17890 14043 1 18 . 1 1 91 91 ALA H H 91 8.367 8.367 8.158 0.209 17890 14044 1 18 . 1 1 92 92 GLY N N 92 108.871 108.871 112.760 -3.889 17890 14045 1 18 . 1 1 92 92 GLY C C 92 174.528 174.528 174.734 -0.206 17890 14046 1 18 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.739 0.519 17890 14047 1 18 . 1 1 92 92 GLY H H 92 8.776 8.776 8.613 0.163 17890 14048 1 18 . 1 1 93 93 ASN N N 93 114.921 114.921 116.925 -2.004 17890 14049 1 18 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.745 -0.296 17890 14050 1 18 . 1 1 93 93 ASN C C 93 172.774 172.774 173.765 -0.991 17890 14051 1 18 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.208 0.765 17890 14052 1 18 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.229 -0.900 17890 14053 1 18 . 1 1 93 93 ASN H H 93 8.647 8.647 8.321 0.326 17890 14054 1 18 . 1 1 94 94 VAL N N 94 112.437 112.437 118.445 -6.008 17890 14055 1 18 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.504 0.561 17890 14056 1 18 . 1 1 94 94 VAL CA C 94 56.915 56.915 57.977 -1.062 17890 14057 1 18 . 1 1 94 94 VAL CB C 94 34.155 34.155 36.149 -1.994 17890 14058 1 18 . 1 1 94 94 VAL H H 94 6.989 6.989 7.493 -0.504 17890 14059 1 18 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.953 -0.025 17890 14060 1 18 . 1 1 95 95 PRO C C 95 176.041 176.041 175.882 0.159 17890 14061 1 18 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.586 -1.385 17890 14062 1 18 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.682 -0.957 17890 14063 1 18 . 1 1 96 96 VAL N N 96 113.564 113.564 115.536 -1.972 17890 14064 1 18 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.952 -0.217 17890 14065 1 18 . 1 1 96 96 VAL C C 96 173.656 173.656 175.231 -1.575 17890 14066 1 18 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.113 -0.260 17890 14067 1 18 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.772 1.381 17890 14068 1 18 . 1 1 96 96 VAL H H 96 8.199 8.199 8.834 -0.635 17890 14069 1 18 . 1 1 97 97 VAL N N 97 122.328 122.328 124.085 -1.757 17890 14070 1 18 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.553 0.078 17890 14071 1 18 . 1 1 97 97 VAL C C 97 174.776 174.776 175.159 -0.383 17890 14072 1 18 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.916 -0.259 17890 14073 1 18 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.250 -0.122 17890 14074 1 18 . 1 1 97 97 VAL H H 97 8.957 8.957 8.349 0.608 17890 14075 1 18 . 1 1 98 98 LEU N N 98 130.258 130.258 129.054 1.204 17890 14076 1 18 . 1 1 98 98 LEU HA H 98 5.050 5.050 5.002 0.048 17890 14077 1 18 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.299 1.524 17890 14078 1 18 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.011 1.107 17890 14079 1 18 . 1 1 98 98 LEU H H 98 9.245 9.245 9.014 0.231 17890 14080 1 18 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.807 -0.028 17890 14081 1 18 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.110 0.379 17890 14082 1 18 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.346 -0.892 17890 14083 1 18 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.546 -0.561 17890 14084 1 18 . 1 1 100 100 PRO C C 100 177.309 177.309 175.839 1.470 17890 14085 1 18 . 1 1 100 100 PRO CA C 100 63.824 63.824 62.991 0.833 17890 14086 1 18 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.221 -0.116 17890 14087 1 18 . 1 1 101 101 ASN N N 101 119.284 119.284 126.063 -6.779 17890 14088 1 18 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.652 -0.110 17890 14089 1 18 . 1 1 101 101 ASN C C 101 171.920 171.920 173.951 -2.031 17890 14090 1 18 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.822 -0.622 17890 14091 1 18 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.476 -1.851 17890 14092 1 18 . 1 1 101 101 ASN H H 101 7.273 7.273 9.373 -2.100 17890 14093 1 18 . 1 1 102 102 ASN N N 102 115.674 115.674 116.240 -0.566 17890 14094 1 18 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.752 -0.834 17890 14095 1 18 . 1 1 102 102 ASN C C 102 173.264 173.264 174.355 -1.091 17890 14096 1 18 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.810 1.229 17890 14097 1 18 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.003 -1.021 17890 14098 1 18 . 1 1 102 102 ASN H H 102 8.197 8.197 7.882 0.315 17890 14099 1 18 . 1 1 103 103 TYR N N 103 118.775 118.775 121.334 -2.559 17890 14100 1 18 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.319 0.166 17890 14101 1 18 . 1 1 103 103 TYR C C 103 175.248 175.248 174.963 0.285 17890 14102 1 18 . 1 1 103 103 TYR CA C 103 57.490 57.490 60.172 -2.682 17890 14103 1 18 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.719 -1.187 17890 14104 1 18 . 1 1 103 103 TYR H H 103 7.745 7.745 7.364 0.381 17890 14105 1 18 . 1 1 104 104 VAL N N 104 116.205 116.205 115.360 0.845 17890 14106 1 18 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.912 0.065 17890 14107 1 18 . 1 1 104 104 VAL C C 104 174.361 174.361 173.670 0.691 17890 14108 1 18 . 1 1 104 104 VAL CA C 104 58.251 58.251 60.162 -1.911 17890 14109 1 18 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.606 -0.063 17890 14110 1 18 . 1 1 104 104 VAL H H 104 7.498 7.498 8.046 -0.548 17890 14111 1 18 . 1 1 105 105 TRP N N 105 119.557 119.557 120.155 -0.598 17890 14112 1 18 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.090 -0.215 17890 14113 1 18 . 1 1 105 105 TRP C C 105 175.526 175.526 176.458 -0.932 17890 14114 1 18 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.355 -0.471 17890 14115 1 18 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.674 -0.135 17890 14116 1 18 . 1 1 105 105 TRP H H 105 8.926 8.926 9.024 -0.098 17890 14117 1 18 . 1 1 106 106 THR N N 106 120.480 120.480 120.198 0.282 17890 14118 1 18 . 1 1 106 106 THR HA H 106 4.966 4.966 4.769 0.197 17890 14119 1 18 . 1 1 106 106 THR C C 106 174.177 174.177 174.031 0.146 17890 14120 1 18 . 1 1 106 106 THR CA C 106 62.091 62.091 64.009 -1.918 17890 14121 1 18 . 1 1 106 106 THR CB C 106 69.649 69.649 69.086 0.563 17890 14122 1 18 . 1 1 106 106 THR H H 106 9.525 9.525 9.129 0.396 17890 14123 1 18 . 1 1 107 107 LEU N N 107 127.146 127.146 130.036 -2.890 17890 14124 1 18 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.226 -0.399 17890 14125 1 18 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.455 0.254 17890 14126 1 18 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.800 -2.277 17890 14127 1 18 . 1 1 107 107 LEU H H 107 7.591 7.591 8.964 -1.373 17890 14128 1 18 . 1 1 108 108 THR N N 108 119.928 119.928 118.601 1.327 17890 14129 1 18 . 1 1 108 108 THR HA H 108 4.411 4.411 4.986 -0.575 17890 14130 1 18 . 1 1 108 108 THR C C 108 173.319 173.319 173.194 0.125 17890 14131 1 18 . 1 1 108 108 THR CA C 108 62.243 62.243 61.775 0.468 17890 14132 1 18 . 1 1 108 108 THR CB C 108 70.138 70.138 71.855 -1.717 17890 14133 1 18 . 1 1 108 108 THR H H 108 8.141 8.141 8.457 -0.316 17890 14134 1 18 . 1 1 109 109 LEU N N 109 130.557 130.557 129.182 1.375 17890 14135 1 18 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.113 -0.568 17890 14136 1 18 . 1 1 109 109 LEU C C 109 175.217 175.217 176.212 -0.995 17890 14137 1 18 . 1 1 109 109 LEU CA C 109 55.286 55.286 54.814 0.472 17890 14138 1 18 . 1 1 109 109 LEU CB C 109 40.606 40.606 43.076 -2.470 17890 14139 1 18 . 1 1 109 109 LEU H H 109 8.924 8.924 8.914 0.010 17890 14140 1 18 . 1 1 110 110 THR N N 110 120.160 120.160 115.062 5.098 17890 14141 1 18 . 1 1 110 110 THR HA H 110 4.911 4.911 4.703 0.208 17890 14142 1 18 . 1 1 110 110 THR CA C 110 60.141 60.141 60.706 -0.565 17890 14143 1 18 . 1 1 110 110 THR CB C 110 72.785 72.785 70.808 1.977 17890 14144 1 18 . 1 1 110 110 THR H H 110 7.677 7.677 8.453 -0.776 17890 14145 1 18 . 1 1 111 111 SER HA H 111 4.204 4.204 4.262 -0.058 17890 14146 1 18 . 1 1 111 111 SER C C 111 174.755 174.755 175.278 -0.523 17890 14147 1 18 . 1 1 111 111 SER CA C 111 60.710 60.710 59.577 1.133 17890 14148 1 18 . 1 1 111 111 SER CB C 111 62.660 62.660 62.813 -0.153 17890 14149 1 18 . 1 1 112 112 GLY N N 112 107.313 107.313 107.222 0.091 17890 14150 1 18 . 1 1 112 112 GLY C C 112 173.023 173.023 173.271 -0.248 17890 14151 1 18 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.054 -0.904 17890 14152 1 18 . 1 1 112 112 GLY H H 112 8.249 8.249 7.500 0.749 17890 14153 1 18 . 1 1 113 113 GLY N N 113 105.618 105.618 108.120 -2.502 17890 14154 1 18 . 1 1 113 113 GLY C C 113 175.844 175.844 171.666 4.178 17890 14155 1 18 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.859 -3.100 17890 14156 1 18 . 1 1 113 113 GLY H H 113 7.444 7.444 7.374 0.070 17890 14157 1 18 . 1 1 114 114 TYR N N 114 121.548 121.548 117.405 4.143 17890 14158 1 18 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.423 -0.571 17890 14159 1 18 . 1 1 114 114 TYR C C 114 175.605 175.605 174.211 1.394 17890 14160 1 18 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.847 4.416 17890 14161 1 18 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.410 -4.477 17890 14162 1 18 . 1 1 114 114 TYR H H 114 9.677 9.677 8.959 0.718 17890 14163 1 18 . 1 1 115 115 ASN N N 115 123.274 123.274 117.419 5.855 17890 14164 1 18 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.234 -0.136 17890 14165 1 18 . 1 1 115 115 ASN C C 115 174.355 174.355 173.481 0.874 17890 14166 1 18 . 1 1 115 115 ASN CA C 115 51.046 51.046 51.442 -0.396 17890 14167 1 18 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.529 -2.180 17890 14168 1 18 . 1 1 115 115 ASN H H 115 9.350 9.350 9.054 0.296 17890 14169 1 18 . 1 1 116 116 ILE N N 116 130.611 130.611 122.532 8.079 17890 14170 1 18 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.710 -0.471 17890 14171 1 18 . 1 1 116 116 ILE C C 116 173.998 173.998 173.999 -0.001 17890 14172 1 18 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.222 1.976 17890 14173 1 18 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.225 -2.125 17890 14174 1 18 . 1 1 116 116 ILE H H 116 9.473 9.473 8.742 0.731 17890 14175 1 18 . 1 1 117 117 GLN N N 117 121.633 121.633 125.237 -3.604 17890 14176 1 18 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.000 0.935 17890 14177 1 18 . 1 1 117 117 GLN C C 117 177.902 177.902 175.923 1.979 17890 14178 1 18 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.855 -0.535 17890 14179 1 18 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.475 3.982 17890 14180 1 18 . 1 1 117 117 GLN H H 117 8.781 8.781 8.735 0.046 17890 14181 1 18 . 1 1 118 118 ASP N N 118 116.836 116.836 120.168 -3.332 17890 14182 1 18 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.862 0.921 17890 14183 1 18 . 1 1 118 118 ASP C C 118 178.084 178.084 176.604 1.480 17890 14184 1 18 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.326 -1.556 17890 14185 1 18 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.212 -0.844 17890 14186 1 18 . 1 1 118 118 ASP H H 118 9.330 9.330 8.652 0.678 17890 14187 1 18 . 1 1 119 119 GLY N N 119 111.037 111.037 107.428 3.609 17890 14188 1 18 . 1 1 119 119 GLY C C 119 174.196 174.196 175.284 -1.088 17890 14189 1 18 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.022 1.954 17890 14190 1 18 . 1 1 119 119 GLY H H 119 8.986 8.986 8.389 0.597 17890 14191 1 18 . 1 1 120 120 LYS N N 120 114.809 114.809 122.614 -7.805 17890 14192 1 18 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.606 -0.257 17890 14193 1 18 . 1 1 120 120 LYS C C 120 175.174 175.174 176.445 -1.271 17890 14194 1 18 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.046 1.887 17890 14195 1 18 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.376 0.100 17890 14196 1 18 . 1 1 120 120 LYS H H 120 7.045 7.045 8.637 -1.592 17890 14197 1 18 . 1 1 121 121 ARG N N 121 116.291 116.291 114.385 1.906 17890 14198 1 18 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.041 -0.455 17890 14199 1 18 . 1 1 121 121 ARG C C 121 175.097 175.097 177.172 -2.075 17890 14200 1 18 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.191 0.878 17890 14201 1 18 . 1 1 121 121 ARG CB C 121 26.623 26.623 27.194 -0.571 17890 14202 1 18 . 1 1 121 121 ARG H H 121 7.683 7.683 7.928 -0.245 17890 14203 1 18 . 1 1 122 122 THR N N 122 113.730 113.730 109.564 4.166 17890 14204 1 18 . 1 1 122 122 THR HA H 122 4.540 4.540 4.222 0.318 17890 14205 1 18 . 1 1 122 122 THR C C 122 175.302 175.302 174.625 0.677 17890 14206 1 18 . 1 1 122 122 THR CA C 122 62.871 62.871 64.234 -1.363 17890 14207 1 18 . 1 1 122 122 THR CB C 122 71.552 71.552 69.652 1.900 17890 14208 1 18 . 1 1 122 122 THR H H 122 11.059 11.059 7.922 3.137 17890 14209 1 18 . 1 1 123 123 VAL N N 123 118.350 118.350 114.688 3.662 17890 14210 1 18 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.591 0.219 17890 14211 1 18 . 1 1 123 123 VAL C C 123 174.730 174.730 173.507 1.223 17890 14212 1 18 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.370 -0.059 17890 14213 1 18 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.925 2.157 17890 14214 1 18 . 1 1 123 123 VAL H H 123 8.181 8.181 7.465 0.716 17890 14215 1 18 . 1 1 124 124 SER N N 124 113.053 113.053 113.494 -0.441 17890 14216 1 18 . 1 1 124 124 SER HA H 124 5.820 5.820 5.213 0.607 17890 14217 1 18 . 1 1 124 124 SER C C 124 175.521 175.521 173.433 2.088 17890 14218 1 18 . 1 1 124 124 SER CA C 124 58.087 58.087 56.932 1.155 17890 14219 1 18 . 1 1 124 124 SER CB C 124 67.405 67.405 66.007 1.398 17890 14220 1 18 . 1 1 124 124 SER H H 124 9.138 9.138 8.568 0.570 17890 14221 1 18 . 1 1 125 125 TRP N N 125 124.900 124.900 125.208 -0.308 17890 14222 1 18 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.084 0.526 17890 14223 1 18 . 1 1 125 125 TRP C C 125 178.114 178.114 177.425 0.689 17890 14224 1 18 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.148 -0.674 17890 14225 1 18 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.234 0.789 17890 14226 1 18 . 1 1 125 125 TRP H H 125 8.843 8.843 8.329 0.514 17890 14227 1 18 . 1 1 126 126 SER N N 126 119.243 119.243 113.808 5.435 17890 14228 1 18 . 1 1 126 126 SER HA H 126 5.443 5.443 5.351 0.092 17890 14229 1 18 . 1 1 126 126 SER C C 126 171.668 171.668 172.872 -1.204 17890 14230 1 18 . 1 1 126 126 SER CA C 126 58.696 58.696 57.170 1.526 17890 14231 1 18 . 1 1 126 126 SER CB C 126 66.176 66.176 66.102 0.074 17890 14232 1 18 . 1 1 126 126 SER H H 126 9.835 9.835 9.265 0.570 17890 14233 1 18 . 1 1 127 127 LEU N N 127 113.708 113.708 117.965 -4.257 17890 14234 1 18 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.704 0.451 17890 14235 1 18 . 1 1 127 127 LEU C C 127 176.563 176.563 176.170 0.393 17890 14236 1 18 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.491 -0.846 17890 14237 1 18 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.123 -1.427 17890 14238 1 18 . 1 1 127 127 LEU H H 127 6.559 6.559 8.108 -1.549 17890 14239 1 18 . 1 1 128 128 ASN N N 128 121.739 121.739 117.556 4.183 17890 14240 1 18 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.938 -0.249 17890 14241 1 18 . 1 1 128 128 ASN C C 128 175.452 175.452 175.843 -0.391 17890 14242 1 18 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.691 1.316 17890 14243 1 18 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.272 -0.981 17890 14244 1 18 . 1 1 128 128 ASN H H 128 8.662 8.662 9.038 -0.376 17890 14245 1 18 . 1 1 129 129 ASN N N 129 119.586 119.586 116.297 3.289 17890 14246 1 18 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.863 0.134 17890 14247 1 18 . 1 1 129 129 ASN C C 129 175.900 175.900 174.780 1.120 17890 14248 1 18 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.383 0.850 17890 14249 1 18 . 1 1 129 129 ASN CB C 129 41.256 41.256 41.075 0.181 17890 14250 1 18 . 1 1 129 129 ASN H H 129 10.962 10.962 8.826 2.136 17890 14251 1 18 . 1 1 130 130 ALA N N 130 128.292 128.292 121.984 6.308 17890 14252 1 18 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.000 -0.430 17890 14253 1 18 . 1 1 130 130 ALA C C 130 172.620 172.620 176.411 -3.791 17890 14254 1 18 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.363 -0.724 17890 14255 1 18 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.194 -1.094 17890 14256 1 18 . 1 1 130 130 ALA H H 130 10.629 10.629 8.622 2.007 17890 14257 1 18 . 1 1 131 131 THR N N 131 105.584 105.584 110.653 -5.069 17890 14258 1 18 . 1 1 131 131 THR HA H 131 4.462 4.462 4.357 0.105 17890 14259 1 18 . 1 1 131 131 THR C C 131 173.552 173.552 174.576 -1.024 17890 14260 1 18 . 1 1 131 131 THR CA C 131 58.338 58.338 61.166 -2.828 17890 14261 1 18 . 1 1 131 131 THR CB C 131 71.569 71.569 69.906 1.663 17890 14262 1 18 . 1 1 131 131 THR H H 131 7.092 7.092 7.785 -0.693 17890 14263 1 18 . 1 1 132 132 ALA N N 132 121.773 121.773 122.470 -0.697 17890 14264 1 18 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.074 -0.325 17890 14265 1 18 . 1 1 132 132 ALA C C 132 178.819 178.819 178.547 0.272 17890 14266 1 18 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.764 1.520 17890 14267 1 18 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.729 -0.502 17890 14268 1 18 . 1 1 132 132 ALA H H 132 8.952 8.952 8.304 0.648 17890 14269 1 18 . 1 1 133 133 GLY N N 133 113.965 113.965 111.706 2.259 17890 14270 1 18 . 1 1 133 133 GLY C C 133 173.453 173.453 174.096 -0.643 17890 14271 1 18 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.961 0.205 17890 14272 1 18 . 1 1 133 133 GLY H H 133 9.016 9.016 8.708 0.308 17890 14273 1 18 . 1 1 134 134 GLU N N 134 123.460 123.460 121.097 2.363 17890 14274 1 18 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.359 -0.401 17890 14275 1 18 . 1 1 134 134 GLU C C 134 176.120 176.120 176.079 0.041 17890 14276 1 18 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.746 1.653 17890 14277 1 18 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.975 0.410 17890 14278 1 18 . 1 1 134 134 GLU H H 134 7.598 7.598 7.605 -0.007 17890 14279 1 18 . 1 1 135 135 GLU N N 135 122.633 122.633 124.915 -2.282 17890 14280 1 18 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.185 0.126 17890 14281 1 18 . 1 1 135 135 GLU C C 135 176.014 176.014 176.617 -0.603 17890 14282 1 18 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.875 -0.693 17890 14283 1 18 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.541 -1.088 17890 14284 1 18 . 1 1 135 135 GLU H H 135 8.258 8.258 8.648 -0.390 17890 14285 1 18 . 1 1 136 136 VAL N N 136 123.635 123.635 125.078 -1.443 17890 14286 1 18 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.837 -0.145 17890 14287 1 18 . 1 1 136 136 VAL C C 136 173.932 173.932 175.803 -1.871 17890 14288 1 18 . 1 1 136 136 VAL CA C 136 63.832 63.832 64.176 -0.344 17890 14289 1 18 . 1 1 136 136 VAL CB C 136 31.864 31.864 31.887 -0.024 17890 14290 1 18 . 1 1 136 136 VAL H H 136 7.267 7.267 7.738 -0.471 17890 14291 1 18 . 1 1 137 137 SER N N 137 118.950 118.950 116.888 2.062 17890 14292 1 18 . 1 1 137 137 SER HA H 137 4.887 4.887 5.242 -0.355 17890 14293 1 18 . 1 1 137 137 SER C C 137 173.780 173.780 173.098 0.682 17890 14294 1 18 . 1 1 137 137 SER CA C 137 57.895 57.895 56.073 1.822 17890 14295 1 18 . 1 1 137 137 SER CB C 137 65.027 65.027 65.632 -0.605 17890 14296 1 18 . 1 1 137 137 SER H H 137 8.454 8.454 8.696 -0.242 17890 14297 1 18 . 1 1 138 138 ILE N N 138 123.511 123.511 121.729 1.782 17890 14298 1 18 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.084 -0.836 17890 14299 1 18 . 1 1 138 138 ILE C C 138 176.142 176.142 175.195 0.947 17890 14300 1 18 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.569 1.281 17890 14301 1 18 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.820 -3.225 17890 14302 1 18 . 1 1 138 138 ILE H H 138 7.915 7.915 7.951 -0.036 17890 14303 1 18 . 1 1 139 139 GLY N N 139 115.638 115.638 111.587 4.051 17890 14304 1 18 . 1 1 139 139 GLY C C 139 171.947 171.947 173.285 -1.338 17890 14305 1 18 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.435 1.651 17890 14306 1 18 . 1 1 139 139 GLY H H 139 8.490 8.490 8.391 0.099 17890 14307 1 18 . 1 1 140 140 ALA N N 140 128.563 128.563 121.569 6.994 17890 14308 1 18 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.344 0.052 17890 14309 1 18 . 1 1 140 140 ALA C C 140 177.956 177.956 176.777 1.179 17890 14310 1 18 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.343 -1.697 17890 14311 1 18 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.797 0.407 17890 14312 1 18 . 1 1 140 140 ALA H H 140 8.531 8.531 8.490 0.041 17890 14313 1 18 . 1 1 141 141 ASP N N 141 120.886 120.886 113.181 7.705 17890 14314 1 18 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.594 0.004 17890 14315 1 18 . 1 1 141 141 ASP C C 141 175.411 175.411 174.087 1.324 17890 14316 1 18 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.125 0.791 17890 14317 1 18 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.962 -1.270 17890 14318 1 18 . 1 1 141 141 ASP H H 141 8.507 8.507 7.807 0.700 17890 14319 1 18 . 1 1 142 142 ALA N N 142 125.604 125.604 121.191 4.413 17890 14320 1 18 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.699 -0.182 17890 14321 1 18 . 1 1 142 142 ALA C C 142 177.671 177.671 178.422 -0.751 17890 14322 1 18 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.593 0.400 17890 14323 1 18 . 1 1 142 142 ALA CB C 142 21.535 21.535 22.009 -0.474 17890 14324 1 18 . 1 1 142 142 ALA H H 142 7.894 7.894 8.265 -0.371 17890 14325 1 18 . 1 1 143 143 THR N N 143 118.085 118.085 117.081 1.004 17890 14326 1 18 . 1 1 143 143 THR HA H 143 3.744 3.744 4.115 -0.371 17890 14327 1 18 . 1 1 143 143 THR C C 143 175.464 175.464 175.230 0.234 17890 14328 1 18 . 1 1 143 143 THR CA C 143 64.548 64.548 65.025 -0.477 17890 14329 1 18 . 1 1 143 143 THR CB C 143 69.305 69.305 69.105 0.200 17890 14330 1 18 . 1 1 143 143 THR H H 143 8.268 8.268 8.890 -0.622 17890 14331 1 18 . 1 1 144 144 PHE N N 144 118.635 118.635 116.710 1.925 17890 14332 1 18 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.801 -0.455 17890 14333 1 18 . 1 1 144 144 PHE C C 144 176.209 176.209 175.559 0.650 17890 14334 1 18 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.614 3.849 17890 14335 1 18 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.014 0.590 17890 14336 1 18 . 1 1 144 144 PHE H H 144 8.719 8.719 7.825 0.893 17890 14337 1 18 . 1 1 145 145 SER N N 145 113.446 113.446 115.620 -2.174 17890 14338 1 18 . 1 1 145 145 SER HA H 145 4.866 4.866 4.010 0.856 17890 14339 1 18 . 1 1 145 145 SER C C 145 176.605 176.605 176.030 0.575 17890 14340 1 18 . 1 1 145 145 SER CA C 145 59.432 59.432 57.072 2.360 17890 14341 1 18 . 1 1 145 145 SER CB C 145 62.167 62.167 62.628 -0.461 17890 14342 1 18 . 1 1 145 145 SER H H 145 8.657 8.657 7.337 1.320 17890 14343 1 18 . 1 1 146 146 GLY N N 146 109.277 109.277 110.697 -1.420 17890 14344 1 18 . 1 1 146 146 GLY C C 146 174.293 174.293 173.571 0.722 17890 14345 1 18 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.246 -0.306 17890 14346 1 18 . 1 1 146 146 GLY H H 146 7.467 7.467 7.569 -0.102 17890 14347 1 18 . 1 1 147 147 ARG N N 147 122.863 122.863 118.128 4.735 17890 14348 1 18 . 1 1 147 147 ARG HA H 147 5.441 5.441 5.087 0.354 17890 14349 1 18 . 1 1 147 147 ARG C C 147 173.849 173.849 174.467 -0.618 17890 14350 1 18 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.860 -2.633 17890 14351 1 18 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.960 -1.363 17890 14352 1 18 . 1 1 147 147 ARG H H 147 7.556 7.556 7.055 0.501 17890 14353 1 18 . 1 1 148 148 TRP N N 148 118.465 118.465 120.765 -2.300 17890 14354 1 18 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.208 -0.362 17890 14355 1 18 . 1 1 148 148 TRP C C 148 174.353 174.353 174.328 0.025 17890 14356 1 18 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.756 -1.094 17890 14357 1 18 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.278 -1.279 17890 14358 1 18 . 1 1 148 148 TRP H H 148 8.709 8.709 9.236 -0.527 17890 14359 1 18 . 1 1 149 149 VAL N N 149 125.852 125.852 118.555 7.297 17890 14360 1 18 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.502 -0.359 17890 14361 1 18 . 1 1 149 149 VAL C C 149 173.613 173.613 173.204 0.409 17890 14362 1 18 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.889 1.851 17890 14363 1 18 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.349 -2.966 17890 14364 1 18 . 1 1 149 149 VAL H H 149 9.700 9.700 8.906 0.794 17890 14365 1 18 . 1 1 150 150 ILE N N 150 125.140 125.140 125.908 -0.768 17890 14366 1 18 . 1 1 150 150 ILE HA H 150 4.862 4.862 4.975 -0.113 17890 14367 1 18 . 1 1 150 150 ILE C C 150 175.661 175.661 174.910 0.751 17890 14368 1 18 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.334 1.487 17890 14369 1 18 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.099 -0.279 17890 14370 1 18 . 1 1 150 150 ILE H H 150 7.747 7.747 7.794 -0.047 17890 14371 1 18 . 1 1 151 151 GLU N N 151 126.762 126.762 128.105 -1.343 17890 14372 1 18 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.816 0.064 17890 14373 1 18 . 1 1 151 151 GLU C C 151 174.424 174.424 174.862 -0.438 17890 14374 1 18 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.083 0.713 17890 14375 1 18 . 1 1 151 151 GLU CB C 151 34.251 34.251 34.031 0.220 17890 14376 1 18 . 1 1 151 151 GLU H H 151 8.892 8.892 8.897 -0.005 17890 14377 1 18 . 1 1 152 152 LYS N N 152 126.299 126.299 123.106 3.193 17890 14378 1 18 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.707 0.154 17890 14379 1 18 . 1 1 152 152 LYS C C 152 176.282 176.282 176.703 -0.421 17890 14380 1 18 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.793 0.712 17890 14381 1 18 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.533 0.803 17890 14382 1 18 . 1 1 152 152 LYS H H 152 8.640 8.640 8.436 0.204 17890 14383 1 19 . 1 1 2 2 GLY CA C 2 43.294 43.294 45.084 -1.790 17890 14384 1 19 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.550 0.072 17890 14385 1 19 . 1 1 8 8 HIS CA C 8 55.661 55.661 55.637 0.024 17890 14386 1 19 . 1 1 8 8 HIS CB C 8 29.880 29.880 31.645 -1.765 17890 14387 1 19 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.607 0.039 17890 14388 1 19 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.768 -0.084 17890 14389 1 19 . 1 1 9 9 HIS CB C 9 29.831 29.831 31.564 -1.733 17890 14390 1 19 . 1 1 10 10 HIS N N 10 120.811 120.811 119.019 1.792 17890 14391 1 19 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.342 0.338 17890 14392 1 19 . 1 1 10 10 HIS C C 10 174.875 174.875 175.562 -0.687 17890 14393 1 19 . 1 1 10 10 HIS CA C 10 55.746 55.746 58.549 -2.803 17890 14394 1 19 . 1 1 10 10 HIS CB C 10 29.889 29.889 28.942 0.947 17890 14395 1 19 . 1 1 10 10 HIS H H 10 8.583 8.583 8.076 0.507 17890 14396 1 19 . 1 1 11 11 SER N N 11 118.009 118.009 113.670 4.339 17890 14397 1 19 . 1 1 11 11 SER HA H 11 4.424 4.424 4.681 -0.257 17890 14398 1 19 . 1 1 11 11 SER C C 11 174.962 174.962 174.039 0.923 17890 14399 1 19 . 1 1 11 11 SER CA C 11 58.660 58.660 58.578 0.082 17890 14400 1 19 . 1 1 11 11 SER CB C 11 63.822 63.822 64.713 -0.891 17890 14401 1 19 . 1 1 11 11 SER H H 11 8.438 8.438 8.094 0.344 17890 14402 1 19 . 1 1 12 12 GLY N N 12 111.011 111.011 110.677 0.334 17890 14403 1 19 . 1 1 12 12 GLY C C 12 173.907 173.907 173.398 0.509 17890 14404 1 19 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.743 -0.322 17890 14405 1 19 . 1 1 12 12 GLY H H 12 8.433 8.433 8.013 0.420 17890 14406 1 19 . 1 1 13 13 ASP N N 13 120.291 120.291 119.183 1.108 17890 14407 1 19 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.940 -0.278 17890 14408 1 19 . 1 1 13 13 ASP C C 13 176.115 176.115 173.952 2.163 17890 14409 1 19 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.105 1.198 17890 14410 1 19 . 1 1 13 13 ASP CB C 13 41.465 41.465 43.497 -2.032 17890 14411 1 19 . 1 1 13 13 ASP H H 13 8.153 8.153 7.648 0.505 17890 14412 1 19 . 1 1 14 14 SER N N 14 116.987 116.987 116.911 0.076 17890 14413 1 19 . 1 1 14 14 SER HA H 14 4.754 4.754 4.895 -0.141 17890 14414 1 19 . 1 1 14 14 SER CA C 14 56.469 56.469 56.446 0.023 17890 14415 1 19 . 1 1 14 14 SER CB C 14 63.553 63.553 64.700 -1.147 17890 14416 1 19 . 1 1 14 14 SER H H 14 8.210 8.210 8.114 0.096 17890 14417 1 19 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.398 0.044 17890 14418 1 19 . 1 1 15 15 PRO C C 15 176.424 176.424 175.967 0.457 17890 14419 1 19 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.090 0.143 17890 14420 1 19 . 1 1 15 15 PRO CB C 15 32.148 32.148 31.933 0.215 17890 14421 1 19 . 1 1 16 16 ALA N N 16 124.219 124.219 123.694 0.525 17890 14422 1 19 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.504 -0.154 17890 14423 1 19 . 1 1 16 16 ALA C C 16 177.552 177.552 177.048 0.504 17890 14424 1 19 . 1 1 16 16 ALA CA C 16 52.433 52.433 51.800 0.633 17890 14425 1 19 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.301 0.018 17890 14426 1 19 . 1 1 16 16 ALA H H 16 8.284 8.284 8.330 -0.046 17890 14427 1 19 . 1 1 17 17 VAL N N 17 119.504 119.504 119.002 0.502 17890 14428 1 19 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.120 0.129 17890 14429 1 19 . 1 1 17 17 VAL C C 17 176.322 176.322 175.705 0.617 17890 14430 1 19 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.724 -0.446 17890 14431 1 19 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.816 0.141 17890 14432 1 19 . 1 1 17 17 VAL H H 17 8.046 8.046 7.425 0.621 17890 14433 1 19 . 1 1 18 18 THR N N 18 118.186 118.186 118.132 0.054 17890 14434 1 19 . 1 1 18 18 THR HA H 18 4.473 4.473 4.548 -0.075 17890 14435 1 19 . 1 1 18 18 THR C C 18 174.248 174.248 174.375 -0.127 17890 14436 1 19 . 1 1 18 18 THR CA C 18 61.565 61.565 61.556 0.009 17890 14437 1 19 . 1 1 18 18 THR CB C 18 70.165 70.165 69.228 0.937 17890 14438 1 19 . 1 1 18 18 THR H H 18 8.276 8.276 8.455 -0.179 17890 14439 1 19 . 1 1 19 19 LEU N N 19 125.265 125.265 119.714 5.551 17890 14440 1 19 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.982 0.311 17890 14441 1 19 . 1 1 19 19 LEU C C 19 175.689 175.689 175.472 0.217 17890 14442 1 19 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.579 -0.152 17890 14443 1 19 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.198 2.081 17890 14444 1 19 . 1 1 19 19 LEU H H 19 8.091 8.091 8.277 -0.186 17890 14445 1 19 . 1 1 20 20 SER N N 20 114.622 114.622 113.908 0.714 17890 14446 1 19 . 1 1 20 20 SER HA H 20 4.947 4.947 4.884 0.063 17890 14447 1 19 . 1 1 20 20 SER C C 20 174.220 174.220 172.752 1.468 17890 14448 1 19 . 1 1 20 20 SER CA C 20 56.583 56.583 57.355 -0.772 17890 14449 1 19 . 1 1 20 20 SER CB C 20 65.653 65.653 64.771 0.882 17890 14450 1 19 . 1 1 20 20 SER H H 20 7.316 7.316 7.987 -0.671 17890 14451 1 19 . 1 1 21 21 ALA N N 21 125.517 125.517 123.635 1.882 17890 14452 1 19 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.939 -0.271 17890 14453 1 19 . 1 1 21 21 ALA C C 21 177.960 177.960 177.208 0.752 17890 14454 1 19 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.511 1.499 17890 14455 1 19 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.453 -0.228 17890 14456 1 19 . 1 1 21 21 ALA H H 21 8.993 8.993 8.471 0.522 17890 14457 1 19 . 1 1 22 22 GLY N N 22 109.543 109.543 112.448 -2.905 17890 14458 1 19 . 1 1 22 22 GLY C C 22 170.422 170.422 172.035 -1.613 17890 14459 1 19 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.066 0.315 17890 14460 1 19 . 1 1 22 22 GLY H H 22 8.411 8.411 8.963 -0.552 17890 14461 1 19 . 1 1 23 23 ASN N N 23 119.649 119.649 119.877 -0.228 17890 14462 1 19 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.727 0.160 17890 14463 1 19 . 1 1 23 23 ASN C C 23 175.207 175.207 174.632 0.575 17890 14464 1 19 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.744 -0.923 17890 14465 1 19 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.886 -1.131 17890 14466 1 19 . 1 1 23 23 ASN H H 23 8.092 8.092 8.385 -0.293 17890 14467 1 19 . 1 1 24 24 TYR N N 24 120.889 120.889 121.668 -0.779 17890 14468 1 19 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.154 0.101 17890 14469 1 19 . 1 1 24 24 TYR C C 24 175.667 175.667 174.418 1.249 17890 14470 1 19 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.276 0.837 17890 14471 1 19 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.693 0.133 17890 14472 1 19 . 1 1 24 24 TYR H H 24 9.914 9.914 9.060 0.854 17890 14473 1 19 . 1 1 25 25 ILE N N 25 115.978 115.978 113.355 2.623 17890 14474 1 19 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.053 0.033 17890 14475 1 19 . 1 1 25 25 ILE C C 25 175.200 175.200 174.236 0.964 17890 14476 1 19 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.500 1.045 17890 14477 1 19 . 1 1 25 25 ILE CB C 25 41.122 41.122 42.054 -0.932 17890 14478 1 19 . 1 1 25 25 ILE H H 25 9.216 9.216 9.303 -0.087 17890 14479 1 19 . 1 1 26 26 ILE N N 26 123.957 123.957 121.951 2.006 17890 14480 1 19 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.286 -0.310 17890 14481 1 19 . 1 1 26 26 ILE C C 26 174.810 174.810 174.974 -0.164 17890 14482 1 19 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.154 0.455 17890 14483 1 19 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.515 0.607 17890 14484 1 19 . 1 1 26 26 ILE H H 26 9.559 9.559 9.047 0.512 17890 14485 1 19 . 1 1 27 27 TYR N N 27 121.371 121.371 123.713 -2.342 17890 14486 1 19 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.568 0.622 17890 14487 1 19 . 1 1 27 27 TYR C C 27 173.963 173.963 173.269 0.694 17890 14488 1 19 . 1 1 27 27 TYR CA C 27 54.669 54.669 55.106 -0.437 17890 14489 1 19 . 1 1 27 27 TYR CB C 27 41.698 41.698 40.931 0.767 17890 14490 1 19 . 1 1 27 27 TYR H H 27 9.378 9.378 9.112 0.266 17890 14491 1 19 . 1 1 28 28 ASN N N 28 121.991 121.991 119.461 2.530 17890 14492 1 19 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.271 -0.503 17890 14493 1 19 . 1 1 28 28 ASN C C 28 174.352 174.352 176.491 -2.139 17890 14494 1 19 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.352 2.768 17890 14495 1 19 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.963 1.483 17890 14496 1 19 . 1 1 28 28 ASN H H 28 8.466 8.466 8.469 -0.003 17890 14497 1 19 . 1 1 29 29 ARG N N 29 121.103 121.103 126.056 -4.953 17890 14498 1 19 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.101 -0.240 17890 14499 1 19 . 1 1 29 29 ARG C C 29 173.635 173.635 177.555 -3.920 17890 14500 1 19 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.612 1.681 17890 14501 1 19 . 1 1 29 29 ARG CB C 29 30.399 30.399 29.639 0.760 17890 14502 1 19 . 1 1 29 29 ARG H H 29 7.756 7.756 8.303 -0.547 17890 14503 1 19 . 1 1 30 30 VAL N N 30 118.412 118.412 117.582 0.830 17890 14504 1 19 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.809 0.135 17890 14505 1 19 . 1 1 30 30 VAL C C 30 176.199 176.199 175.995 0.204 17890 14506 1 19 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.806 -1.229 17890 14507 1 19 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.343 -2.121 17890 14508 1 19 . 1 1 30 30 VAL H H 30 8.976 8.976 7.813 1.163 17890 14509 1 19 . 1 1 31 31 LEU N N 31 125.418 125.418 116.228 9.190 17890 14510 1 19 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.049 0.436 17890 14511 1 19 . 1 1 31 31 LEU C C 31 179.123 179.123 175.950 3.173 17890 14512 1 19 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.802 -1.777 17890 14513 1 19 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.841 3.740 17890 14514 1 19 . 1 1 31 31 LEU H H 31 8.856 8.856 7.537 1.319 17890 14515 1 19 . 1 1 32 32 SER N N 32 116.890 116.890 115.983 0.907 17890 14516 1 19 . 1 1 32 32 SER HA H 32 5.365 5.365 4.780 0.585 17890 14517 1 19 . 1 1 32 32 SER CA C 32 57.269 57.269 55.952 1.317 17890 14518 1 19 . 1 1 32 32 SER CB C 32 62.213 62.213 64.322 -2.109 17890 14519 1 19 . 1 1 32 32 SER H H 32 9.307 9.307 8.389 0.918 17890 14520 1 19 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.355 -0.475 17890 14521 1 19 . 1 1 33 33 PRO C C 33 175.137 175.137 177.625 -2.488 17890 14522 1 19 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.533 0.752 17890 14523 1 19 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.686 0.345 17890 14524 1 19 . 1 1 34 34 ARG N N 34 110.279 110.279 118.682 -8.403 17890 14525 1 19 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.249 0.243 17890 14526 1 19 . 1 1 34 34 ARG C C 34 176.844 176.844 177.167 -0.323 17890 14527 1 19 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.864 -1.427 17890 14528 1 19 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.442 0.142 17890 14529 1 19 . 1 1 34 34 ARG H H 34 7.257 7.257 7.797 -0.540 17890 14530 1 19 . 1 1 35 35 GLY N N 35 110.288 110.288 105.792 4.496 17890 14531 1 19 . 1 1 35 35 GLY C C 35 173.336 173.336 173.768 -0.432 17890 14532 1 19 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.842 2.188 17890 14533 1 19 . 1 1 35 35 GLY H H 35 8.589 8.589 7.904 0.685 17890 14534 1 19 . 1 1 36 36 GLU N N 36 116.838 116.838 119.129 -2.291 17890 14535 1 19 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.662 -0.314 17890 14536 1 19 . 1 1 36 36 GLU C C 36 176.915 176.915 174.959 1.956 17890 14537 1 19 . 1 1 36 36 GLU CA C 36 54.907 54.907 53.750 1.157 17890 14538 1 19 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.459 -2.043 17890 14539 1 19 . 1 1 36 36 GLU H H 36 7.769 7.769 7.668 0.101 17890 14540 1 19 . 1 1 37 37 LYS N N 37 123.775 123.775 122.675 1.100 17890 14541 1 19 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.138 0.285 17890 14542 1 19 . 1 1 37 37 LYS C C 37 176.067 176.067 175.527 0.540 17890 14543 1 19 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.787 -0.886 17890 14544 1 19 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.556 1.117 17890 14545 1 19 . 1 1 37 37 LYS H H 37 8.667 8.667 8.740 -0.073 17890 14546 1 19 . 1 1 38 38 LEU N N 38 126.658 126.658 127.207 -0.549 17890 14547 1 19 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.738 -0.511 17890 14548 1 19 . 1 1 38 38 LEU C C 38 174.332 174.332 175.182 -0.850 17890 14549 1 19 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.533 -0.190 17890 14550 1 19 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.324 -0.673 17890 14551 1 19 . 1 1 38 38 LEU H H 38 10.455 10.455 8.991 1.464 17890 14552 1 19 . 1 1 39 39 ALA N N 39 127.018 127.018 127.891 -0.873 17890 14553 1 19 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.141 0.088 17890 14554 1 19 . 1 1 39 39 ALA C C 39 178.694 178.694 176.322 2.372 17890 14555 1 19 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.630 -0.405 17890 14556 1 19 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.490 0.859 17890 14557 1 19 . 1 1 39 39 ALA H H 39 8.773 8.773 8.803 -0.030 17890 14558 1 19 . 1 1 40 40 LEU N N 40 126.771 126.771 124.987 1.784 17890 14559 1 19 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.436 -0.082 17890 14560 1 19 . 1 1 40 40 LEU C C 40 178.309 178.309 176.252 2.057 17890 14561 1 19 . 1 1 40 40 LEU CA C 40 56.845 56.845 55.377 1.468 17890 14562 1 19 . 1 1 40 40 LEU CB C 40 43.323 43.323 41.609 1.714 17890 14563 1 19 . 1 1 40 40 LEU H H 40 9.665 9.665 8.929 0.736 17890 14564 1 19 . 1 1 41 41 THR N N 41 126.578 126.578 125.562 1.016 17890 14565 1 19 . 1 1 41 41 THR HA H 41 4.916 4.916 5.207 -0.291 17890 14566 1 19 . 1 1 41 41 THR C C 41 172.547 172.547 173.443 -0.896 17890 14567 1 19 . 1 1 41 41 THR CA C 41 63.253 63.253 61.410 1.843 17890 14568 1 19 . 1 1 41 41 THR CB C 41 71.832 71.832 70.882 0.950 17890 14569 1 19 . 1 1 41 41 THR H H 41 9.802 9.802 9.140 0.662 17890 14570 1 19 . 1 1 42 42 TYR N N 42 130.506 130.506 129.896 0.610 17890 14571 1 19 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.588 0.514 17890 14572 1 19 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.405 -3.419 17890 14573 1 19 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.448 -0.293 17890 14574 1 19 . 1 1 42 42 TYR H H 42 9.428 9.428 8.932 0.496 17890 14575 1 19 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.389 0.101 17890 14576 1 19 . 1 1 43 43 PRO CA C 43 63.573 63.573 62.955 0.619 17890 14577 1 19 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.749 -0.105 17890 14578 1 19 . 1 1 44 44 GLY N N 44 113.736 113.736 106.354 7.382 17890 14579 1 19 . 1 1 44 44 GLY C C 44 171.790 171.790 173.203 -1.413 17890 14580 1 19 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.882 0.834 17890 14581 1 19 . 1 1 44 44 GLY H H 44 8.337 8.337 7.308 1.029 17890 14582 1 19 . 1 1 45 45 ARG N N 45 113.899 113.899 116.447 -2.548 17890 14583 1 19 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.521 0.056 17890 14584 1 19 . 1 1 45 45 ARG C C 45 175.151 175.151 173.757 1.394 17890 14585 1 19 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.017 0.148 17890 14586 1 19 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.857 1.362 17890 14587 1 19 . 1 1 45 45 ARG H H 45 6.463 6.463 7.267 -0.804 17890 14588 1 19 . 1 1 46 46 GLN N N 46 119.000 119.000 118.685 0.315 17890 14589 1 19 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.515 -0.066 17890 14590 1 19 . 1 1 46 46 GLN C C 46 177.282 177.282 176.593 0.689 17890 14591 1 19 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.035 1.578 17890 14592 1 19 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.398 1.098 17890 14593 1 19 . 1 1 46 46 GLN H H 46 8.683 8.683 8.472 0.211 17890 14594 1 19 . 1 1 47 47 ARG N N 47 113.526 113.526 119.817 -6.291 17890 14595 1 19 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.084 -0.554 17890 14596 1 19 . 1 1 47 47 ARG C C 47 174.130 174.130 174.868 -0.738 17890 14597 1 19 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.245 1.571 17890 14598 1 19 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.605 0.465 17890 14599 1 19 . 1 1 47 47 ARG H H 47 9.677 9.677 8.531 1.146 17890 14600 1 19 . 1 1 48 48 THR N N 48 114.672 114.672 115.175 -0.503 17890 14601 1 19 . 1 1 48 48 THR HA H 48 4.938 4.938 4.695 0.243 17890 14602 1 19 . 1 1 48 48 THR CA C 48 59.987 59.987 60.329 -0.342 17890 14603 1 19 . 1 1 48 48 THR CB C 48 71.947 71.947 71.211 0.736 17890 14604 1 19 . 1 1 48 48 THR H H 48 8.104 8.104 7.625 0.479 17890 14605 1 19 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.521 -0.153 17890 14606 1 19 . 1 1 49 49 PRO C C 49 175.651 175.651 176.240 -0.589 17890 14607 1 19 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.306 0.875 17890 14608 1 19 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.347 0.350 17890 14609 1 19 . 1 1 50 50 VAL N N 50 122.562 122.562 119.821 2.741 17890 14610 1 19 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.189 -0.242 17890 14611 1 19 . 1 1 50 50 VAL C C 50 174.493 174.493 175.279 -0.786 17890 14612 1 19 . 1 1 50 50 VAL CA C 50 63.811 63.811 60.843 2.969 17890 14613 1 19 . 1 1 50 50 VAL CB C 50 32.168 32.168 35.028 -2.860 17890 14614 1 19 . 1 1 50 50 VAL H H 50 8.123 8.123 8.053 0.070 17890 14615 1 19 . 1 1 51 51 THR N N 51 113.549 113.549 119.287 -5.738 17890 14616 1 19 . 1 1 51 51 THR HA H 51 5.372 5.372 5.068 0.304 17890 14617 1 19 . 1 1 51 51 THR C C 51 174.841 174.841 172.826 2.015 17890 14618 1 19 . 1 1 51 51 THR CA C 51 59.196 59.196 60.713 -1.517 17890 14619 1 19 . 1 1 51 51 THR CB C 51 72.703 72.703 71.799 0.905 17890 14620 1 19 . 1 1 51 51 THR H H 51 7.057 7.057 8.090 -1.033 17890 14621 1 19 . 1 1 52 52 VAL N N 52 107.374 107.374 117.325 -9.951 17890 14622 1 19 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.354 0.160 17890 14623 1 19 . 1 1 52 52 VAL C C 52 175.697 175.697 173.766 1.931 17890 14624 1 19 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.748 -1.276 17890 14625 1 19 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.130 -0.356 17890 14626 1 19 . 1 1 52 52 VAL H H 52 8.062 8.062 8.648 -0.586 17890 14627 1 19 . 1 1 53 53 SER N N 53 114.662 114.662 118.732 -4.070 17890 14628 1 19 . 1 1 53 53 SER HA H 53 4.690 4.690 4.960 -0.270 17890 14629 1 19 . 1 1 53 53 SER CA C 53 56.828 56.828 55.672 1.156 17890 14630 1 19 . 1 1 53 53 SER CB C 53 64.789 64.789 65.831 -1.042 17890 14631 1 19 . 1 1 53 53 SER H H 53 8.681 8.681 8.991 -0.310 17890 14632 1 19 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.510 0.266 17890 14633 1 19 . 1 1 54 54 PRO C C 54 177.724 177.724 176.323 1.401 17890 14634 1 19 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.318 0.107 17890 14635 1 19 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.071 0.026 17890 14636 1 19 . 1 1 55 55 LEU N N 55 128.655 128.655 125.350 3.305 17890 14637 1 19 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.196 0.331 17890 14638 1 19 . 1 1 55 55 LEU C C 55 178.696 178.696 176.059 2.637 17890 14639 1 19 . 1 1 55 55 LEU CA C 55 56.246 56.246 56.106 0.140 17890 14640 1 19 . 1 1 55 55 LEU CB C 55 43.606 43.606 42.177 1.429 17890 14641 1 19 . 1 1 55 55 LEU H H 55 8.675 8.675 8.461 0.214 17890 14642 1 19 . 1 1 56 56 ASP N N 56 126.651 126.651 125.953 0.698 17890 14643 1 19 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.787 -0.078 17890 14644 1 19 . 1 1 56 56 ASP C C 56 177.729 177.729 176.828 0.901 17890 14645 1 19 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.191 -0.568 17890 14646 1 19 . 1 1 56 56 ASP CB C 56 41.632 41.632 44.156 -2.524 17890 14647 1 19 . 1 1 56 56 ASP H H 56 9.683 9.683 9.333 0.350 17890 14648 1 19 . 1 1 57 57 GLY N N 57 109.299 109.299 108.681 0.618 17890 14649 1 19 . 1 1 57 57 GLY C C 57 174.558 174.558 174.275 0.283 17890 14650 1 19 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.828 1.127 17890 14651 1 19 . 1 1 57 57 GLY H H 57 8.157 8.157 8.547 -0.390 17890 14652 1 19 . 1 1 58 58 SER N N 58 116.740 116.740 115.357 1.383 17890 14653 1 19 . 1 1 58 58 SER HA H 58 4.288 4.288 4.492 -0.204 17890 14654 1 19 . 1 1 58 58 SER C C 58 177.252 177.252 176.003 1.249 17890 14655 1 19 . 1 1 58 58 SER CA C 58 58.737 58.737 57.223 1.514 17890 14656 1 19 . 1 1 58 58 SER CB C 58 64.576 64.576 64.154 0.421 17890 14657 1 19 . 1 1 58 58 SER H H 58 8.328 8.328 7.995 0.333 17890 14658 1 19 . 1 1 59 59 SER N N 59 119.768 119.768 118.954 0.814 17890 14659 1 19 . 1 1 59 59 SER HA H 59 4.046 4.046 4.196 -0.150 17890 14660 1 19 . 1 1 59 59 SER C C 59 176.671 176.671 175.065 1.606 17890 14661 1 19 . 1 1 59 59 SER CA C 59 61.691 61.691 60.147 1.544 17890 14662 1 19 . 1 1 59 59 SER CB C 59 63.154 63.154 63.023 0.131 17890 14663 1 19 . 1 1 59 59 SER H H 59 9.020 9.020 8.803 0.217 17890 14664 1 19 . 1 1 60 60 GLU N N 60 119.133 119.133 120.077 -0.944 17890 14665 1 19 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.084 0.102 17890 14666 1 19 . 1 1 60 60 GLU C C 60 177.435 177.435 177.487 -0.052 17890 14667 1 19 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.220 1.813 17890 14668 1 19 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.320 -1.094 17890 14669 1 19 . 1 1 60 60 GLU H H 60 8.832 8.832 7.634 1.198 17890 14670 1 19 . 1 1 61 61 GLN N N 61 118.818 118.818 117.883 0.935 17890 14671 1 19 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.814 0.363 17890 14672 1 19 . 1 1 61 61 GLN C C 61 173.254 173.254 175.021 -1.767 17890 14673 1 19 . 1 1 61 61 GLN CA C 61 54.373 54.373 55.700 -1.327 17890 14674 1 19 . 1 1 61 61 GLN CB C 61 27.922 27.922 29.980 -2.058 17890 14675 1 19 . 1 1 61 61 GLN H H 61 7.648 7.648 7.505 0.143 17890 14676 1 19 . 1 1 62 62 ALA N N 62 122.562 122.562 122.051 0.511 17890 14677 1 19 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.559 0.505 17890 14678 1 19 . 1 1 62 62 ALA C C 62 176.637 176.637 175.225 1.412 17890 14679 1 19 . 1 1 62 62 ALA CA C 62 51.179 51.179 50.881 0.298 17890 14680 1 19 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.489 -0.894 17890 14681 1 19 . 1 1 62 62 ALA H H 62 7.315 7.315 6.767 0.548 17890 14682 1 19 . 1 1 63 63 TRP N N 63 124.787 124.787 120.238 4.549 17890 14683 1 19 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.329 -0.365 17890 14684 1 19 . 1 1 63 63 TRP C C 63 174.351 174.351 175.285 -0.934 17890 14685 1 19 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.053 -0.151 17890 14686 1 19 . 1 1 63 63 TRP CB C 63 32.117 32.117 34.031 -1.914 17890 14687 1 19 . 1 1 63 63 TRP H H 63 9.544 9.544 9.066 0.478 17890 14688 1 19 . 1 1 64 64 ILE N N 64 122.482 122.482 119.391 3.091 17890 14689 1 19 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.974 -0.280 17890 14690 1 19 . 1 1 64 64 ILE C C 64 177.078 177.078 174.223 2.855 17890 14691 1 19 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.558 0.473 17890 14692 1 19 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.167 -0.798 17890 14693 1 19 . 1 1 64 64 ILE H H 64 10.235 10.235 9.403 0.832 17890 14694 1 19 . 1 1 65 65 LEU N N 65 132.183 132.183 128.756 3.427 17890 14695 1 19 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.523 -0.058 17890 14696 1 19 . 1 1 65 65 LEU C C 65 177.048 177.048 174.494 2.554 17890 14697 1 19 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.690 0.659 17890 14698 1 19 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.136 -3.792 17890 14699 1 19 . 1 1 65 65 LEU H H 65 9.432 9.432 9.334 0.098 17890 14700 1 19 . 1 1 66 66 ARG N N 66 120.807 120.807 125.768 -4.961 17890 14701 1 19 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.926 -0.038 17890 14702 1 19 . 1 1 66 66 ARG C C 66 175.275 175.275 174.439 0.836 17890 14703 1 19 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.505 0.549 17890 14704 1 19 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.431 -1.440 17890 14705 1 19 . 1 1 66 66 ARG H H 66 8.491 8.491 8.587 -0.096 17890 14706 1 19 . 1 1 67 67 SER N N 67 119.709 119.709 116.699 3.010 17890 14707 1 19 . 1 1 67 67 SER HA H 67 3.186 3.186 3.430 -0.244 17890 14708 1 19 . 1 1 67 67 SER C C 67 174.508 174.508 173.438 1.070 17890 14709 1 19 . 1 1 67 67 SER CA C 67 58.521 58.521 59.072 -0.551 17890 14710 1 19 . 1 1 67 67 SER CB C 67 62.590 62.590 63.433 -0.843 17890 14711 1 19 . 1 1 67 67 SER H H 67 8.557 8.557 8.711 -0.154 17890 14712 1 19 . 1 1 68 68 TYR N N 68 131.011 131.011 127.495 3.516 17890 14713 1 19 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.540 -0.092 17890 14714 1 19 . 1 1 68 68 TYR C C 68 174.687 174.687 174.964 -0.277 17890 14715 1 19 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.487 0.278 17890 14716 1 19 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.140 -2.152 17890 14717 1 19 . 1 1 68 68 TYR H H 68 8.531 8.531 8.493 0.038 17890 14718 1 19 . 1 1 69 69 ASP N N 69 117.066 117.066 119.959 -2.893 17890 14719 1 19 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.846 -0.221 17890 14720 1 19 . 1 1 69 69 ASP C C 69 176.455 176.455 176.303 0.152 17890 14721 1 19 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.949 -0.858 17890 14722 1 19 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.944 -0.797 17890 14723 1 19 . 1 1 69 69 ASP H H 69 7.122 7.122 7.617 -0.495 17890 14724 1 19 . 1 1 70 70 SER N N 70 122.869 122.869 120.197 2.672 17890 14725 1 19 . 1 1 70 70 SER HA H 70 4.270 4.270 4.073 0.197 17890 14726 1 19 . 1 1 70 70 SER C C 70 177.010 177.010 176.075 0.935 17890 14727 1 19 . 1 1 70 70 SER CA C 70 60.837 60.837 61.331 -0.494 17890 14728 1 19 . 1 1 70 70 SER CB C 70 62.722 62.722 63.247 -0.525 17890 14729 1 19 . 1 1 70 70 SER H H 70 8.757 8.757 8.799 -0.042 17890 14730 1 19 . 1 1 71 71 ASN N N 71 119.873 119.873 118.984 0.889 17890 14731 1 19 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.589 -0.018 17890 14732 1 19 . 1 1 71 71 ASN C C 71 176.226 176.226 176.009 0.217 17890 14733 1 19 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.327 0.387 17890 14734 1 19 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.413 0.229 17890 14735 1 19 . 1 1 71 71 ASN H H 71 8.342 8.342 8.521 -0.179 17890 14736 1 19 . 1 1 72 72 SER N N 72 112.202 112.202 112.427 -0.225 17890 14737 1 19 . 1 1 72 72 SER HA H 72 4.567 4.567 4.618 -0.051 17890 14738 1 19 . 1 1 72 72 SER C C 72 173.789 173.789 173.887 -0.098 17890 14739 1 19 . 1 1 72 72 SER CA C 72 57.816 57.816 57.733 0.083 17890 14740 1 19 . 1 1 72 72 SER CB C 72 63.935 63.935 63.919 0.016 17890 14741 1 19 . 1 1 72 72 SER H H 72 7.560 7.560 7.804 -0.244 17890 14742 1 19 . 1 1 73 73 ASN N N 73 117.437 117.437 118.449 -1.012 17890 14743 1 19 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.402 0.132 17890 14744 1 19 . 1 1 73 73 ASN C C 73 173.647 173.647 174.079 -0.432 17890 14745 1 19 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.496 0.027 17890 14746 1 19 . 1 1 73 73 ASN CB C 73 37.213 37.213 36.814 0.399 17890 14747 1 19 . 1 1 73 73 ASN H H 73 7.940 7.940 8.140 -0.200 17890 14748 1 19 . 1 1 74 74 THR N N 74 104.227 104.227 109.517 -5.290 17890 14749 1 19 . 1 1 74 74 THR HA H 74 5.477 5.477 4.937 0.540 17890 14750 1 19 . 1 1 74 74 THR C C 74 176.824 176.824 173.869 2.955 17890 14751 1 19 . 1 1 74 74 THR CA C 74 59.768 59.768 61.611 -1.843 17890 14752 1 19 . 1 1 74 74 THR CB C 74 71.985 71.985 70.000 1.985 17890 14753 1 19 . 1 1 74 74 THR H H 74 7.737 7.737 7.699 0.038 17890 14754 1 19 . 1 1 75 75 TRP N N 75 124.636 124.636 123.370 1.266 17890 14755 1 19 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.389 -0.182 17890 14756 1 19 . 1 1 75 75 TRP C C 75 175.876 175.876 176.167 -0.291 17890 14757 1 19 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.187 1.419 17890 14758 1 19 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.674 -0.158 17890 14759 1 19 . 1 1 75 75 TRP H H 75 9.442 9.442 9.064 0.378 17890 14760 1 19 . 1 1 76 76 THR N N 76 110.544 110.544 114.853 -4.309 17890 14761 1 19 . 1 1 76 76 THR HA H 76 5.129 5.129 4.980 0.149 17890 14762 1 19 . 1 1 76 76 THR C C 76 174.506 174.506 174.500 0.006 17890 14763 1 19 . 1 1 76 76 THR CA C 76 60.561 60.561 61.468 -0.907 17890 14764 1 19 . 1 1 76 76 THR CB C 76 71.688 71.688 69.978 1.710 17890 14765 1 19 . 1 1 76 76 THR H H 76 9.415 9.415 9.343 0.072 17890 14766 1 19 . 1 1 77 77 ILE N N 77 121.567 121.567 124.094 -2.527 17890 14767 1 19 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.223 -0.084 17890 14768 1 19 . 1 1 77 77 ILE C C 77 176.148 176.148 175.110 1.038 17890 14769 1 19 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.691 2.017 17890 14770 1 19 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.911 1.076 17890 14771 1 19 . 1 1 77 77 ILE H H 77 9.255 9.255 8.445 0.810 17890 14772 1 19 . 1 1 78 78 SER N N 78 122.269 122.269 121.563 0.706 17890 14773 1 19 . 1 1 78 78 SER HA H 78 5.601 5.601 5.391 0.210 17890 14774 1 19 . 1 1 78 78 SER CA C 78 55.835 55.835 55.974 -0.139 17890 14775 1 19 . 1 1 78 78 SER CB C 78 65.858 65.858 66.618 -0.760 17890 14776 1 19 . 1 1 78 78 SER H H 78 9.226 9.226 8.801 0.425 17890 14777 1 19 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.008 -0.144 17890 14778 1 19 . 1 1 79 79 PRO C C 79 178.175 178.175 177.539 0.636 17890 14779 1 19 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.186 0.698 17890 14780 1 19 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.642 -1.370 17890 14781 1 19 . 1 1 80 80 VAL N N 80 121.906 121.906 122.097 -0.191 17890 14782 1 19 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.736 -0.155 17890 14783 1 19 . 1 1 80 80 VAL C C 80 177.751 177.751 176.920 0.831 17890 14784 1 19 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.612 1.454 17890 14785 1 19 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.372 0.113 17890 14786 1 19 . 1 1 80 80 VAL H H 80 7.328 7.328 7.960 -0.632 17890 14787 1 19 . 1 1 81 81 GLY N N 81 104.643 104.643 106.023 -1.380 17890 14788 1 19 . 1 1 81 81 GLY C C 81 174.979 174.979 174.575 0.404 17890 14789 1 19 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.092 -0.004 17890 14790 1 19 . 1 1 81 81 GLY H H 81 8.949 8.949 7.768 1.181 17890 14791 1 19 . 1 1 82 82 SER N N 82 111.865 111.865 115.087 -3.222 17890 14792 1 19 . 1 1 82 82 SER HA H 82 4.646 4.646 4.894 -0.248 17890 14793 1 19 . 1 1 82 82 SER CA C 82 55.441 55.441 56.492 -1.051 17890 14794 1 19 . 1 1 82 82 SER CB C 82 62.277 62.277 63.722 -1.445 17890 14795 1 19 . 1 1 82 82 SER H H 82 6.968 6.968 7.249 -0.281 17890 14796 1 19 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.619 -0.272 17890 14797 1 19 . 1 1 83 83 PRO C C 83 176.660 176.660 176.386 0.274 17890 14798 1 19 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.334 0.869 17890 14799 1 19 . 1 1 83 83 PRO CB C 83 32.819 32.819 32.044 0.775 17890 14800 1 19 . 1 1 84 84 ASN N N 84 116.542 116.542 113.426 3.116 17890 14801 1 19 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.606 0.395 17890 14802 1 19 . 1 1 84 84 ASN C C 84 175.825 175.825 175.169 0.656 17890 14803 1 19 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.801 -0.910 17890 14804 1 19 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.081 0.663 17890 14805 1 19 . 1 1 84 84 ASN H H 84 8.502 8.502 8.211 0.291 17890 14806 1 19 . 1 1 85 85 SER N N 85 114.633 114.633 113.616 1.017 17890 14807 1 19 . 1 1 85 85 SER HA H 85 4.624 4.624 4.863 -0.239 17890 14808 1 19 . 1 1 85 85 SER C C 85 172.963 172.963 172.357 0.606 17890 14809 1 19 . 1 1 85 85 SER CA C 85 59.210 59.210 57.797 1.413 17890 14810 1 19 . 1 1 85 85 SER CB C 85 64.697 64.697 66.348 -1.651 17890 14811 1 19 . 1 1 85 85 SER H H 85 7.980 7.980 7.792 0.188 17890 14812 1 19 . 1 1 86 86 GLN N N 86 119.016 119.016 118.406 0.610 17890 14813 1 19 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.645 -0.199 17890 14814 1 19 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.334 0.118 17890 14815 1 19 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.252 0.146 17890 14816 1 19 . 1 1 86 86 GLN H H 86 9.399 9.399 9.189 0.210 17890 14817 1 19 . 1 1 87 87 ILE N N 87 119.691 119.691 119.001 0.690 17890 14818 1 19 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.203 -0.628 17890 14819 1 19 . 1 1 87 87 ILE C C 87 176.505 176.505 176.101 0.404 17890 14820 1 19 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.960 4.534 17890 14821 1 19 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.297 -1.099 17890 14822 1 19 . 1 1 87 87 ILE H H 87 8.970 8.970 8.266 0.704 17890 14823 1 19 . 1 1 88 88 GLY N N 88 118.378 118.378 114.546 3.832 17890 14824 1 19 . 1 1 88 88 GLY C C 88 171.397 171.397 171.640 -0.243 17890 14825 1 19 . 1 1 88 88 GLY CA C 88 43.604 43.604 45.021 -1.417 17890 14826 1 19 . 1 1 88 88 GLY H H 88 9.752 9.752 9.054 0.698 17890 14827 1 19 . 1 1 89 89 TRP N N 89 122.749 122.749 122.148 0.601 17890 14828 1 19 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.354 -0.756 17890 14829 1 19 . 1 1 89 89 TRP C C 89 175.924 175.924 175.117 0.807 17890 14830 1 19 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.551 -0.268 17890 14831 1 19 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.681 -2.595 17890 14832 1 19 . 1 1 89 89 TRP H H 89 8.215 8.215 8.388 -0.173 17890 14833 1 19 . 1 1 90 90 GLY N N 90 116.305 116.305 110.941 5.364 17890 14834 1 19 . 1 1 90 90 GLY C C 90 173.725 173.725 172.958 0.767 17890 14835 1 19 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.608 0.447 17890 14836 1 19 . 1 1 90 90 GLY H H 90 8.922 8.922 8.136 0.786 17890 14837 1 19 . 1 1 91 91 ALA N N 91 123.795 123.795 122.009 1.786 17890 14838 1 19 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.173 0.070 17890 14839 1 19 . 1 1 91 91 ALA C C 91 178.510 178.510 178.943 -0.433 17890 14840 1 19 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.450 0.040 17890 14841 1 19 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.805 -0.396 17890 14842 1 19 . 1 1 91 91 ALA H H 91 8.367 8.367 8.163 0.204 17890 14843 1 19 . 1 1 92 92 GLY N N 92 108.871 108.871 112.417 -3.546 17890 14844 1 19 . 1 1 92 92 GLY C C 92 174.528 174.528 174.541 -0.013 17890 14845 1 19 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.819 0.439 17890 14846 1 19 . 1 1 92 92 GLY H H 92 8.776 8.776 8.638 0.138 17890 14847 1 19 . 1 1 93 93 ASN N N 93 114.921 114.921 116.496 -1.575 17890 14848 1 19 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.747 -0.298 17890 14849 1 19 . 1 1 93 93 ASN C C 93 172.774 172.774 173.822 -1.048 17890 14850 1 19 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.154 0.819 17890 14851 1 19 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.242 -0.913 17890 14852 1 19 . 1 1 93 93 ASN H H 93 8.647 8.647 8.236 0.411 17890 14853 1 19 . 1 1 94 94 VAL N N 94 112.437 112.437 119.138 -6.701 17890 14854 1 19 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.607 0.458 17890 14855 1 19 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.009 -1.094 17890 14856 1 19 . 1 1 94 94 VAL CB C 94 34.155 34.155 36.291 -2.136 17890 14857 1 19 . 1 1 94 94 VAL H H 94 6.989 6.989 7.474 -0.485 17890 14858 1 19 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.974 -0.046 17890 14859 1 19 . 1 1 95 95 PRO C C 95 176.041 176.041 175.515 0.526 17890 14860 1 19 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.477 -1.276 17890 14861 1 19 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.699 -0.974 17890 14862 1 19 . 1 1 96 96 VAL N N 96 113.564 113.564 115.796 -2.232 17890 14863 1 19 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.974 -0.239 17890 14864 1 19 . 1 1 96 96 VAL C C 96 173.656 173.656 175.000 -1.344 17890 14865 1 19 . 1 1 96 96 VAL CA C 96 58.853 58.853 58.999 -0.146 17890 14866 1 19 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.377 1.776 17890 14867 1 19 . 1 1 96 96 VAL H H 96 8.199 8.199 8.872 -0.673 17890 14868 1 19 . 1 1 97 97 VAL N N 97 122.328 122.328 123.121 -0.793 17890 14869 1 19 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.589 0.042 17890 14870 1 19 . 1 1 97 97 VAL C C 97 174.776 174.776 175.673 -0.897 17890 14871 1 19 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.180 0.477 17890 14872 1 19 . 1 1 97 97 VAL CB C 97 31.128 31.128 32.041 -0.913 17890 14873 1 19 . 1 1 97 97 VAL H H 97 8.957 8.957 8.043 0.914 17890 14874 1 19 . 1 1 98 98 LEU N N 98 130.258 130.258 125.824 4.434 17890 14875 1 19 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.931 0.119 17890 14876 1 19 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.592 1.231 17890 14877 1 19 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.081 1.037 17890 14878 1 19 . 1 1 98 98 LEU H H 98 9.245 9.245 9.052 0.193 17890 14879 1 19 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.738 0.041 17890 14880 1 19 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.041 0.447 17890 14881 1 19 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.027 -0.574 17890 14882 1 19 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.653 -0.668 17890 14883 1 19 . 1 1 100 100 PRO C C 100 177.309 177.309 175.778 1.531 17890 14884 1 19 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.044 0.780 17890 14885 1 19 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.289 -0.184 17890 14886 1 19 . 1 1 101 101 ASN N N 101 119.284 119.284 125.884 -6.600 17890 14887 1 19 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.631 -0.089 17890 14888 1 19 . 1 1 101 101 ASN C C 101 171.920 171.920 173.957 -2.037 17890 14889 1 19 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.816 -0.616 17890 14890 1 19 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.438 -1.813 17890 14891 1 19 . 1 1 101 101 ASN H H 101 7.273 7.273 9.425 -2.152 17890 14892 1 19 . 1 1 102 102 ASN N N 102 115.674 115.674 116.235 -0.561 17890 14893 1 19 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.725 -0.807 17890 14894 1 19 . 1 1 102 102 ASN C C 102 173.264 173.264 174.333 -1.069 17890 14895 1 19 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.791 1.248 17890 14896 1 19 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.039 -1.057 17890 14897 1 19 . 1 1 102 102 ASN H H 102 8.197 8.197 7.802 0.395 17890 14898 1 19 . 1 1 103 103 TYR N N 103 118.775 118.775 121.630 -2.855 17890 14899 1 19 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.335 0.150 17890 14900 1 19 . 1 1 103 103 TYR C C 103 175.248 175.248 174.825 0.423 17890 14901 1 19 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.897 -2.407 17890 14902 1 19 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.471 -0.939 17890 14903 1 19 . 1 1 103 103 TYR H H 103 7.745 7.745 7.302 0.443 17890 14904 1 19 . 1 1 104 104 VAL N N 104 116.205 116.205 115.936 0.269 17890 14905 1 19 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.910 0.067 17890 14906 1 19 . 1 1 104 104 VAL C C 104 174.361 174.361 173.468 0.893 17890 14907 1 19 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.732 -1.481 17890 14908 1 19 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.307 0.236 17890 14909 1 19 . 1 1 104 104 VAL H H 104 7.498 7.498 8.011 -0.513 17890 14910 1 19 . 1 1 105 105 TRP N N 105 119.557 119.557 119.478 0.079 17890 14911 1 19 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.080 -0.205 17890 14912 1 19 . 1 1 105 105 TRP C C 105 175.526 175.526 176.398 -0.872 17890 14913 1 19 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.349 -0.465 17890 14914 1 19 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.616 -0.077 17890 14915 1 19 . 1 1 105 105 TRP H H 105 8.926 8.926 8.893 0.033 17890 14916 1 19 . 1 1 106 106 THR N N 106 120.480 120.480 119.662 0.818 17890 14917 1 19 . 1 1 106 106 THR HA H 106 4.966 4.966 4.774 0.192 17890 14918 1 19 . 1 1 106 106 THR C C 106 174.177 174.177 174.340 -0.163 17890 14919 1 19 . 1 1 106 106 THR CA C 106 62.091 62.091 63.812 -1.721 17890 14920 1 19 . 1 1 106 106 THR CB C 106 69.649 69.649 69.269 0.380 17890 14921 1 19 . 1 1 106 106 THR H H 106 9.525 9.525 9.258 0.267 17890 14922 1 19 . 1 1 107 107 LEU N N 107 127.146 127.146 129.814 -2.668 17890 14923 1 19 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.023 -0.196 17890 14924 1 19 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.382 0.327 17890 14925 1 19 . 1 1 107 107 LEU CB C 107 41.523 41.523 41.519 0.004 17890 14926 1 19 . 1 1 107 107 LEU H H 107 7.591 7.591 8.583 -0.992 17890 14927 1 19 . 1 1 108 108 THR N N 108 119.928 119.928 119.875 0.053 17890 14928 1 19 . 1 1 108 108 THR HA H 108 4.411 4.411 4.268 0.143 17890 14929 1 19 . 1 1 108 108 THR C C 108 173.319 173.319 173.684 -0.365 17890 14930 1 19 . 1 1 108 108 THR CA C 108 62.243 62.243 62.988 -0.745 17890 14931 1 19 . 1 1 108 108 THR CB C 108 70.138 70.138 69.484 0.654 17890 14932 1 19 . 1 1 108 108 THR H H 108 8.141 8.141 7.954 0.187 17890 14933 1 19 . 1 1 109 109 LEU N N 109 130.557 130.557 130.207 0.350 17890 14934 1 19 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.925 -0.380 17890 14935 1 19 . 1 1 109 109 LEU C C 109 175.217 175.217 176.322 -1.105 17890 14936 1 19 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.451 -0.165 17890 14937 1 19 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.917 -2.311 17890 14938 1 19 . 1 1 109 109 LEU H H 109 8.924 8.924 8.640 0.284 17890 14939 1 19 . 1 1 110 110 THR N N 110 120.160 120.160 116.131 4.029 17890 14940 1 19 . 1 1 110 110 THR HA H 110 4.911 4.911 4.673 0.238 17890 14941 1 19 . 1 1 110 110 THR CA C 110 60.141 60.141 60.609 -0.468 17890 14942 1 19 . 1 1 110 110 THR CB C 110 72.785 72.785 70.933 1.852 17890 14943 1 19 . 1 1 110 110 THR H H 110 7.677 7.677 8.615 -0.938 17890 14944 1 19 . 1 1 111 111 SER HA H 111 4.204 4.204 4.197 0.007 17890 14945 1 19 . 1 1 111 111 SER C C 111 174.755 174.755 174.322 0.433 17890 14946 1 19 . 1 1 111 111 SER CA C 111 60.710 60.710 60.349 0.361 17890 14947 1 19 . 1 1 111 111 SER CB C 111 62.660 62.660 63.158 -0.498 17890 14948 1 19 . 1 1 112 112 GLY N N 112 107.313 107.313 104.898 2.415 17890 14949 1 19 . 1 1 112 112 GLY C C 112 173.023 173.023 172.674 0.349 17890 14950 1 19 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.078 -0.927 17890 14951 1 19 . 1 1 112 112 GLY H H 112 8.249 8.249 7.371 0.878 17890 14952 1 19 . 1 1 113 113 GLY N N 113 105.618 105.618 106.701 -1.083 17890 14953 1 19 . 1 1 113 113 GLY C C 113 175.844 175.844 171.635 4.209 17890 14954 1 19 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.613 -2.854 17890 14955 1 19 . 1 1 113 113 GLY H H 113 7.444 7.444 7.335 0.109 17890 14956 1 19 . 1 1 114 114 TYR N N 114 121.548 121.548 116.991 4.557 17890 14957 1 19 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.465 -0.613 17890 14958 1 19 . 1 1 114 114 TYR C C 114 175.605 175.605 174.341 1.264 17890 14959 1 19 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.558 4.705 17890 14960 1 19 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.431 -4.498 17890 14961 1 19 . 1 1 114 114 TYR H H 114 9.677 9.677 9.074 0.603 17890 14962 1 19 . 1 1 115 115 ASN N N 115 123.274 123.274 117.072 6.202 17890 14963 1 19 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.222 -0.124 17890 14964 1 19 . 1 1 115 115 ASN C C 115 174.355 174.355 173.238 1.117 17890 14965 1 19 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.307 -1.261 17890 14966 1 19 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.725 -2.376 17890 14967 1 19 . 1 1 115 115 ASN H H 115 9.350 9.350 8.873 0.477 17890 14968 1 19 . 1 1 116 116 ILE N N 116 130.611 130.611 122.739 7.872 17890 14969 1 19 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.644 -0.405 17890 14970 1 19 . 1 1 116 116 ILE C C 116 173.998 173.998 173.946 0.052 17890 14971 1 19 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.997 2.202 17890 14972 1 19 . 1 1 116 116 ILE CB C 116 37.100 37.100 38.821 -1.721 17890 14973 1 19 . 1 1 116 116 ILE H H 116 9.473 9.473 8.517 0.956 17890 14974 1 19 . 1 1 117 117 GLN N N 117 121.633 121.633 125.428 -3.795 17890 14975 1 19 . 1 1 117 117 GLN HA H 117 5.935 5.935 4.989 0.946 17890 14976 1 19 . 1 1 117 117 GLN C C 117 177.902 177.902 175.894 2.008 17890 14977 1 19 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.891 -0.570 17890 14978 1 19 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.464 3.993 17890 14979 1 19 . 1 1 117 117 GLN H H 117 8.781 8.781 8.636 0.145 17890 14980 1 19 . 1 1 118 118 ASP N N 118 116.836 116.836 120.223 -3.387 17890 14981 1 19 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.897 0.886 17890 14982 1 19 . 1 1 118 118 ASP C C 118 178.084 178.084 176.697 1.387 17890 14983 1 19 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.346 -1.576 17890 14984 1 19 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.293 -0.925 17890 14985 1 19 . 1 1 118 118 ASP H H 118 9.330 9.330 8.622 0.708 17890 14986 1 19 . 1 1 119 119 GLY N N 119 111.037 111.037 107.665 3.372 17890 14987 1 19 . 1 1 119 119 GLY C C 119 174.196 174.196 175.680 -1.484 17890 14988 1 19 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.998 1.978 17890 14989 1 19 . 1 1 119 119 GLY H H 119 8.986 8.986 8.328 0.658 17890 14990 1 19 . 1 1 120 120 LYS N N 120 114.809 114.809 122.031 -7.222 17890 14991 1 19 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.480 -0.131 17890 14992 1 19 . 1 1 120 120 LYS C C 120 175.174 175.174 176.781 -1.607 17890 14993 1 19 . 1 1 120 120 LYS CA C 120 55.933 55.933 55.194 0.739 17890 14994 1 19 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.366 0.110 17890 14995 1 19 . 1 1 120 120 LYS H H 120 7.045 7.045 8.659 -1.614 17890 14996 1 19 . 1 1 121 121 ARG N N 121 116.291 116.291 114.283 2.008 17890 14997 1 19 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.060 -0.474 17890 14998 1 19 . 1 1 121 121 ARG C C 121 175.097 175.097 177.059 -1.962 17890 14999 1 19 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.072 0.997 17890 15000 1 19 . 1 1 121 121 ARG CB C 121 26.623 26.623 27.255 -0.631 17890 15001 1 19 . 1 1 121 121 ARG H H 121 7.683 7.683 7.926 -0.243 17890 15002 1 19 . 1 1 122 122 THR N N 122 113.730 113.730 109.286 4.444 17890 15003 1 19 . 1 1 122 122 THR HA H 122 4.540 4.540 4.234 0.306 17890 15004 1 19 . 1 1 122 122 THR C C 122 175.302 175.302 174.564 0.738 17890 15005 1 19 . 1 1 122 122 THR CA C 122 62.871 62.871 64.249 -1.379 17890 15006 1 19 . 1 1 122 122 THR CB C 122 71.552 71.552 69.608 1.944 17890 15007 1 19 . 1 1 122 122 THR H H 122 11.059 11.059 7.964 3.095 17890 15008 1 19 . 1 1 123 123 VAL N N 123 118.350 118.350 114.888 3.462 17890 15009 1 19 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.664 0.146 17890 15010 1 19 . 1 1 123 123 VAL C C 123 174.730 174.730 173.556 1.174 17890 15011 1 19 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.756 0.555 17890 15012 1 19 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.402 2.680 17890 15013 1 19 . 1 1 123 123 VAL H H 123 8.181 8.181 7.572 0.609 17890 15014 1 19 . 1 1 124 124 SER N N 124 113.053 113.053 113.762 -0.709 17890 15015 1 19 . 1 1 124 124 SER HA H 124 5.820 5.820 5.130 0.690 17890 15016 1 19 . 1 1 124 124 SER C C 124 175.521 175.521 173.402 2.119 17890 15017 1 19 . 1 1 124 124 SER CA C 124 58.087 58.087 56.752 1.335 17890 15018 1 19 . 1 1 124 124 SER CB C 124 67.405 67.405 65.463 1.942 17890 15019 1 19 . 1 1 124 124 SER H H 124 9.138 9.138 8.613 0.525 17890 15020 1 19 . 1 1 125 125 TRP N N 125 124.900 124.900 123.889 1.011 17890 15021 1 19 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.039 0.571 17890 15022 1 19 . 1 1 125 125 TRP C C 125 178.114 178.114 177.364 0.750 17890 15023 1 19 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.173 -0.699 17890 15024 1 19 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.212 0.811 17890 15025 1 19 . 1 1 125 125 TRP H H 125 8.843 8.843 8.347 0.496 17890 15026 1 19 . 1 1 126 126 SER N N 126 119.243 119.243 113.941 5.302 17890 15027 1 19 . 1 1 126 126 SER HA H 126 5.443 5.443 5.192 0.251 17890 15028 1 19 . 1 1 126 126 SER C C 126 171.668 171.668 172.786 -1.118 17890 15029 1 19 . 1 1 126 126 SER CA C 126 58.696 58.696 57.170 1.526 17890 15030 1 19 . 1 1 126 126 SER CB C 126 66.176 66.176 66.213 -0.037 17890 15031 1 19 . 1 1 126 126 SER H H 126 9.835 9.835 9.335 0.500 17890 15032 1 19 . 1 1 127 127 LEU N N 127 113.708 113.708 119.041 -5.333 17890 15033 1 19 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.724 0.431 17890 15034 1 19 . 1 1 127 127 LEU C C 127 176.563 176.563 177.495 -0.932 17890 15035 1 19 . 1 1 127 127 LEU CA C 127 52.645 52.645 52.937 -0.292 17890 15036 1 19 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.125 -1.429 17890 15037 1 19 . 1 1 127 127 LEU H H 127 6.559 6.559 8.183 -1.624 17890 15038 1 19 . 1 1 128 128 ASN N N 128 121.739 121.739 120.196 1.543 17890 15039 1 19 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.787 -0.098 17890 15040 1 19 . 1 1 128 128 ASN C C 128 175.452 175.452 175.671 -0.219 17890 15041 1 19 . 1 1 128 128 ASN CA C 128 56.007 56.007 55.420 0.587 17890 15042 1 19 . 1 1 128 128 ASN CB C 128 39.291 39.291 39.455 -0.164 17890 15043 1 19 . 1 1 128 128 ASN H H 128 8.662 8.662 9.033 -0.371 17890 15044 1 19 . 1 1 129 129 ASN N N 129 119.586 119.586 116.538 3.048 17890 15045 1 19 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.948 0.049 17890 15046 1 19 . 1 1 129 129 ASN C C 129 175.900 175.900 174.060 1.840 17890 15047 1 19 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.013 1.220 17890 15048 1 19 . 1 1 129 129 ASN CB C 129 41.256 41.256 40.115 1.141 17890 15049 1 19 . 1 1 129 129 ASN H H 129 10.962 10.962 7.999 2.963 17890 15050 1 19 . 1 1 130 130 ALA N N 130 128.292 128.292 122.504 5.788 17890 15051 1 19 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.045 -0.475 17890 15052 1 19 . 1 1 130 130 ALA C C 130 172.620 172.620 177.292 -4.672 17890 15053 1 19 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.200 -0.561 17890 15054 1 19 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.382 -1.282 17890 15055 1 19 . 1 1 130 130 ALA H H 130 10.629 10.629 8.352 2.277 17890 15056 1 19 . 1 1 131 131 THR N N 131 105.584 105.584 110.854 -5.270 17890 15057 1 19 . 1 1 131 131 THR HA H 131 4.462 4.462 4.264 0.198 17890 15058 1 19 . 1 1 131 131 THR C C 131 173.552 173.552 174.648 -1.096 17890 15059 1 19 . 1 1 131 131 THR CA C 131 58.338 58.338 61.499 -3.161 17890 15060 1 19 . 1 1 131 131 THR CB C 131 71.569 71.569 69.660 1.909 17890 15061 1 19 . 1 1 131 131 THR H H 131 7.092 7.092 7.591 -0.499 17890 15062 1 19 . 1 1 132 132 ALA N N 132 121.773 121.773 123.480 -1.707 17890 15063 1 19 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.064 -0.315 17890 15064 1 19 . 1 1 132 132 ALA C C 132 178.819 178.819 178.351 0.468 17890 15065 1 19 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.530 1.754 17890 15066 1 19 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.961 -0.734 17890 15067 1 19 . 1 1 132 132 ALA H H 132 8.952 8.952 8.457 0.495 17890 15068 1 19 . 1 1 133 133 GLY N N 133 113.965 113.965 111.522 2.443 17890 15069 1 19 . 1 1 133 133 GLY C C 133 173.453 173.453 174.232 -0.779 17890 15070 1 19 . 1 1 133 133 GLY CA C 133 45.166 45.166 45.037 0.129 17890 15071 1 19 . 1 1 133 133 GLY H H 133 9.016 9.016 8.711 0.305 17890 15072 1 19 . 1 1 134 134 GLU N N 134 123.460 123.460 121.389 2.071 17890 15073 1 19 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.297 -0.339 17890 15074 1 19 . 1 1 134 134 GLU C C 134 176.120 176.120 176.290 -0.170 17890 15075 1 19 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.903 1.496 17890 15076 1 19 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.863 0.522 17890 15077 1 19 . 1 1 134 134 GLU H H 134 7.598 7.598 7.582 0.016 17890 15078 1 19 . 1 1 135 135 GLU N N 135 122.633 122.633 125.918 -3.285 17890 15079 1 19 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.349 -0.038 17890 15080 1 19 . 1 1 135 135 GLU C C 135 176.014 176.014 176.025 -0.011 17890 15081 1 19 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.049 0.133 17890 15082 1 19 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.106 -0.653 17890 15083 1 19 . 1 1 135 135 GLU H H 135 8.258 8.258 8.555 -0.297 17890 15084 1 19 . 1 1 136 136 VAL N N 136 123.635 123.635 126.317 -2.682 17890 15085 1 19 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.799 -0.107 17890 15086 1 19 . 1 1 136 136 VAL C C 136 173.932 173.932 174.918 -0.986 17890 15087 1 19 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.452 0.380 17890 15088 1 19 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.612 -0.748 17890 15089 1 19 . 1 1 136 136 VAL H H 136 7.267 7.267 8.254 -0.987 17890 15090 1 19 . 1 1 137 137 SER N N 137 118.950 118.950 121.824 -2.874 17890 15091 1 19 . 1 1 137 137 SER HA H 137 4.887 4.887 5.134 -0.247 17890 15092 1 19 . 1 1 137 137 SER C C 137 173.780 173.780 172.992 0.788 17890 15093 1 19 . 1 1 137 137 SER CA C 137 57.895 57.895 56.825 1.070 17890 15094 1 19 . 1 1 137 137 SER CB C 137 65.027 65.027 67.025 -1.998 17890 15095 1 19 . 1 1 137 137 SER H H 137 8.454 8.454 8.747 -0.293 17890 15096 1 19 . 1 1 138 138 ILE N N 138 123.511 123.511 119.685 3.826 17890 15097 1 19 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.008 -0.760 17890 15098 1 19 . 1 1 138 138 ILE C C 138 176.142 176.142 175.611 0.531 17890 15099 1 19 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.480 1.369 17890 15100 1 19 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.660 -3.066 17890 15101 1 19 . 1 1 138 138 ILE H H 138 7.915 7.915 8.427 -0.512 17890 15102 1 19 . 1 1 139 139 GLY N N 139 115.638 115.638 110.975 4.663 17890 15103 1 19 . 1 1 139 139 GLY C C 139 171.947 171.947 173.269 -1.322 17890 15104 1 19 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.418 1.668 17890 15105 1 19 . 1 1 139 139 GLY H H 139 8.490 8.490 8.417 0.073 17890 15106 1 19 . 1 1 140 140 ALA N N 140 128.563 128.563 122.024 6.539 17890 15107 1 19 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.407 -0.011 17890 15108 1 19 . 1 1 140 140 ALA C C 140 177.956 177.956 176.981 0.975 17890 15109 1 19 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.297 -1.651 17890 15110 1 19 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.352 -0.148 17890 15111 1 19 . 1 1 140 140 ALA H H 140 8.531 8.531 8.390 0.141 17890 15112 1 19 . 1 1 141 141 ASP N N 141 120.886 120.886 114.560 6.326 17890 15113 1 19 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.626 -0.028 17890 15114 1 19 . 1 1 141 141 ASP C C 141 175.411 175.411 173.979 1.432 17890 15115 1 19 . 1 1 141 141 ASP CA C 141 53.916 53.916 52.944 0.972 17890 15116 1 19 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.675 -0.983 17890 15117 1 19 . 1 1 141 141 ASP H H 141 8.507 8.507 7.753 0.754 17890 15118 1 19 . 1 1 142 142 ALA N N 142 125.604 125.604 120.741 4.863 17890 15119 1 19 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.579 -0.062 17890 15120 1 19 . 1 1 142 142 ALA C C 142 177.671 177.671 178.282 -0.611 17890 15121 1 19 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.541 0.452 17890 15122 1 19 . 1 1 142 142 ALA CB C 142 21.535 21.535 22.160 -0.625 17890 15123 1 19 . 1 1 142 142 ALA H H 142 7.894 7.894 8.175 -0.281 17890 15124 1 19 . 1 1 143 143 THR N N 143 118.085 118.085 115.636 2.449 17890 15125 1 19 . 1 1 143 143 THR HA H 143 3.744 3.744 4.213 -0.469 17890 15126 1 19 . 1 1 143 143 THR C C 143 175.464 175.464 174.639 0.825 17890 15127 1 19 . 1 1 143 143 THR CA C 143 64.548 64.548 64.767 -0.219 17890 15128 1 19 . 1 1 143 143 THR CB C 143 69.305 69.305 68.977 0.328 17890 15129 1 19 . 1 1 143 143 THR H H 143 8.268 8.268 8.729 -0.461 17890 15130 1 19 . 1 1 144 144 PHE N N 144 118.635 118.635 117.362 1.273 17890 15131 1 19 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.808 -0.462 17890 15132 1 19 . 1 1 144 144 PHE C C 144 176.209 176.209 175.333 0.876 17890 15133 1 19 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.057 4.404 17890 15134 1 19 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.155 0.449 17890 15135 1 19 . 1 1 144 144 PHE H H 144 8.719 8.719 7.828 0.891 17890 15136 1 19 . 1 1 145 145 SER N N 145 113.446 113.446 115.328 -1.882 17890 15137 1 19 . 1 1 145 145 SER HA H 145 4.866 4.866 4.008 0.858 17890 15138 1 19 . 1 1 145 145 SER C C 145 176.605 176.605 176.072 0.533 17890 15139 1 19 . 1 1 145 145 SER CA C 145 59.432 59.432 57.937 1.496 17890 15140 1 19 . 1 1 145 145 SER CB C 145 62.167 62.167 62.701 -0.534 17890 15141 1 19 . 1 1 145 145 SER H H 145 8.657 8.657 7.148 1.509 17890 15142 1 19 . 1 1 146 146 GLY N N 146 109.277 109.277 111.283 -2.006 17890 15143 1 19 . 1 1 146 146 GLY C C 146 174.293 174.293 173.184 1.109 17890 15144 1 19 . 1 1 146 146 GLY CA C 146 44.940 44.940 44.995 -0.056 17890 15145 1 19 . 1 1 146 146 GLY H H 146 7.467 7.467 7.823 -0.356 17890 15146 1 19 . 1 1 147 147 ARG N N 147 122.863 122.863 117.980 4.883 17890 15147 1 19 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.978 0.463 17890 15148 1 19 . 1 1 147 147 ARG C C 147 173.849 173.849 174.281 -0.432 17890 15149 1 19 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.213 -1.986 17890 15150 1 19 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.657 -1.060 17890 15151 1 19 . 1 1 147 147 ARG H H 147 7.556 7.556 7.269 0.287 17890 15152 1 19 . 1 1 148 148 TRP N N 148 118.465 118.465 120.307 -1.842 17890 15153 1 19 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.050 -0.204 17890 15154 1 19 . 1 1 148 148 TRP C C 148 174.353 174.353 174.342 0.011 17890 15155 1 19 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.930 -1.268 17890 15156 1 19 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.176 -1.177 17890 15157 1 19 . 1 1 148 148 TRP H H 148 8.709 8.709 9.289 -0.580 17890 15158 1 19 . 1 1 149 149 VAL N N 149 125.852 125.852 118.022 7.830 17890 15159 1 19 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.585 -0.442 17890 15160 1 19 . 1 1 149 149 VAL C C 149 173.613 173.613 173.365 0.248 17890 15161 1 19 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.891 1.849 17890 15162 1 19 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.217 -2.834 17890 15163 1 19 . 1 1 149 149 VAL H H 149 9.700 9.700 8.825 0.875 17890 15164 1 19 . 1 1 150 150 ILE N N 150 125.140 125.140 127.444 -2.304 17890 15165 1 19 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.087 -0.225 17890 15166 1 19 . 1 1 150 150 ILE C C 150 175.661 175.661 174.134 1.527 17890 15167 1 19 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.500 1.321 17890 15168 1 19 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.625 -0.805 17890 15169 1 19 . 1 1 150 150 ILE H H 150 7.747 7.747 7.817 -0.070 17890 15170 1 19 . 1 1 151 151 GLU N N 151 126.762 126.762 126.813 -0.051 17890 15171 1 19 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.864 0.016 17890 15172 1 19 . 1 1 151 151 GLU C C 151 174.424 174.424 174.804 -0.380 17890 15173 1 19 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.009 0.787 17890 15174 1 19 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.815 0.436 17890 15175 1 19 . 1 1 151 151 GLU H H 151 8.892 8.892 8.770 0.122 17890 15176 1 19 . 1 1 152 152 LYS N N 152 126.299 126.299 122.564 3.735 17890 15177 1 19 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.776 0.085 17890 15178 1 19 . 1 1 152 152 LYS C C 152 176.282 176.282 176.824 -0.542 17890 15179 1 19 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.865 0.640 17890 15180 1 19 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.547 0.789 17890 15181 1 19 . 1 1 152 152 LYS H H 152 8.640 8.640 8.305 0.335 17890 15182 1 20 . 1 1 2 2 GLY CA C 2 43.294 43.294 46.214 -2.920 17890 15183 1 20 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.807 -0.185 17890 15184 1 20 . 1 1 8 8 HIS CA C 8 55.661 55.661 56.345 -0.684 17890 15185 1 20 . 1 1 8 8 HIS CB C 8 29.880 29.880 31.087 -1.207 17890 15186 1 20 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.232 0.414 17890 15187 1 20 . 1 1 9 9 HIS CA C 9 55.684 55.684 58.014 -2.330 17890 15188 1 20 . 1 1 9 9 HIS CB C 9 29.831 29.831 29.367 0.464 17890 15189 1 20 . 1 1 10 10 HIS N N 10 120.811 120.811 114.900 5.911 17890 15190 1 20 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.948 -0.268 17890 15191 1 20 . 1 1 10 10 HIS C C 10 174.875 174.875 175.065 -0.190 17890 15192 1 20 . 1 1 10 10 HIS CA C 10 55.746 55.746 55.378 0.368 17890 15193 1 20 . 1 1 10 10 HIS CB C 10 29.889 29.889 30.838 -0.949 17890 15194 1 20 . 1 1 10 10 HIS H H 10 8.583 8.583 7.732 0.851 17890 15195 1 20 . 1 1 11 11 SER N N 11 118.009 118.009 114.961 3.048 17890 15196 1 20 . 1 1 11 11 SER HA H 11 4.424 4.424 4.077 0.347 17890 15197 1 20 . 1 1 11 11 SER C C 11 174.962 174.962 174.684 0.278 17890 15198 1 20 . 1 1 11 11 SER CA C 11 58.660 58.660 60.126 -1.466 17890 15199 1 20 . 1 1 11 11 SER CB C 11 63.822 63.822 63.006 0.816 17890 15200 1 20 . 1 1 11 11 SER H H 11 8.438 8.438 8.438 -0.000 17890 15201 1 20 . 1 1 12 12 GLY N N 12 111.011 111.011 107.039 3.972 17890 15202 1 20 . 1 1 12 12 GLY C C 12 173.907 173.907 172.284 1.623 17890 15203 1 20 . 1 1 12 12 GLY CA C 12 45.421 45.421 44.477 0.944 17890 15204 1 20 . 1 1 12 12 GLY H H 12 8.433 8.433 8.042 0.391 17890 15205 1 20 . 1 1 13 13 ASP N N 13 120.291 120.291 119.325 0.966 17890 15206 1 20 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.924 -0.262 17890 15207 1 20 . 1 1 13 13 ASP C C 13 176.115 176.115 175.111 1.004 17890 15208 1 20 . 1 1 13 13 ASP CA C 13 54.303 54.303 52.390 1.913 17890 15209 1 20 . 1 1 13 13 ASP CB C 13 41.465 41.465 43.959 -2.494 17890 15210 1 20 . 1 1 13 13 ASP H H 13 8.153 8.153 7.627 0.526 17890 15211 1 20 . 1 1 14 14 SER N N 14 116.987 116.987 116.246 0.741 17890 15212 1 20 . 1 1 14 14 SER HA H 14 4.754 4.754 4.416 0.338 17890 15213 1 20 . 1 1 14 14 SER CA C 14 56.469 56.469 57.743 -1.274 17890 15214 1 20 . 1 1 14 14 SER CB C 14 63.553 63.553 63.077 0.476 17890 15215 1 20 . 1 1 14 14 SER H H 14 8.210 8.210 8.220 -0.010 17890 15216 1 20 . 1 1 15 15 PRO HA H 15 4.442 4.442 3.023 1.419 17890 15217 1 20 . 1 1 15 15 PRO C C 15 176.424 176.424 175.491 0.933 17890 15218 1 20 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.306 -0.073 17890 15219 1 20 . 1 1 15 15 PRO CB C 15 32.148 32.148 31.428 0.720 17890 15220 1 20 . 1 1 16 16 ALA N N 16 124.219 124.219 127.010 -2.791 17890 15221 1 20 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.334 0.016 17890 15222 1 20 . 1 1 16 16 ALA C C 16 177.552 177.552 177.277 0.275 17890 15223 1 20 . 1 1 16 16 ALA CA C 16 52.433 52.433 51.949 0.484 17890 15224 1 20 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.638 -0.319 17890 15225 1 20 . 1 1 16 16 ALA H H 16 8.284 8.284 8.055 0.229 17890 15226 1 20 . 1 1 17 17 VAL N N 17 119.504 119.504 119.896 -0.392 17890 15227 1 20 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.146 0.103 17890 15228 1 20 . 1 1 17 17 VAL C C 17 176.322 176.322 175.462 0.860 17890 15229 1 20 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.695 -0.417 17890 15230 1 20 . 1 1 17 17 VAL CB C 17 32.957 32.957 32.904 0.053 17890 15231 1 20 . 1 1 17 17 VAL H H 17 8.046 8.046 7.623 0.423 17890 15232 1 20 . 1 1 18 18 THR N N 18 118.186 118.186 120.418 -2.232 17890 15233 1 20 . 1 1 18 18 THR HA H 18 4.473 4.473 4.521 -0.049 17890 15234 1 20 . 1 1 18 18 THR C C 18 174.248 174.248 174.768 -0.520 17890 15235 1 20 . 1 1 18 18 THR CA C 18 61.565 61.565 61.347 0.218 17890 15236 1 20 . 1 1 18 18 THR CB C 18 70.165 70.165 69.647 0.519 17890 15237 1 20 . 1 1 18 18 THR H H 18 8.276 8.276 8.407 -0.131 17890 15238 1 20 . 1 1 19 19 LEU N N 19 125.265 125.265 119.929 5.336 17890 15239 1 20 . 1 1 19 19 LEU HA H 19 4.293 4.293 3.969 0.324 17890 15240 1 20 . 1 1 19 19 LEU C C 19 175.689 175.689 175.143 0.546 17890 15241 1 20 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.609 -0.182 17890 15242 1 20 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.296 1.983 17890 15243 1 20 . 1 1 19 19 LEU H H 19 8.091 8.091 8.297 -0.206 17890 15244 1 20 . 1 1 20 20 SER N N 20 114.622 114.622 115.460 -0.838 17890 15245 1 20 . 1 1 20 20 SER HA H 20 4.947 4.947 4.842 0.105 17890 15246 1 20 . 1 1 20 20 SER C C 20 174.220 174.220 173.199 1.021 17890 15247 1 20 . 1 1 20 20 SER CA C 20 56.583 56.583 57.254 -0.671 17890 15248 1 20 . 1 1 20 20 SER CB C 20 65.653 65.653 66.053 -0.400 17890 15249 1 20 . 1 1 20 20 SER H H 20 7.316 7.316 7.929 -0.613 17890 15250 1 20 . 1 1 21 21 ALA N N 21 125.517 125.517 124.085 1.432 17890 15251 1 20 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.931 -0.263 17890 15252 1 20 . 1 1 21 21 ALA C C 21 177.960 177.960 177.539 0.421 17890 15253 1 20 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.320 1.690 17890 15254 1 20 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.436 -0.211 17890 15255 1 20 . 1 1 21 21 ALA H H 21 8.993 8.993 8.476 0.517 17890 15256 1 20 . 1 1 22 22 GLY N N 22 109.543 109.543 111.032 -1.489 17890 15257 1 20 . 1 1 22 22 GLY C C 22 170.422 170.422 171.736 -1.314 17890 15258 1 20 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.164 0.216 17890 15259 1 20 . 1 1 22 22 GLY H H 22 8.411 8.411 8.866 -0.455 17890 15260 1 20 . 1 1 23 23 ASN N N 23 119.649 119.649 118.933 0.716 17890 15261 1 20 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.629 0.258 17890 15262 1 20 . 1 1 23 23 ASN C C 23 175.207 175.207 174.579 0.628 17890 15263 1 20 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.711 -0.890 17890 15264 1 20 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.310 -0.555 17890 15265 1 20 . 1 1 23 23 ASN H H 23 8.092 8.092 8.430 -0.338 17890 15266 1 20 . 1 1 24 24 TYR N N 24 120.889 120.889 121.772 -0.883 17890 15267 1 20 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.135 0.120 17890 15268 1 20 . 1 1 24 24 TYR C C 24 175.667 175.667 174.490 1.177 17890 15269 1 20 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.234 0.879 17890 15270 1 20 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.622 0.204 17890 15271 1 20 . 1 1 24 24 TYR H H 24 9.914 9.914 8.933 0.981 17890 15272 1 20 . 1 1 25 25 ILE N N 25 115.978 115.978 113.793 2.185 17890 15273 1 20 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.015 0.071 17890 15274 1 20 . 1 1 25 25 ILE C C 25 175.200 175.200 174.063 1.137 17890 15275 1 20 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.705 0.840 17890 15276 1 20 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.474 -0.352 17890 15277 1 20 . 1 1 25 25 ILE H H 25 9.216 9.216 9.243 -0.027 17890 15278 1 20 . 1 1 26 26 ILE N N 26 123.957 123.957 122.618 1.339 17890 15279 1 20 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.200 -0.224 17890 15280 1 20 . 1 1 26 26 ILE C C 26 174.810 174.810 174.953 -0.143 17890 15281 1 20 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.350 0.259 17890 15282 1 20 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.060 1.062 17890 15283 1 20 . 1 1 26 26 ILE H H 26 9.559 9.559 8.864 0.695 17890 15284 1 20 . 1 1 27 27 TYR N N 27 121.371 121.371 124.140 -2.769 17890 15285 1 20 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.632 0.558 17890 15286 1 20 . 1 1 27 27 TYR C C 27 173.963 173.963 173.503 0.460 17890 15287 1 20 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.761 -0.092 17890 15288 1 20 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.040 0.658 17890 15289 1 20 . 1 1 27 27 TYR H H 27 9.378 9.378 9.141 0.237 17890 15290 1 20 . 1 1 28 28 ASN N N 28 121.991 121.991 120.024 1.967 17890 15291 1 20 . 1 1 28 28 ASN HA H 28 3.768 3.768 3.967 -0.199 17890 15292 1 20 . 1 1 28 28 ASN C C 28 174.352 174.352 176.011 -1.659 17890 15293 1 20 . 1 1 28 28 ASN CA C 28 55.120 55.120 53.106 2.014 17890 15294 1 20 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.723 1.723 17890 15295 1 20 . 1 1 28 28 ASN H H 28 8.466 8.466 8.399 0.067 17890 15296 1 20 . 1 1 29 29 ARG N N 29 121.103 121.103 126.376 -5.273 17890 15297 1 20 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.010 -0.149 17890 15298 1 20 . 1 1 29 29 ARG C C 29 173.635 173.635 177.431 -3.796 17890 15299 1 20 . 1 1 29 29 ARG CA C 29 59.293 59.293 58.364 0.929 17890 15300 1 20 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.163 0.236 17890 15301 1 20 . 1 1 29 29 ARG H H 29 7.756 7.756 8.144 -0.388 17890 15302 1 20 . 1 1 30 30 VAL N N 30 118.412 118.412 118.779 -0.367 17890 15303 1 20 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.860 0.084 17890 15304 1 20 . 1 1 30 30 VAL C C 30 176.199 176.199 176.370 -0.171 17890 15305 1 20 . 1 1 30 30 VAL CA C 30 62.577 62.577 64.656 -2.079 17890 15306 1 20 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.275 -2.053 17890 15307 1 20 . 1 1 30 30 VAL H H 30 8.976 8.976 7.929 1.047 17890 15308 1 20 . 1 1 31 31 LEU N N 31 125.418 125.418 116.176 9.242 17890 15309 1 20 . 1 1 31 31 LEU HA H 31 4.485 4.485 3.913 0.572 17890 15310 1 20 . 1 1 31 31 LEU C C 31 179.123 179.123 176.360 2.763 17890 15311 1 20 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.757 -1.732 17890 15312 1 20 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.365 4.216 17890 15313 1 20 . 1 1 31 31 LEU H H 31 8.856 8.856 7.545 1.311 17890 15314 1 20 . 1 1 32 32 SER N N 32 116.890 116.890 114.149 2.741 17890 15315 1 20 . 1 1 32 32 SER HA H 32 5.365 5.365 5.078 0.287 17890 15316 1 20 . 1 1 32 32 SER CA C 32 57.269 57.269 56.068 1.201 17890 15317 1 20 . 1 1 32 32 SER CB C 32 62.213 62.213 64.785 -2.572 17890 15318 1 20 . 1 1 32 32 SER H H 32 9.307 9.307 8.504 0.803 17890 15319 1 20 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.425 -0.545 17890 15320 1 20 . 1 1 33 33 PRO C C 33 175.137 175.137 177.009 -1.872 17890 15321 1 20 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.101 1.184 17890 15322 1 20 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.432 0.599 17890 15323 1 20 . 1 1 34 34 ARG N N 34 110.279 110.279 117.939 -7.660 17890 15324 1 20 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.262 0.230 17890 15325 1 20 . 1 1 34 34 ARG C C 34 176.844 176.844 177.553 -0.709 17890 15326 1 20 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.569 -1.133 17890 15327 1 20 . 1 1 34 34 ARG CB C 34 30.584 30.584 29.587 0.997 17890 15328 1 20 . 1 1 34 34 ARG H H 34 7.257 7.257 7.423 -0.166 17890 15329 1 20 . 1 1 35 35 GLY N N 35 110.288 110.288 108.042 2.246 17890 15330 1 20 . 1 1 35 35 GLY C C 35 173.336 173.336 173.942 -0.606 17890 15331 1 20 . 1 1 35 35 GLY CA C 35 47.030 47.030 45.219 1.811 17890 15332 1 20 . 1 1 35 35 GLY H H 35 8.589 8.589 7.948 0.641 17890 15333 1 20 . 1 1 36 36 GLU N N 36 116.838 116.838 117.700 -0.862 17890 15334 1 20 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.724 -0.376 17890 15335 1 20 . 1 1 36 36 GLU C C 36 176.915 176.915 175.452 1.463 17890 15336 1 20 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.325 0.582 17890 15337 1 20 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.242 -1.827 17890 15338 1 20 . 1 1 36 36 GLU H H 36 7.769 7.769 7.762 0.007 17890 15339 1 20 . 1 1 37 37 LYS N N 37 123.775 123.775 120.275 3.500 17890 15340 1 20 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.198 0.225 17890 15341 1 20 . 1 1 37 37 LYS C C 37 176.067 176.067 175.959 0.108 17890 15342 1 20 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.016 -0.115 17890 15343 1 20 . 1 1 37 37 LYS CB C 37 33.674 33.674 33.096 0.578 17890 15344 1 20 . 1 1 37 37 LYS H H 37 8.667 8.667 8.611 0.056 17890 15345 1 20 . 1 1 38 38 LEU N N 38 126.658 126.658 122.622 4.036 17890 15346 1 20 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.958 -0.731 17890 15347 1 20 . 1 1 38 38 LEU C C 38 174.332 174.332 175.849 -1.517 17890 15348 1 20 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.673 -0.331 17890 15349 1 20 . 1 1 38 38 LEU CB C 38 41.651 41.651 41.811 -0.160 17890 15350 1 20 . 1 1 38 38 LEU H H 38 10.455 10.455 8.796 1.659 17890 15351 1 20 . 1 1 39 39 ALA N N 39 127.018 127.018 124.281 2.737 17890 15352 1 20 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.209 0.020 17890 15353 1 20 . 1 1 39 39 ALA C C 39 178.694 178.694 176.647 2.047 17890 15354 1 20 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.690 -0.465 17890 15355 1 20 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.736 0.613 17890 15356 1 20 . 1 1 39 39 ALA H H 39 8.773 8.773 8.641 0.132 17890 15357 1 20 . 1 1 40 40 LEU N N 40 126.771 126.771 124.361 2.410 17890 15358 1 20 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.627 -0.273 17890 15359 1 20 . 1 1 40 40 LEU C C 40 178.309 178.309 176.633 1.676 17890 15360 1 20 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.074 0.771 17890 15361 1 20 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.856 0.467 17890 15362 1 20 . 1 1 40 40 LEU H H 40 9.665 9.665 8.720 0.945 17890 15363 1 20 . 1 1 41 41 THR N N 41 126.578 126.578 124.683 1.895 17890 15364 1 20 . 1 1 41 41 THR HA H 41 4.916 4.916 5.215 -0.299 17890 15365 1 20 . 1 1 41 41 THR C C 41 172.547 172.547 173.513 -0.966 17890 15366 1 20 . 1 1 41 41 THR CA C 41 63.253 63.253 61.789 1.464 17890 15367 1 20 . 1 1 41 41 THR CB C 41 71.832 71.832 70.640 1.192 17890 15368 1 20 . 1 1 41 41 THR H H 41 9.802 9.802 9.108 0.694 17890 15369 1 20 . 1 1 42 42 TYR N N 42 130.506 130.506 129.622 0.884 17890 15370 1 20 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.593 0.509 17890 15371 1 20 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.906 -3.920 17890 15372 1 20 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.611 -0.456 17890 15373 1 20 . 1 1 42 42 TYR H H 42 9.428 9.428 8.935 0.493 17890 15374 1 20 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.325 0.165 17890 15375 1 20 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.184 0.389 17890 15376 1 20 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.179 0.465 17890 15377 1 20 . 1 1 44 44 GLY N N 44 113.736 113.736 104.188 9.548 17890 15378 1 20 . 1 1 44 44 GLY C C 44 171.790 171.790 173.531 -1.741 17890 15379 1 20 . 1 1 44 44 GLY CA C 44 45.716 45.716 45.144 0.572 17890 15380 1 20 . 1 1 44 44 GLY H H 44 8.337 8.337 7.720 0.617 17890 15381 1 20 . 1 1 45 45 ARG N N 45 113.899 113.899 116.494 -2.595 17890 15382 1 20 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.544 0.032 17890 15383 1 20 . 1 1 45 45 ARG C C 45 175.151 175.151 173.706 1.445 17890 15384 1 20 . 1 1 45 45 ARG CA C 45 54.165 54.165 53.961 0.204 17890 15385 1 20 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.819 1.400 17890 15386 1 20 . 1 1 45 45 ARG H H 45 6.463 6.463 7.325 -0.862 17890 15387 1 20 . 1 1 46 46 GLN N N 46 119.000 119.000 118.688 0.312 17890 15388 1 20 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.519 -0.070 17890 15389 1 20 . 1 1 46 46 GLN C C 46 177.282 177.282 176.576 0.706 17890 15390 1 20 . 1 1 46 46 GLN CA C 46 56.613 56.613 54.871 1.742 17890 15391 1 20 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.463 1.033 17890 15392 1 20 . 1 1 46 46 GLN H H 46 8.683 8.683 8.473 0.210 17890 15393 1 20 . 1 1 47 47 ARG N N 47 113.526 113.526 120.332 -6.806 17890 15394 1 20 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.048 -0.518 17890 15395 1 20 . 1 1 47 47 ARG C C 47 174.130 174.130 174.561 -0.431 17890 15396 1 20 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.255 1.561 17890 15397 1 20 . 1 1 47 47 ARG CB C 47 29.070 29.070 28.271 0.799 17890 15398 1 20 . 1 1 47 47 ARG H H 47 9.677 9.677 8.644 1.033 17890 15399 1 20 . 1 1 48 48 THR N N 48 114.672 114.672 114.456 0.216 17890 15400 1 20 . 1 1 48 48 THR HA H 48 4.938 4.938 4.656 0.282 17890 15401 1 20 . 1 1 48 48 THR CA C 48 59.987 59.987 59.072 0.915 17890 15402 1 20 . 1 1 48 48 THR CB C 48 71.947 71.947 71.081 0.866 17890 15403 1 20 . 1 1 48 48 THR H H 48 8.104 8.104 7.626 0.478 17890 15404 1 20 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.533 -0.165 17890 15405 1 20 . 1 1 49 49 PRO C C 49 175.651 175.651 176.274 -0.623 17890 15406 1 20 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.336 0.845 17890 15407 1 20 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.167 0.530 17890 15408 1 20 . 1 1 50 50 VAL N N 50 122.562 122.562 119.426 3.136 17890 15409 1 20 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.302 -0.355 17890 15410 1 20 . 1 1 50 50 VAL C C 50 174.493 174.493 175.652 -1.159 17890 15411 1 20 . 1 1 50 50 VAL CA C 50 63.811 63.811 60.716 3.095 17890 15412 1 20 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.306 -2.138 17890 15413 1 20 . 1 1 50 50 VAL H H 50 8.123 8.123 7.888 0.235 17890 15414 1 20 . 1 1 51 51 THR N N 51 113.549 113.549 117.667 -4.118 17890 15415 1 20 . 1 1 51 51 THR HA H 51 5.372 5.372 4.923 0.449 17890 15416 1 20 . 1 1 51 51 THR C C 51 174.841 174.841 172.532 2.309 17890 15417 1 20 . 1 1 51 51 THR CA C 51 59.196 59.196 60.767 -1.571 17890 15418 1 20 . 1 1 51 51 THR CB C 51 72.703 72.703 72.316 0.387 17890 15419 1 20 . 1 1 51 51 THR H H 51 7.057 7.057 8.247 -1.190 17890 15420 1 20 . 1 1 52 52 VAL N N 52 107.374 107.374 120.976 -13.602 17890 15421 1 20 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.087 0.427 17890 15422 1 20 . 1 1 52 52 VAL C C 52 175.697 175.697 173.896 1.801 17890 15423 1 20 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.443 -0.971 17890 15424 1 20 . 1 1 52 52 VAL CB C 52 34.774 34.774 34.764 0.010 17890 15425 1 20 . 1 1 52 52 VAL H H 52 8.062 8.062 8.732 -0.670 17890 15426 1 20 . 1 1 53 53 SER N N 53 114.662 114.662 122.095 -7.433 17890 15427 1 20 . 1 1 53 53 SER HA H 53 4.690 4.690 4.969 -0.279 17890 15428 1 20 . 1 1 53 53 SER CA C 53 56.828 56.828 56.645 0.183 17890 15429 1 20 . 1 1 53 53 SER CB C 53 64.789 64.789 65.799 -1.010 17890 15430 1 20 . 1 1 53 53 SER H H 53 8.681 8.681 8.964 -0.283 17890 15431 1 20 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.711 0.065 17890 15432 1 20 . 1 1 54 54 PRO C C 54 177.724 177.724 176.190 1.534 17890 15433 1 20 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.205 0.220 17890 15434 1 20 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.358 -0.260 17890 15435 1 20 . 1 1 55 55 LEU N N 55 128.655 128.655 121.355 7.300 17890 15436 1 20 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.613 -0.086 17890 15437 1 20 . 1 1 55 55 LEU C C 55 178.696 178.696 176.048 2.648 17890 15438 1 20 . 1 1 55 55 LEU CA C 55 56.246 56.246 54.335 1.911 17890 15439 1 20 . 1 1 55 55 LEU CB C 55 43.606 43.606 44.679 -1.073 17890 15440 1 20 . 1 1 55 55 LEU H H 55 8.675 8.675 8.287 0.388 17890 15441 1 20 . 1 1 56 56 ASP N N 56 126.651 126.651 125.252 1.399 17890 15442 1 20 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.829 -0.120 17890 15443 1 20 . 1 1 56 56 ASP C C 56 177.729 177.729 176.820 0.909 17890 15444 1 20 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.604 -0.981 17890 15445 1 20 . 1 1 56 56 ASP CB C 56 41.632 41.632 44.453 -2.821 17890 15446 1 20 . 1 1 56 56 ASP H H 56 9.683 9.683 9.659 0.024 17890 15447 1 20 . 1 1 57 57 GLY N N 57 109.299 109.299 109.499 -0.200 17890 15448 1 20 . 1 1 57 57 GLY C C 57 174.558 174.558 174.242 0.316 17890 15449 1 20 . 1 1 57 57 GLY CA C 57 45.955 45.955 44.921 1.034 17890 15450 1 20 . 1 1 57 57 GLY H H 57 8.157 8.157 8.884 -0.727 17890 15451 1 20 . 1 1 58 58 SER N N 58 116.740 116.740 115.928 0.812 17890 15452 1 20 . 1 1 58 58 SER HA H 58 4.288 4.288 4.568 -0.280 17890 15453 1 20 . 1 1 58 58 SER C C 58 177.252 177.252 175.766 1.486 17890 15454 1 20 . 1 1 58 58 SER CA C 58 58.737 58.737 57.475 1.262 17890 15455 1 20 . 1 1 58 58 SER CB C 58 64.576 64.576 64.669 -0.093 17890 15456 1 20 . 1 1 58 58 SER H H 58 8.328 8.328 7.799 0.529 17890 15457 1 20 . 1 1 59 59 SER N N 59 119.768 119.768 116.378 3.390 17890 15458 1 20 . 1 1 59 59 SER HA H 59 4.046 4.046 4.148 -0.102 17890 15459 1 20 . 1 1 59 59 SER C C 59 176.671 176.671 175.661 1.010 17890 15460 1 20 . 1 1 59 59 SER CA C 59 61.691 61.691 60.147 1.544 17890 15461 1 20 . 1 1 59 59 SER CB C 59 63.154 63.154 62.909 0.245 17890 15462 1 20 . 1 1 59 59 SER H H 59 9.020 9.020 8.742 0.278 17890 15463 1 20 . 1 1 60 60 GLU N N 60 119.133 119.133 119.803 -0.670 17890 15464 1 20 . 1 1 60 60 GLU HA H 60 4.186 4.186 3.984 0.202 17890 15465 1 20 . 1 1 60 60 GLU C C 60 177.435 177.435 176.979 0.456 17890 15466 1 20 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.398 1.635 17890 15467 1 20 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.704 -1.478 17890 15468 1 20 . 1 1 60 60 GLU H H 60 8.832 8.832 7.946 0.886 17890 15469 1 20 . 1 1 61 61 GLN N N 61 118.818 118.818 113.712 5.106 17890 15470 1 20 . 1 1 61 61 GLN HA H 61 5.177 5.177 5.013 0.165 17890 15471 1 20 . 1 1 61 61 GLN C C 61 173.254 173.254 174.865 -1.611 17890 15472 1 20 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.443 -0.070 17890 15473 1 20 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.183 -2.261 17890 15474 1 20 . 1 1 61 61 GLN H H 61 7.648 7.648 7.505 0.143 17890 15475 1 20 . 1 1 62 62 ALA N N 62 122.562 122.562 122.509 0.053 17890 15476 1 20 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.607 0.457 17890 15477 1 20 . 1 1 62 62 ALA C C 62 176.637 176.637 174.999 1.638 17890 15478 1 20 . 1 1 62 62 ALA CA C 62 51.179 51.179 50.931 0.248 17890 15479 1 20 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.617 -1.022 17890 15480 1 20 . 1 1 62 62 ALA H H 62 7.315 7.315 6.880 0.435 17890 15481 1 20 . 1 1 63 63 TRP N N 63 124.787 124.787 119.405 5.382 17890 15482 1 20 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.407 -0.443 17890 15483 1 20 . 1 1 63 63 TRP C C 63 174.351 174.351 175.357 -1.006 17890 15484 1 20 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.110 -0.208 17890 15485 1 20 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.821 -1.704 17890 15486 1 20 . 1 1 63 63 TRP H H 63 9.544 9.544 8.971 0.573 17890 15487 1 20 . 1 1 64 64 ILE N N 64 122.482 122.482 119.168 3.314 17890 15488 1 20 . 1 1 64 64 ILE HA H 64 4.694 4.694 5.007 -0.313 17890 15489 1 20 . 1 1 64 64 ILE C C 64 177.078 177.078 174.287 2.791 17890 15490 1 20 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.485 0.546 17890 15491 1 20 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.715 -1.346 17890 15492 1 20 . 1 1 64 64 ILE H H 64 10.235 10.235 9.388 0.847 17890 15493 1 20 . 1 1 65 65 LEU N N 65 132.183 132.183 128.456 3.727 17890 15494 1 20 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.499 -0.034 17890 15495 1 20 . 1 1 65 65 LEU C C 65 177.048 177.048 174.475 2.573 17890 15496 1 20 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.852 0.497 17890 15497 1 20 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.020 -3.676 17890 15498 1 20 . 1 1 65 65 LEU H H 65 9.432 9.432 9.289 0.143 17890 15499 1 20 . 1 1 66 66 ARG N N 66 120.807 120.807 125.904 -5.097 17890 15500 1 20 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.945 -0.057 17890 15501 1 20 . 1 1 66 66 ARG C C 66 175.275 175.275 174.364 0.911 17890 15502 1 20 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.579 0.476 17890 15503 1 20 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.397 -1.406 17890 15504 1 20 . 1 1 66 66 ARG H H 66 8.491 8.491 8.579 -0.088 17890 15505 1 20 . 1 1 67 67 SER N N 67 119.709 119.709 117.875 1.834 17890 15506 1 20 . 1 1 67 67 SER HA H 67 3.186 3.186 3.250 -0.064 17890 15507 1 20 . 1 1 67 67 SER C C 67 174.508 174.508 173.543 0.965 17890 15508 1 20 . 1 1 67 67 SER CA C 67 58.521 58.521 58.727 -0.206 17890 15509 1 20 . 1 1 67 67 SER CB C 67 62.590 62.590 63.088 -0.498 17890 15510 1 20 . 1 1 67 67 SER H H 67 8.557 8.557 8.602 -0.045 17890 15511 1 20 . 1 1 68 68 TYR N N 68 131.011 131.011 127.657 3.354 17890 15512 1 20 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.636 -0.188 17890 15513 1 20 . 1 1 68 68 TYR C C 68 174.687 174.687 174.816 -0.129 17890 15514 1 20 . 1 1 68 68 TYR CA C 68 59.765 59.765 58.769 0.996 17890 15515 1 20 . 1 1 68 68 TYR CB C 68 38.988 38.988 40.869 -1.881 17890 15516 1 20 . 1 1 68 68 TYR H H 68 8.531 8.531 8.659 -0.128 17890 15517 1 20 . 1 1 69 69 ASP N N 69 117.066 117.066 120.059 -2.993 17890 15518 1 20 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.856 -0.231 17890 15519 1 20 . 1 1 69 69 ASP C C 69 176.455 176.455 176.301 0.154 17890 15520 1 20 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.993 -0.902 17890 15521 1 20 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.952 -0.805 17890 15522 1 20 . 1 1 69 69 ASP H H 69 7.122 7.122 7.705 -0.583 17890 15523 1 20 . 1 1 70 70 SER N N 70 122.869 122.869 119.726 3.143 17890 15524 1 20 . 1 1 70 70 SER HA H 70 4.270 4.270 4.036 0.234 17890 15525 1 20 . 1 1 70 70 SER C C 70 177.010 177.010 176.054 0.956 17890 15526 1 20 . 1 1 70 70 SER CA C 70 60.837 60.837 61.633 -0.796 17890 15527 1 20 . 1 1 70 70 SER CB C 70 62.722 62.722 63.266 -0.544 17890 15528 1 20 . 1 1 70 70 SER H H 70 8.757 8.757 8.802 -0.045 17890 15529 1 20 . 1 1 71 71 ASN N N 71 119.873 119.873 119.329 0.544 17890 15530 1 20 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.601 -0.030 17890 15531 1 20 . 1 1 71 71 ASN C C 71 176.226 176.226 175.940 0.286 17890 15532 1 20 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.376 0.338 17890 15533 1 20 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.487 0.153 17890 15534 1 20 . 1 1 71 71 ASN H H 71 8.342 8.342 8.656 -0.314 17890 15535 1 20 . 1 1 72 72 SER N N 72 112.202 112.202 113.193 -0.991 17890 15536 1 20 . 1 1 72 72 SER HA H 72 4.567 4.567 4.696 -0.129 17890 15537 1 20 . 1 1 72 72 SER C C 72 173.789 173.789 173.555 0.234 17890 15538 1 20 . 1 1 72 72 SER CA C 72 57.816 57.816 57.635 0.181 17890 15539 1 20 . 1 1 72 72 SER CB C 72 63.935 63.935 64.429 -0.494 17890 15540 1 20 . 1 1 72 72 SER H H 72 7.560 7.560 7.789 -0.229 17890 15541 1 20 . 1 1 73 73 ASN N N 73 117.437 117.437 118.749 -1.312 17890 15542 1 20 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.462 0.072 17890 15543 1 20 . 1 1 73 73 ASN C C 73 173.647 173.647 174.152 -0.505 17890 15544 1 20 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.483 0.041 17890 15545 1 20 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.064 0.149 17890 15546 1 20 . 1 1 73 73 ASN H H 73 7.940 7.940 8.005 -0.065 17890 15547 1 20 . 1 1 74 74 THR N N 74 104.227 104.227 109.456 -5.229 17890 15548 1 20 . 1 1 74 74 THR HA H 74 5.477 5.477 5.140 0.337 17890 15549 1 20 . 1 1 74 74 THR C C 74 176.824 176.824 174.008 2.816 17890 15550 1 20 . 1 1 74 74 THR CA C 74 59.768 59.768 61.536 -1.768 17890 15551 1 20 . 1 1 74 74 THR CB C 74 71.985 71.985 70.142 1.843 17890 15552 1 20 . 1 1 74 74 THR H H 74 7.737 7.737 7.819 -0.082 17890 15553 1 20 . 1 1 75 75 TRP N N 75 124.636 124.636 124.088 0.548 17890 15554 1 20 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.408 -0.201 17890 15555 1 20 . 1 1 75 75 TRP C C 75 175.876 175.876 176.180 -0.304 17890 15556 1 20 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.116 1.490 17890 15557 1 20 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.578 -0.062 17890 15558 1 20 . 1 1 75 75 TRP H H 75 9.442 9.442 9.263 0.179 17890 15559 1 20 . 1 1 76 76 THR N N 76 110.544 110.544 114.583 -4.039 17890 15560 1 20 . 1 1 76 76 THR HA H 76 5.129 5.129 4.916 0.213 17890 15561 1 20 . 1 1 76 76 THR C C 76 174.506 174.506 174.136 0.370 17890 15562 1 20 . 1 1 76 76 THR CA C 76 60.561 60.561 61.737 -1.176 17890 15563 1 20 . 1 1 76 76 THR CB C 76 71.688 71.688 70.210 1.478 17890 15564 1 20 . 1 1 76 76 THR H H 76 9.415 9.415 9.329 0.086 17890 15565 1 20 . 1 1 77 77 ILE N N 77 121.567 121.567 123.251 -1.684 17890 15566 1 20 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.278 -0.139 17890 15567 1 20 . 1 1 77 77 ILE C C 77 176.148 176.148 174.975 1.173 17890 15568 1 20 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.721 1.987 17890 15569 1 20 . 1 1 77 77 ILE CB C 77 40.987 40.987 40.092 0.895 17890 15570 1 20 . 1 1 77 77 ILE H H 77 9.255 9.255 8.678 0.577 17890 15571 1 20 . 1 1 78 78 SER N N 78 122.269 122.269 120.512 1.757 17890 15572 1 20 . 1 1 78 78 SER HA H 78 5.601 5.601 5.257 0.344 17890 15573 1 20 . 1 1 78 78 SER CA C 78 55.835 55.835 55.560 0.274 17890 15574 1 20 . 1 1 78 78 SER CB C 78 65.858 65.858 65.188 0.670 17890 15575 1 20 . 1 1 78 78 SER H H 78 9.226 9.226 8.876 0.350 17890 15576 1 20 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.262 -0.398 17890 15577 1 20 . 1 1 79 79 PRO C C 79 178.175 178.175 178.362 -0.187 17890 15578 1 20 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.018 0.866 17890 15579 1 20 . 1 1 79 79 PRO CB C 79 30.272 30.272 32.067 -1.795 17890 15580 1 20 . 1 1 80 80 VAL N N 80 121.906 121.906 118.051 3.855 17890 15581 1 20 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.808 -0.227 17890 15582 1 20 . 1 1 80 80 VAL C C 80 177.751 177.751 176.662 1.089 17890 15583 1 20 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.566 1.501 17890 15584 1 20 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.253 0.232 17890 15585 1 20 . 1 1 80 80 VAL H H 80 7.328 7.328 8.030 -0.702 17890 15586 1 20 . 1 1 81 81 GLY N N 81 104.643 104.643 107.524 -2.881 17890 15587 1 20 . 1 1 81 81 GLY C C 81 174.979 174.979 174.426 0.553 17890 15588 1 20 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.271 -0.183 17890 15589 1 20 . 1 1 81 81 GLY H H 81 8.949 8.949 8.316 0.633 17890 15590 1 20 . 1 1 82 82 SER N N 82 111.865 111.865 115.984 -4.119 17890 15591 1 20 . 1 1 82 82 SER HA H 82 4.646 4.646 4.814 -0.168 17890 15592 1 20 . 1 1 82 82 SER CA C 82 55.441 55.441 55.059 0.382 17890 15593 1 20 . 1 1 82 82 SER CB C 82 62.277 62.277 63.849 -1.572 17890 15594 1 20 . 1 1 82 82 SER H H 82 6.968 6.968 7.239 -0.271 17890 15595 1 20 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.457 -0.110 17890 15596 1 20 . 1 1 83 83 PRO C C 83 176.660 176.660 176.875 -0.215 17890 15597 1 20 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.395 0.808 17890 15598 1 20 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.842 0.977 17890 15599 1 20 . 1 1 84 84 ASN N N 84 116.542 116.542 115.664 0.878 17890 15600 1 20 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.639 0.362 17890 15601 1 20 . 1 1 84 84 ASN C C 84 175.825 175.825 175.105 0.720 17890 15602 1 20 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.850 -0.959 17890 15603 1 20 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.313 0.431 17890 15604 1 20 . 1 1 84 84 ASN H H 84 8.502 8.502 8.484 0.018 17890 15605 1 20 . 1 1 85 85 SER N N 85 114.633 114.633 113.993 0.640 17890 15606 1 20 . 1 1 85 85 SER HA H 85 4.624 4.624 4.842 -0.218 17890 15607 1 20 . 1 1 85 85 SER C C 85 172.963 172.963 172.318 0.645 17890 15608 1 20 . 1 1 85 85 SER CA C 85 59.210 59.210 57.732 1.478 17890 15609 1 20 . 1 1 85 85 SER CB C 85 64.697 64.697 66.430 -1.733 17890 15610 1 20 . 1 1 85 85 SER H H 85 7.980 7.980 7.857 0.123 17890 15611 1 20 . 1 1 86 86 GLN N N 86 119.016 119.016 118.768 0.248 17890 15612 1 20 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.289 0.157 17890 15613 1 20 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.292 0.160 17890 15614 1 20 . 1 1 86 86 GLN CB C 86 34.398 34.398 33.881 0.517 17890 15615 1 20 . 1 1 86 86 GLN H H 86 9.399 9.399 8.989 0.410 17890 15616 1 20 . 1 1 87 87 ILE N N 87 119.691 119.691 120.980 -1.289 17890 15617 1 20 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.126 -0.551 17890 15618 1 20 . 1 1 87 87 ILE C C 87 176.505 176.505 175.833 0.672 17890 15619 1 20 . 1 1 87 87 ILE CA C 87 63.494 63.494 59.156 4.338 17890 15620 1 20 . 1 1 87 87 ILE CB C 87 38.197 38.197 39.544 -1.347 17890 15621 1 20 . 1 1 87 87 ILE H H 87 8.970 8.970 8.283 0.687 17890 15622 1 20 . 1 1 88 88 GLY N N 88 118.378 118.378 114.816 3.562 17890 15623 1 20 . 1 1 88 88 GLY C C 88 171.397 171.397 171.667 -0.270 17890 15624 1 20 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.917 -1.313 17890 15625 1 20 . 1 1 88 88 GLY H H 88 9.752 9.752 9.058 0.694 17890 15626 1 20 . 1 1 89 89 TRP N N 89 122.749 122.749 121.727 1.022 17890 15627 1 20 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.370 -0.772 17890 15628 1 20 . 1 1 89 89 TRP C C 89 175.924 175.924 174.687 1.237 17890 15629 1 20 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.204 0.079 17890 15630 1 20 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.567 -2.481 17890 15631 1 20 . 1 1 89 89 TRP H H 89 8.215 8.215 8.194 0.021 17890 15632 1 20 . 1 1 90 90 GLY N N 90 116.305 116.305 109.961 6.344 17890 15633 1 20 . 1 1 90 90 GLY C C 90 173.725 173.725 172.353 1.372 17890 15634 1 20 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.567 0.488 17890 15635 1 20 . 1 1 90 90 GLY H H 90 8.922 8.922 8.136 0.786 17890 15636 1 20 . 1 1 91 91 ALA N N 91 123.795 123.795 122.125 1.670 17890 15637 1 20 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.170 0.073 17890 15638 1 20 . 1 1 91 91 ALA C C 91 178.510 178.510 178.901 -0.391 17890 15639 1 20 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.456 0.034 17890 15640 1 20 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.752 -0.343 17890 15641 1 20 . 1 1 91 91 ALA H H 91 8.367 8.367 8.134 0.233 17890 15642 1 20 . 1 1 92 92 GLY N N 92 108.871 108.871 112.698 -3.827 17890 15643 1 20 . 1 1 92 92 GLY C C 92 174.528 174.528 174.856 -0.328 17890 15644 1 20 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.721 0.537 17890 15645 1 20 . 1 1 92 92 GLY H H 92 8.776 8.776 8.614 0.162 17890 15646 1 20 . 1 1 93 93 ASN N N 93 114.921 114.921 117.622 -2.701 17890 15647 1 20 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.736 -0.287 17890 15648 1 20 . 1 1 93 93 ASN C C 93 172.774 172.774 173.803 -1.029 17890 15649 1 20 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.382 0.591 17890 15650 1 20 . 1 1 93 93 ASN CB C 93 36.329 36.329 36.952 -0.623 17890 15651 1 20 . 1 1 93 93 ASN H H 93 8.647 8.647 8.392 0.255 17890 15652 1 20 . 1 1 94 94 VAL N N 94 112.437 112.437 118.038 -5.601 17890 15653 1 20 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.633 0.432 17890 15654 1 20 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.001 -1.086 17890 15655 1 20 . 1 1 94 94 VAL CB C 94 34.155 34.155 35.986 -1.831 17890 15656 1 20 . 1 1 94 94 VAL H H 94 6.989 6.989 7.536 -0.547 17890 15657 1 20 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.937 -0.009 17890 15658 1 20 . 1 1 95 95 PRO C C 95 176.041 176.041 175.779 0.262 17890 15659 1 20 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.734 -1.533 17890 15660 1 20 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.684 -0.959 17890 15661 1 20 . 1 1 96 96 VAL N N 96 113.564 113.564 114.723 -1.159 17890 15662 1 20 . 1 1 96 96 VAL HA H 96 4.735 4.735 5.034 -0.299 17890 15663 1 20 . 1 1 96 96 VAL C C 96 173.656 173.656 175.068 -1.412 17890 15664 1 20 . 1 1 96 96 VAL CA C 96 58.853 58.853 58.867 -0.014 17890 15665 1 20 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.766 1.387 17890 15666 1 20 . 1 1 96 96 VAL H H 96 8.199 8.199 8.797 -0.598 17890 15667 1 20 . 1 1 97 97 VAL N N 97 122.328 122.328 122.604 -0.276 17890 15668 1 20 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.540 0.091 17890 15669 1 20 . 1 1 97 97 VAL C C 97 174.776 174.776 175.254 -0.478 17890 15670 1 20 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.102 0.555 17890 15671 1 20 . 1 1 97 97 VAL CB C 97 31.128 31.128 32.049 -0.921 17890 15672 1 20 . 1 1 97 97 VAL H H 97 8.957 8.957 8.038 0.919 17890 15673 1 20 . 1 1 98 98 LEU N N 98 130.258 130.258 125.001 5.257 17890 15674 1 20 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.930 0.120 17890 15675 1 20 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.382 1.441 17890 15676 1 20 . 1 1 98 98 LEU CB C 98 46.118 46.118 44.860 1.258 17890 15677 1 20 . 1 1 98 98 LEU H H 98 9.245 9.245 8.938 0.307 17890 15678 1 20 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.769 0.010 17890 15679 1 20 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.112 0.376 17890 15680 1 20 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.136 -0.682 17890 15681 1 20 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.604 -0.619 17890 15682 1 20 . 1 1 100 100 PRO C C 100 177.309 177.309 175.904 1.405 17890 15683 1 20 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.138 0.686 17890 15684 1 20 . 1 1 100 100 PRO CB C 100 32.105 32.105 32.152 -0.047 17890 15685 1 20 . 1 1 101 101 ASN N N 101 119.284 119.284 124.605 -5.321 17890 15686 1 20 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.629 -0.087 17890 15687 1 20 . 1 1 101 101 ASN C C 101 171.920 171.920 174.320 -2.400 17890 15688 1 20 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.877 -0.677 17890 15689 1 20 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.369 -1.744 17890 15690 1 20 . 1 1 101 101 ASN H H 101 7.273 7.273 9.017 -1.744 17890 15691 1 20 . 1 1 102 102 ASN N N 102 115.674 115.674 117.364 -1.690 17890 15692 1 20 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.680 -0.762 17890 15693 1 20 . 1 1 102 102 ASN C C 102 173.264 173.264 174.000 -0.736 17890 15694 1 20 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.857 1.182 17890 15695 1 20 . 1 1 102 102 ASN CB C 102 36.982 36.982 37.986 -1.004 17890 15696 1 20 . 1 1 102 102 ASN H H 102 8.197 8.197 7.902 0.295 17890 15697 1 20 . 1 1 103 103 TYR N N 103 118.775 118.775 120.798 -2.023 17890 15698 1 20 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.394 0.091 17890 15699 1 20 . 1 1 103 103 TYR C C 103 175.248 175.248 175.149 0.099 17890 15700 1 20 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.336 -1.846 17890 15701 1 20 . 1 1 103 103 TYR CB C 103 37.532 37.532 37.980 -0.448 17890 15702 1 20 . 1 1 103 103 TYR H H 103 7.745 7.745 7.542 0.203 17890 15703 1 20 . 1 1 104 104 VAL N N 104 116.205 116.205 115.302 0.903 17890 15704 1 20 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.863 0.114 17890 15705 1 20 . 1 1 104 104 VAL C C 104 174.361 174.361 173.735 0.626 17890 15706 1 20 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.776 -1.525 17890 15707 1 20 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.538 0.005 17890 15708 1 20 . 1 1 104 104 VAL H H 104 7.498 7.498 7.922 -0.424 17890 15709 1 20 . 1 1 105 105 TRP N N 105 119.557 119.557 119.393 0.164 17890 15710 1 20 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.120 -0.245 17890 15711 1 20 . 1 1 105 105 TRP C C 105 175.526 175.526 176.106 -0.580 17890 15712 1 20 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.429 -0.545 17890 15713 1 20 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.848 -0.309 17890 15714 1 20 . 1 1 105 105 TRP H H 105 8.926 8.926 8.878 0.048 17890 15715 1 20 . 1 1 106 106 THR N N 106 120.480 120.480 119.964 0.516 17890 15716 1 20 . 1 1 106 106 THR HA H 106 4.966 4.966 4.919 0.047 17890 15717 1 20 . 1 1 106 106 THR C C 106 174.177 174.177 173.962 0.215 17890 15718 1 20 . 1 1 106 106 THR CA C 106 62.091 62.091 63.744 -1.653 17890 15719 1 20 . 1 1 106 106 THR CB C 106 69.649 69.649 69.469 0.180 17890 15720 1 20 . 1 1 106 106 THR H H 106 9.525 9.525 9.126 0.399 17890 15721 1 20 . 1 1 107 107 LEU N N 107 127.146 127.146 128.214 -1.068 17890 15722 1 20 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.077 -0.250 17890 15723 1 20 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.435 0.274 17890 15724 1 20 . 1 1 107 107 LEU CB C 107 41.523 41.523 42.944 -1.421 17890 15725 1 20 . 1 1 107 107 LEU H H 107 7.591 7.591 8.783 -1.192 17890 15726 1 20 . 1 1 108 108 THR N N 108 119.928 119.928 120.582 -0.654 17890 15727 1 20 . 1 1 108 108 THR HA H 108 4.411 4.411 4.676 -0.265 17890 15728 1 20 . 1 1 108 108 THR C C 108 173.319 173.319 173.381 -0.062 17890 15729 1 20 . 1 1 108 108 THR CA C 108 62.243 62.243 61.019 1.224 17890 15730 1 20 . 1 1 108 108 THR CB C 108 70.138 70.138 71.466 -1.328 17890 15731 1 20 . 1 1 108 108 THR H H 108 8.141 8.141 8.855 -0.714 17890 15732 1 20 . 1 1 109 109 LEU N N 109 130.557 130.557 128.482 2.075 17890 15733 1 20 . 1 1 109 109 LEU HA H 109 3.545 3.545 4.060 -0.515 17890 15734 1 20 . 1 1 109 109 LEU C C 109 175.217 175.217 177.149 -1.932 17890 15735 1 20 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.458 -0.172 17890 15736 1 20 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.472 -1.866 17890 15737 1 20 . 1 1 109 109 LEU H H 109 8.924 8.924 8.614 0.310 17890 15738 1 20 . 1 1 110 110 THR N N 110 120.160 120.160 113.603 6.557 17890 15739 1 20 . 1 1 110 110 THR HA H 110 4.911 4.911 4.626 0.285 17890 15740 1 20 . 1 1 110 110 THR CA C 110 60.141 60.141 60.546 -0.405 17890 15741 1 20 . 1 1 110 110 THR CB C 110 72.785 72.785 70.682 2.103 17890 15742 1 20 . 1 1 110 110 THR H H 110 7.677 7.677 8.438 -0.761 17890 15743 1 20 . 1 1 111 111 SER HA H 111 4.204 4.204 4.263 -0.059 17890 15744 1 20 . 1 1 111 111 SER C C 111 174.755 174.755 175.187 -0.432 17890 15745 1 20 . 1 1 111 111 SER CA C 111 60.710 60.710 59.543 1.167 17890 15746 1 20 . 1 1 111 111 SER CB C 111 62.660 62.660 62.930 -0.270 17890 15747 1 20 . 1 1 112 112 GLY N N 112 107.313 107.313 108.410 -1.097 17890 15748 1 20 . 1 1 112 112 GLY C C 112 173.023 173.023 172.758 0.265 17890 15749 1 20 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.117 -0.967 17890 15750 1 20 . 1 1 112 112 GLY H H 112 8.249 8.249 7.579 0.670 17890 15751 1 20 . 1 1 113 113 GLY N N 113 105.618 105.618 107.721 -2.103 17890 15752 1 20 . 1 1 113 113 GLY C C 113 175.844 175.844 171.945 3.899 17890 15753 1 20 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.547 -2.788 17890 15754 1 20 . 1 1 113 113 GLY H H 113 7.444 7.444 7.297 0.147 17890 15755 1 20 . 1 1 114 114 TYR N N 114 121.548 121.548 118.286 3.262 17890 15756 1 20 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.447 -0.595 17890 15757 1 20 . 1 1 114 114 TYR C C 114 175.605 175.605 174.185 1.420 17890 15758 1 20 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.601 4.662 17890 15759 1 20 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.573 -4.640 17890 15760 1 20 . 1 1 114 114 TYR H H 114 9.677 9.677 8.992 0.685 17890 15761 1 20 . 1 1 115 115 ASN N N 115 123.274 123.274 117.561 5.713 17890 15762 1 20 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.217 -0.119 17890 15763 1 20 . 1 1 115 115 ASN C C 115 174.355 174.355 173.127 1.228 17890 15764 1 20 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.344 -1.298 17890 15765 1 20 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.794 -2.445 17890 15766 1 20 . 1 1 115 115 ASN H H 115 9.350 9.350 9.001 0.349 17890 15767 1 20 . 1 1 116 116 ILE N N 116 130.611 130.611 122.026 8.585 17890 15768 1 20 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.857 -0.618 17890 15769 1 20 . 1 1 116 116 ILE C C 116 173.998 173.998 174.237 -0.239 17890 15770 1 20 . 1 1 116 116 ILE CA C 116 62.199 62.199 59.891 2.308 17890 15771 1 20 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.880 -2.780 17890 15772 1 20 . 1 1 116 116 ILE H H 116 9.473 9.473 8.307 1.166 17890 15773 1 20 . 1 1 117 117 GLN N N 117 121.633 121.633 125.220 -3.587 17890 15774 1 20 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.026 0.909 17890 15775 1 20 . 1 1 117 117 GLN C C 117 177.902 177.902 176.012 1.890 17890 15776 1 20 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.953 -0.633 17890 15777 1 20 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.576 3.881 17890 15778 1 20 . 1 1 117 117 GLN H H 117 8.781 8.781 8.631 0.150 17890 15779 1 20 . 1 1 118 118 ASP N N 118 116.836 116.836 119.812 -2.976 17890 15780 1 20 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.942 0.841 17890 15781 1 20 . 1 1 118 118 ASP C C 118 178.084 178.084 176.631 1.453 17890 15782 1 20 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.211 -1.441 17890 15783 1 20 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.235 -0.867 17890 15784 1 20 . 1 1 118 118 ASP H H 118 9.330 9.330 8.502 0.828 17890 15785 1 20 . 1 1 119 119 GLY N N 119 111.037 111.037 107.803 3.234 17890 15786 1 20 . 1 1 119 119 GLY C C 119 174.196 174.196 175.408 -1.212 17890 15787 1 20 . 1 1 119 119 GLY CA C 119 46.976 46.976 45.069 1.907 17890 15788 1 20 . 1 1 119 119 GLY H H 119 8.986 8.986 8.356 0.630 17890 15789 1 20 . 1 1 120 120 LYS N N 120 114.809 114.809 122.261 -7.452 17890 15790 1 20 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.549 -0.200 17890 15791 1 20 . 1 1 120 120 LYS C C 120 175.174 175.174 175.981 -0.807 17890 15792 1 20 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.073 1.860 17890 15793 1 20 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.475 0.001 17890 15794 1 20 . 1 1 120 120 LYS H H 120 7.045 7.045 8.662 -1.617 17890 15795 1 20 . 1 1 121 121 ARG N N 121 116.291 116.291 113.804 2.487 17890 15796 1 20 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.067 -0.481 17890 15797 1 20 . 1 1 121 121 ARG C C 121 175.097 175.097 177.230 -2.133 17890 15798 1 20 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.206 0.863 17890 15799 1 20 . 1 1 121 121 ARG CB C 121 26.623 26.623 27.163 -0.540 17890 15800 1 20 . 1 1 121 121 ARG H H 121 7.683 7.683 8.485 -0.802 17890 15801 1 20 . 1 1 122 122 THR N N 122 113.730 113.730 109.378 4.352 17890 15802 1 20 . 1 1 122 122 THR HA H 122 4.540 4.540 4.233 0.307 17890 15803 1 20 . 1 1 122 122 THR C C 122 175.302 175.302 174.601 0.701 17890 15804 1 20 . 1 1 122 122 THR CA C 122 62.871 62.871 64.063 -1.192 17890 15805 1 20 . 1 1 122 122 THR CB C 122 71.552 71.552 69.775 1.777 17890 15806 1 20 . 1 1 122 122 THR H H 122 11.059 11.059 8.065 2.994 17890 15807 1 20 . 1 1 123 123 VAL N N 123 118.350 118.350 114.778 3.572 17890 15808 1 20 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.601 0.209 17890 15809 1 20 . 1 1 123 123 VAL C C 123 174.730 174.730 173.795 0.935 17890 15810 1 20 . 1 1 123 123 VAL CA C 123 60.311 60.311 60.263 0.048 17890 15811 1 20 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.943 2.139 17890 15812 1 20 . 1 1 123 123 VAL H H 123 8.181 8.181 7.801 0.380 17890 15813 1 20 . 1 1 124 124 SER N N 124 113.053 113.053 113.862 -0.809 17890 15814 1 20 . 1 1 124 124 SER HA H 124 5.820 5.820 5.162 0.658 17890 15815 1 20 . 1 1 124 124 SER C C 124 175.521 175.521 173.382 2.139 17890 15816 1 20 . 1 1 124 124 SER CA C 124 58.087 58.087 57.052 1.035 17890 15817 1 20 . 1 1 124 124 SER CB C 124 67.405 67.405 65.953 1.452 17890 15818 1 20 . 1 1 124 124 SER H H 124 9.138 9.138 8.652 0.486 17890 15819 1 20 . 1 1 125 125 TRP N N 125 124.900 124.900 124.606 0.294 17890 15820 1 20 . 1 1 125 125 TRP HA H 125 5.610 5.610 4.997 0.613 17890 15821 1 20 . 1 1 125 125 TRP C C 125 178.114 178.114 177.489 0.625 17890 15822 1 20 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.054 -0.580 17890 15823 1 20 . 1 1 125 125 TRP CB C 125 30.023 30.023 28.803 1.220 17890 15824 1 20 . 1 1 125 125 TRP H H 125 8.843 8.843 7.904 0.939 17890 15825 1 20 . 1 1 126 126 SER N N 126 119.243 119.243 113.769 5.474 17890 15826 1 20 . 1 1 126 126 SER HA H 126 5.443 5.443 5.364 0.079 17890 15827 1 20 . 1 1 126 126 SER C C 126 171.668 171.668 172.893 -1.225 17890 15828 1 20 . 1 1 126 126 SER CA C 126 58.696 58.696 57.174 1.522 17890 15829 1 20 . 1 1 126 126 SER CB C 126 66.176 66.176 66.233 -0.057 17890 15830 1 20 . 1 1 126 126 SER H H 126 9.835 9.835 9.244 0.591 17890 15831 1 20 . 1 1 127 127 LEU N N 127 113.708 113.708 117.581 -3.873 17890 15832 1 20 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.660 0.495 17890 15833 1 20 . 1 1 127 127 LEU C C 127 176.563 176.563 176.512 0.051 17890 15834 1 20 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.532 -0.887 17890 15835 1 20 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.252 -1.556 17890 15836 1 20 . 1 1 127 127 LEU H H 127 6.559 6.559 8.322 -1.763 17890 15837 1 20 . 1 1 128 128 ASN N N 128 121.739 121.739 118.136 3.603 17890 15838 1 20 . 1 1 128 128 ASN HA H 128 4.689 4.689 5.029 -0.340 17890 15839 1 20 . 1 1 128 128 ASN C C 128 175.452 175.452 175.543 -0.091 17890 15840 1 20 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.673 1.334 17890 15841 1 20 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.908 -1.617 17890 15842 1 20 . 1 1 128 128 ASN H H 128 8.662 8.662 9.642 -0.980 17890 15843 1 20 . 1 1 129 129 ASN N N 129 119.586 119.586 116.675 2.911 17890 15844 1 20 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.864 0.133 17890 15845 1 20 . 1 1 129 129 ASN C C 129 175.900 175.900 174.781 1.119 17890 15846 1 20 . 1 1 129 129 ASN CA C 129 54.233 54.233 52.905 1.328 17890 15847 1 20 . 1 1 129 129 ASN CB C 129 41.256 41.256 38.940 2.316 17890 15848 1 20 . 1 1 129 129 ASN H H 129 10.962 10.962 8.664 2.298 17890 15849 1 20 . 1 1 130 130 ALA N N 130 128.292 128.292 121.476 6.816 17890 15850 1 20 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.045 -0.475 17890 15851 1 20 . 1 1 130 130 ALA C C 130 172.620 172.620 176.479 -3.859 17890 15852 1 20 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.358 -0.719 17890 15853 1 20 . 1 1 130 130 ALA CB C 130 16.100 16.100 16.464 -0.364 17890 15854 1 20 . 1 1 130 130 ALA H H 130 10.629 10.629 8.315 2.314 17890 15855 1 20 . 1 1 131 131 THR N N 131 105.584 105.584 110.110 -4.526 17890 15856 1 20 . 1 1 131 131 THR HA H 131 4.462 4.462 4.467 -0.005 17890 15857 1 20 . 1 1 131 131 THR C C 131 173.552 173.552 174.223 -0.671 17890 15858 1 20 . 1 1 131 131 THR CA C 131 58.338 58.338 60.108 -1.770 17890 15859 1 20 . 1 1 131 131 THR CB C 131 71.569 71.569 70.850 0.719 17890 15860 1 20 . 1 1 131 131 THR H H 131 7.092 7.092 8.219 -1.127 17890 15861 1 20 . 1 1 132 132 ALA N N 132 121.773 121.773 123.028 -1.255 17890 15862 1 20 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.065 -0.316 17890 15863 1 20 . 1 1 132 132 ALA C C 132 178.819 178.819 178.549 0.270 17890 15864 1 20 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.693 1.591 17890 15865 1 20 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.446 -0.219 17890 15866 1 20 . 1 1 132 132 ALA H H 132 8.952 8.952 8.460 0.492 17890 15867 1 20 . 1 1 133 133 GLY N N 133 113.965 113.965 110.585 3.380 17890 15868 1 20 . 1 1 133 133 GLY C C 133 173.453 173.453 174.607 -1.154 17890 15869 1 20 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.954 0.212 17890 15870 1 20 . 1 1 133 133 GLY H H 133 9.016 9.016 8.503 0.513 17890 15871 1 20 . 1 1 134 134 GLU N N 134 123.460 123.460 121.390 2.070 17890 15872 1 20 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.227 -0.269 17890 15873 1 20 . 1 1 134 134 GLU C C 134 176.120 176.120 175.656 0.464 17890 15874 1 20 . 1 1 134 134 GLU CA C 134 57.399 57.399 56.360 1.039 17890 15875 1 20 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.553 0.832 17890 15876 1 20 . 1 1 134 134 GLU H H 134 7.598 7.598 7.778 -0.180 17890 15877 1 20 . 1 1 135 135 GLU N N 135 122.633 122.633 125.460 -2.827 17890 15878 1 20 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.346 -0.035 17890 15879 1 20 . 1 1 135 135 GLU C C 135 176.014 176.014 176.549 -0.535 17890 15880 1 20 . 1 1 135 135 GLU CA C 135 56.182 56.182 55.920 0.262 17890 15881 1 20 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.105 -0.652 17890 15882 1 20 . 1 1 135 135 GLU H H 135 8.258 8.258 8.634 -0.376 17890 15883 1 20 . 1 1 136 136 VAL N N 136 123.635 123.635 125.656 -2.021 17890 15884 1 20 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.767 -0.075 17890 15885 1 20 . 1 1 136 136 VAL C C 136 173.932 173.932 175.117 -1.185 17890 15886 1 20 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.237 0.595 17890 15887 1 20 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.529 -0.664 17890 15888 1 20 . 1 1 136 136 VAL H H 136 7.267 7.267 8.427 -1.160 17890 15889 1 20 . 1 1 137 137 SER N N 137 118.950 118.950 120.571 -1.621 17890 15890 1 20 . 1 1 137 137 SER HA H 137 4.887 4.887 5.235 -0.348 17890 15891 1 20 . 1 1 137 137 SER C C 137 173.780 173.780 173.204 0.576 17890 15892 1 20 . 1 1 137 137 SER CA C 137 57.895 57.895 56.679 1.216 17890 15893 1 20 . 1 1 137 137 SER CB C 137 65.027 65.027 67.008 -1.981 17890 15894 1 20 . 1 1 137 137 SER H H 137 8.454 8.454 8.551 -0.097 17890 15895 1 20 . 1 1 138 138 ILE N N 138 123.511 123.511 119.768 3.743 17890 15896 1 20 . 1 1 138 138 ILE HA H 138 4.248 4.248 4.962 -0.714 17890 15897 1 20 . 1 1 138 138 ILE C C 138 176.142 176.142 175.550 0.592 17890 15898 1 20 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.549 1.301 17890 15899 1 20 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.801 -3.206 17890 15900 1 20 . 1 1 138 138 ILE H H 138 7.915 7.915 8.188 -0.273 17890 15901 1 20 . 1 1 139 139 GLY N N 139 115.638 115.638 110.948 4.690 17890 15902 1 20 . 1 1 139 139 GLY C C 139 171.947 171.947 173.281 -1.334 17890 15903 1 20 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.404 1.682 17890 15904 1 20 . 1 1 139 139 GLY H H 139 8.490 8.490 8.455 0.035 17890 15905 1 20 . 1 1 140 140 ALA N N 140 128.563 128.563 121.255 7.308 17890 15906 1 20 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.355 0.041 17890 15907 1 20 . 1 1 140 140 ALA C C 140 177.956 177.956 177.222 0.734 17890 15908 1 20 . 1 1 140 140 ALA CA C 140 52.646 52.646 54.639 -1.993 17890 15909 1 20 . 1 1 140 140 ALA CB C 140 19.204 19.204 18.844 0.360 17890 15910 1 20 . 1 1 140 140 ALA H H 140 8.531 8.531 8.431 0.100 17890 15911 1 20 . 1 1 141 141 ASP N N 141 120.886 120.886 114.508 6.378 17890 15912 1 20 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.589 0.009 17890 15913 1 20 . 1 1 141 141 ASP C C 141 175.411 175.411 174.365 1.046 17890 15914 1 20 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.527 0.389 17890 15915 1 20 . 1 1 141 141 ASP CB C 141 40.692 40.692 42.502 -1.810 17890 15916 1 20 . 1 1 141 141 ASP H H 141 8.507 8.507 7.719 0.788 17890 15917 1 20 . 1 1 142 142 ALA N N 142 125.604 125.604 122.588 3.016 17890 15918 1 20 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.669 -0.152 17890 15919 1 20 . 1 1 142 142 ALA C C 142 177.671 177.671 178.001 -0.330 17890 15920 1 20 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.469 0.524 17890 15921 1 20 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.060 0.475 17890 15922 1 20 . 1 1 142 142 ALA H H 142 7.894 7.894 8.223 -0.329 17890 15923 1 20 . 1 1 143 143 THR N N 143 118.085 118.085 117.747 0.338 17890 15924 1 20 . 1 1 143 143 THR HA H 143 3.744 3.744 4.124 -0.380 17890 15925 1 20 . 1 1 143 143 THR C C 143 175.464 175.464 175.209 0.255 17890 15926 1 20 . 1 1 143 143 THR CA C 143 64.548 64.548 64.955 -0.407 17890 15927 1 20 . 1 1 143 143 THR CB C 143 69.305 69.305 68.877 0.428 17890 15928 1 20 . 1 1 143 143 THR H H 143 8.268 8.268 8.903 -0.635 17890 15929 1 20 . 1 1 144 144 PHE N N 144 118.635 118.635 116.283 2.352 17890 15930 1 20 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.696 -0.350 17890 15931 1 20 . 1 1 144 144 PHE C C 144 176.209 176.209 175.013 1.196 17890 15932 1 20 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.895 3.567 17890 15933 1 20 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.497 0.107 17890 15934 1 20 . 1 1 144 144 PHE H H 144 8.719 8.719 8.015 0.704 17890 15935 1 20 . 1 1 145 145 SER N N 145 113.446 113.446 114.256 -0.810 17890 15936 1 20 . 1 1 145 145 SER HA H 145 4.866 4.866 4.061 0.805 17890 15937 1 20 . 1 1 145 145 SER C C 145 176.605 176.605 175.265 1.340 17890 15938 1 20 . 1 1 145 145 SER CA C 145 59.432 59.432 57.327 2.105 17890 15939 1 20 . 1 1 145 145 SER CB C 145 62.167 62.167 63.408 -1.241 17890 15940 1 20 . 1 1 145 145 SER H H 145 8.657 8.657 7.228 1.429 17890 15941 1 20 . 1 1 146 146 GLY N N 146 109.277 109.277 109.710 -0.433 17890 15942 1 20 . 1 1 146 146 GLY C C 146 174.293 174.293 173.604 0.689 17890 15943 1 20 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.563 -0.623 17890 15944 1 20 . 1 1 146 146 GLY H H 146 7.467 7.467 7.586 -0.119 17890 15945 1 20 . 1 1 147 147 ARG N N 147 122.863 122.863 117.840 5.023 17890 15946 1 20 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.991 0.450 17890 15947 1 20 . 1 1 147 147 ARG C C 147 173.849 173.849 174.641 -0.792 17890 15948 1 20 . 1 1 147 147 ARG CA C 147 52.227 52.227 53.829 -1.602 17890 15949 1 20 . 1 1 147 147 ARG CB C 147 32.597 32.597 32.769 -0.172 17890 15950 1 20 . 1 1 147 147 ARG H H 147 7.556 7.556 6.867 0.689 17890 15951 1 20 . 1 1 148 148 TRP N N 148 118.465 118.465 121.337 -2.872 17890 15952 1 20 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.137 -0.291 17890 15953 1 20 . 1 1 148 148 TRP C C 148 174.353 174.353 174.331 0.022 17890 15954 1 20 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.922 -1.260 17890 15955 1 20 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.309 -1.310 17890 15956 1 20 . 1 1 148 148 TRP H H 148 8.709 8.709 9.291 -0.582 17890 15957 1 20 . 1 1 149 149 VAL N N 149 125.852 125.852 118.139 7.713 17890 15958 1 20 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.572 -0.429 17890 15959 1 20 . 1 1 149 149 VAL C C 149 173.613 173.613 173.345 0.268 17890 15960 1 20 . 1 1 149 149 VAL CA C 149 61.740 61.740 59.886 1.853 17890 15961 1 20 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.166 -2.783 17890 15962 1 20 . 1 1 149 149 VAL H H 149 9.700 9.700 8.840 0.860 17890 15963 1 20 . 1 1 150 150 ILE N N 150 125.140 125.140 127.450 -2.310 17890 15964 1 20 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.116 -0.254 17890 15965 1 20 . 1 1 150 150 ILE C C 150 175.661 175.661 174.264 1.397 17890 15966 1 20 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.480 1.341 17890 15967 1 20 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.644 -0.824 17890 15968 1 20 . 1 1 150 150 ILE H H 150 7.747 7.747 8.010 -0.263 17890 15969 1 20 . 1 1 151 151 GLU N N 151 126.762 126.762 126.968 -0.206 17890 15970 1 20 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.843 0.037 17890 15971 1 20 . 1 1 151 151 GLU C C 151 174.424 174.424 174.817 -0.393 17890 15972 1 20 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.042 0.754 17890 15973 1 20 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.752 0.499 17890 15974 1 20 . 1 1 151 151 GLU H H 151 8.892 8.892 8.761 0.131 17890 15975 1 20 . 1 1 152 152 LYS N N 152 126.299 126.299 122.319 3.980 17890 15976 1 20 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.853 0.008 17890 15977 1 20 . 1 1 152 152 LYS C C 152 176.282 176.282 176.626 -0.344 17890 15978 1 20 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.875 0.630 17890 15979 1 20 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.688 0.648 17890 15980 1 20 . 1 1 152 152 LYS H H 152 8.640 8.640 8.359 0.281 17890 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 132 3.764 -0.436 3.753 17890 2 1 1 "Average Difference" HA 162 0.377 0.023 0.378 17890 3 1 1 "Average Difference" C 129 1.291 -0.216 1.278 17890 4 1 1 "Average Difference" CA 146 1.349 -0.251 1.330 17890 5 1 1 "Average Difference" CB 130 1.527 0.324 1.497 17890 6 1 1 "Average Difference" HN 132 0.771 -0.169 0.755 17890 7 1 2 "Average Difference" N 132 3.657 -0.498 3.636 17890 8 1 2 "Average Difference" HA 162 0.364 0.012 0.365 17890 9 1 2 "Average Difference" C 129 1.254 -0.216 1.240 17890 10 1 2 "Average Difference" CA 146 1.310 -0.235 1.294 17890 11 1 2 "Average Difference" CB 130 1.402 0.228 1.389 17890 12 1 2 "Average Difference" HN 132 0.729 -0.188 0.707 17890 13 1 3 "Average Difference" N 132 3.376 -0.487 3.354 17890 14 1 3 "Average Difference" HA 162 0.363 0.022 0.363 17890 15 1 3 "Average Difference" C 129 1.242 -0.228 1.226 17890 16 1 3 "Average Difference" CA 146 1.313 -0.239 1.296 17890 17 1 3 "Average Difference" CB 130 1.360 0.186 1.352 17890 18 1 3 "Average Difference" HN 132 0.676 -0.153 0.660 17890 19 1 4 "Average Difference" N 132 3.530 -0.409 3.520 17890 20 1 4 "Average Difference" HA 162 0.366 0.007 0.367 17890 21 1 4 "Average Difference" C 129 1.256 -0.283 1.228 17890 22 1 4 "Average Difference" CA 146 1.318 -0.229 1.302 17890 23 1 4 "Average Difference" CB 130 1.406 0.329 1.372 17890 24 1 4 "Average Difference" HN 132 0.713 -0.157 0.698 17890 25 1 5 "Average Difference" N 132 3.588 -0.630 3.546 17890 26 1 5 "Average Difference" HA 162 0.374 0.027 0.374 17890 27 1 5 "Average Difference" C 129 1.284 -0.267 1.261 17890 28 1 5 "Average Difference" CA 146 1.368 -0.255 1.348 17890 29 1 5 "Average Difference" CB 130 1.451 0.301 1.425 17890 30 1 5 "Average Difference" HN 132 0.740 -0.191 0.718 17890 31 1 6 "Average Difference" N 132 3.774 -0.694 3.724 17890 32 1 6 "Average Difference" HA 162 0.370 0.004 0.371 17890 33 1 6 "Average Difference" C 129 1.272 -0.269 1.248 17890 34 1 6 "Average Difference" CA 146 1.355 -0.225 1.341 17890 35 1 6 "Average Difference" CB 130 1.459 0.318 1.430 17890 36 1 6 "Average Difference" HN 132 0.736 -0.190 0.714 17890 37 1 7 "Average Difference" N 132 3.683 -0.631 3.642 17890 38 1 7 "Average Difference" HA 162 0.368 0.006 0.369 17890 39 1 7 "Average Difference" C 129 1.247 -0.221 1.232 17890 40 1 7 "Average Difference" CA 146 1.364 -0.192 1.355 17890 41 1 7 "Average Difference" CB 130 1.360 0.266 1.339 17890 42 1 7 "Average Difference" HN 132 0.758 -0.192 0.736 17890 43 1 8 "Average Difference" N 132 3.536 -0.445 3.521 17890 44 1 8 "Average Difference" HA 162 0.362 0.017 0.363 17890 45 1 8 "Average Difference" C 129 1.288 -0.278 1.262 17890 46 1 8 "Average Difference" CA 146 1.330 -0.257 1.309 17890 47 1 8 "Average Difference" CB 130 1.409 0.339 1.373 17890 48 1 8 "Average Difference" HN 132 0.724 -0.166 0.708 17890 49 1 9 "Average Difference" N 132 3.451 -0.364 3.445 17890 50 1 9 "Average Difference" HA 162 0.368 0.014 0.369 17890 51 1 9 "Average Difference" C 129 1.258 -0.260 1.236 17890 52 1 9 "Average Difference" CA 146 1.352 -0.218 1.339 17890 53 1 9 "Average Difference" CB 130 1.374 0.306 1.345 17890 54 1 9 "Average Difference" HN 132 0.699 -0.165 0.682 17890 55 1 10 "Average Difference" N 132 3.661 -0.400 3.653 17890 56 1 10 "Average Difference" HA 162 0.387 0.001 0.388 17890 57 1 10 "Average Difference" C 129 1.304 -0.282 1.278 17890 58 1 10 "Average Difference" CA 146 1.344 -0.229 1.329 17890 59 1 10 "Average Difference" CB 130 1.376 0.209 1.366 17890 60 1 10 "Average Difference" HN 132 0.733 -0.201 0.708 17890 61 1 11 "Average Difference" N 132 3.842 -0.648 3.801 17890 62 1 11 "Average Difference" HA 162 0.368 0.027 0.368 17890 63 1 11 "Average Difference" C 129 1.348 -0.241 1.331 17890 64 1 11 "Average Difference" CA 146 1.365 -0.189 1.357 17890 65 1 11 "Average Difference" CB 130 1.427 0.234 1.414 17890 66 1 11 "Average Difference" HN 132 0.773 -0.177 0.756 17890 67 1 12 "Average Difference" N 132 3.617 -0.630 3.575 17890 68 1 12 "Average Difference" HA 162 0.370 0.015 0.371 17890 69 1 12 "Average Difference" C 129 1.342 -0.246 1.325 17890 70 1 12 "Average Difference" CA 146 1.365 -0.248 1.347 17890 71 1 12 "Average Difference" CB 130 1.468 0.239 1.454 17890 72 1 12 "Average Difference" HN 132 0.742 -0.193 0.720 17890 73 1 13 "Average Difference" N 132 3.662 -0.547 3.635 17890 74 1 13 "Average Difference" HA 162 0.360 0.003 0.361 17890 75 1 13 "Average Difference" C 129 1.294 -0.181 1.287 17890 76 1 13 "Average Difference" CA 146 1.365 -0.170 1.359 17890 77 1 13 "Average Difference" CB 130 1.411 0.230 1.397 17890 78 1 13 "Average Difference" HN 132 0.716 -0.178 0.696 17890 79 1 14 "Average Difference" N 132 3.633 -0.660 3.586 17890 80 1 14 "Average Difference" HA 162 0.370 0.017 0.371 17890 81 1 14 "Average Difference" C 129 1.257 -0.270 1.233 17890 82 1 14 "Average Difference" CA 146 1.332 -0.272 1.308 17890 83 1 14 "Average Difference" CB 130 1.444 0.304 1.417 17890 84 1 14 "Average Difference" HN 132 0.735 -0.186 0.714 17890 85 1 15 "Average Difference" N 132 3.733 -0.588 3.701 17890 86 1 15 "Average Difference" HA 162 0.375 0.018 0.376 17890 87 1 15 "Average Difference" C 129 1.301 -0.283 1.275 17890 88 1 15 "Average Difference" CA 146 1.399 -0.269 1.377 17890 89 1 15 "Average Difference" CB 130 1.441 0.303 1.414 17890 90 1 15 "Average Difference" HN 132 0.741 -0.187 0.719 17890 91 1 16 "Average Difference" N 132 3.835 -0.577 3.806 17890 92 1 16 "Average Difference" HA 162 0.381 0.009 0.382 17890 93 1 16 "Average Difference" C 129 1.250 -0.243 1.231 17890 94 1 16 "Average Difference" CA 146 1.308 -0.224 1.293 17890 95 1 16 "Average Difference" CB 130 1.455 0.300 1.429 17890 96 1 16 "Average Difference" HN 132 0.737 -0.184 0.717 17890 97 1 17 "Average Difference" N 132 3.770 -0.624 3.732 17890 98 1 17 "Average Difference" HA 162 0.372 0.026 0.373 17890 99 1 17 "Average Difference" C 129 1.257 -0.281 1.230 17890 100 1 17 "Average Difference" CA 146 1.351 -0.270 1.328 17890 101 1 17 "Average Difference" CB 130 1.418 0.280 1.396 17890 102 1 17 "Average Difference" HN 132 0.733 -0.194 0.709 17890 103 1 18 "Average Difference" N 132 3.643 -0.419 3.633 17890 104 1 18 "Average Difference" HA 162 0.379 0.014 0.380 17890 105 1 18 "Average Difference" C 129 1.300 -0.242 1.282 17890 106 1 18 "Average Difference" CA 146 1.361 -0.208 1.349 17890 107 1 18 "Average Difference" CB 130 1.430 0.316 1.400 17890 108 1 18 "Average Difference" HN 132 0.724 -0.156 0.710 17890 109 1 19 "Average Difference" N 132 3.546 -0.473 3.528 17890 110 1 19 "Average Difference" HA 162 0.372 0.008 0.373 17890 111 1 19 "Average Difference" C 129 1.343 -0.280 1.318 17890 112 1 19 "Average Difference" CA 146 1.366 -0.229 1.351 17890 113 1 19 "Average Difference" CB 130 1.429 0.275 1.408 17890 114 1 19 "Average Difference" HN 132 0.752 -0.204 0.727 17890 115 1 20 "Average Difference" N 132 3.865 -0.685 3.818 17890 116 1 20 "Average Difference" HA 162 0.386 -0.002 0.388 17890 117 1 20 "Average Difference" C 129 1.276 -0.261 1.254 17890 118 1 20 "Average Difference" CA 146 1.352 -0.250 1.333 17890 119 1 20 "Average Difference" CB 130 1.429 0.293 1.404 17890 120 1 20 "Average Difference" HN 132 0.740 -0.174 0.722 17890 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 17890 _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 2 2 GLY CA C 2 43.294 43.294 45.384 -2.090 17890 2 1 . 1 1 8 8 HIS HA H 8 4.622 4.622 4.620 0.002 17890 3 1 . 1 1 8 8 HIS CA C 8 55.661 55.661 56.242 -0.581 17890 4 1 . 1 1 8 8 HIS CB C 8 29.880 29.880 30.848 -0.968 17890 5 1 . 1 1 9 9 HIS HA H 9 4.646 4.646 4.641 0.005 17890 6 1 . 1 1 9 9 HIS CA C 9 55.684 55.684 55.941 -0.257 17890 7 1 . 1 1 9 9 HIS CB C 9 29.831 29.831 31.207 -1.376 17890 8 1 . 1 1 10 10 HIS N N 10 120.811 120.811 117.516 3.295 17890 9 1 . 1 1 10 10 HIS HA H 10 4.680 4.680 4.632 0.048 17890 10 1 . 1 1 10 10 HIS C C 10 174.875 174.875 174.535 0.340 17890 11 1 . 1 1 10 10 HIS CA C 10 55.746 55.746 56.115 -0.369 17890 12 1 . 1 1 10 10 HIS CB C 10 29.889 29.889 30.794 -0.905 17890 13 1 . 1 1 10 10 HIS H H 10 8.583 8.583 7.983 0.600 17890 14 1 . 1 1 11 11 SER N N 11 118.009 118.009 114.308 3.701 17890 15 1 . 1 1 11 11 SER HA H 11 4.424 4.424 4.351 0.073 17890 16 1 . 1 1 11 11 SER C C 11 174.962 174.962 174.040 0.922 17890 17 1 . 1 1 11 11 SER CA C 11 58.660 58.660 58.468 0.192 17890 18 1 . 1 1 11 11 SER CB C 11 63.822 63.822 63.936 -0.115 17890 19 1 . 1 1 11 11 SER H H 11 8.438 8.438 8.083 0.355 17890 20 1 . 1 1 12 12 GLY N N 12 111.011 111.011 108.410 2.601 17890 21 1 . 1 1 12 12 GLY C C 12 173.907 173.907 173.175 0.732 17890 22 1 . 1 1 12 12 GLY CA C 12 45.421 45.421 45.338 0.083 17890 23 1 . 1 1 12 12 GLY H H 12 8.433 8.433 8.000 0.433 17890 24 1 . 1 1 13 13 ASP N N 13 120.291 120.291 119.181 1.110 17890 25 1 . 1 1 13 13 ASP HA H 13 4.662 4.662 4.819 -0.157 17890 26 1 . 1 1 13 13 ASP C C 13 176.115 176.115 175.429 0.686 17890 27 1 . 1 1 13 13 ASP CA C 13 54.303 54.303 53.829 0.474 17890 28 1 . 1 1 13 13 ASP CB C 13 41.465 41.465 42.172 -0.707 17890 29 1 . 1 1 13 13 ASP H H 13 8.153 8.153 8.149 0.004 17890 30 1 . 1 1 14 14 SER N N 14 116.987 116.987 115.385 1.602 17890 31 1 . 1 1 14 14 SER HA H 14 4.754 4.754 4.732 0.022 17890 32 1 . 1 1 14 14 SER CA C 14 56.469 56.469 56.864 -0.395 17890 33 1 . 1 1 14 14 SER CB C 14 63.553 63.553 64.043 -0.490 17890 34 1 . 1 1 14 14 SER H H 14 8.210 8.210 7.969 0.241 17890 35 1 . 1 1 15 15 PRO HA H 15 4.442 4.442 4.385 0.057 17890 36 1 . 1 1 15 15 PRO C C 15 176.424 176.424 175.981 0.443 17890 37 1 . 1 1 15 15 PRO CA C 15 63.233 63.233 63.111 0.122 17890 38 1 . 1 1 15 15 PRO CB C 15 32.148 32.148 32.133 0.015 17890 39 1 . 1 1 16 16 ALA N N 16 124.219 124.219 123.806 0.413 17890 40 1 . 1 1 16 16 ALA HA H 16 4.350 4.350 4.459 -0.109 17890 41 1 . 1 1 16 16 ALA C C 16 177.552 177.552 176.636 0.916 17890 42 1 . 1 1 16 16 ALA CA C 16 52.433 52.433 52.132 0.301 17890 43 1 . 1 1 16 16 ALA CB C 16 19.319 19.319 19.333 -0.014 17890 44 1 . 1 1 16 16 ALA H H 16 8.284 8.284 8.345 -0.061 17890 45 1 . 1 1 17 17 VAL N N 17 119.504 119.504 118.565 0.939 17890 46 1 . 1 1 17 17 VAL HA H 17 4.249 4.249 4.232 0.017 17890 47 1 . 1 1 17 17 VAL C C 17 176.322 176.322 175.798 0.524 17890 48 1 . 1 1 17 17 VAL CA C 17 62.278 62.278 62.665 -0.388 17890 49 1 . 1 1 17 17 VAL CB C 17 32.957 32.957 33.358 -0.401 17890 50 1 . 1 1 17 17 VAL H H 17 8.046 8.046 7.692 0.354 17890 51 1 . 1 1 18 18 THR N N 18 118.186 118.186 118.591 -0.405 17890 52 1 . 1 1 18 18 THR HA H 18 4.473 4.473 4.544 -0.071 17890 53 1 . 1 1 18 18 THR C C 18 174.248 174.248 174.540 -0.292 17890 54 1 . 1 1 18 18 THR CA C 18 61.565 61.565 61.551 0.014 17890 55 1 . 1 1 18 18 THR CB C 18 70.165 70.165 69.340 0.825 17890 56 1 . 1 1 18 18 THR H H 18 8.276 8.276 8.432 -0.156 17890 57 1 . 1 1 19 19 LEU N N 19 125.265 125.265 119.943 5.322 17890 58 1 . 1 1 19 19 LEU HA H 19 4.293 4.293 4.004 0.289 17890 59 1 . 1 1 19 19 LEU C C 19 175.689 175.689 175.627 0.062 17890 60 1 . 1 1 19 19 LEU CA C 19 55.427 55.427 55.527 -0.100 17890 61 1 . 1 1 19 19 LEU CB C 19 43.279 43.279 41.326 1.953 17890 62 1 . 1 1 19 19 LEU H H 19 8.091 8.091 8.151 -0.060 17890 63 1 . 1 1 20 20 SER N N 20 114.622 114.622 114.805 -0.183 17890 64 1 . 1 1 20 20 SER HA H 20 4.947 4.947 4.881 0.066 17890 65 1 . 1 1 20 20 SER C C 20 174.220 174.220 173.074 1.146 17890 66 1 . 1 1 20 20 SER CA C 20 56.583 56.583 57.346 -0.763 17890 67 1 . 1 1 20 20 SER CB C 20 65.653 65.653 65.344 0.309 17890 68 1 . 1 1 20 20 SER H H 20 7.316 7.316 7.991 -0.675 17890 69 1 . 1 1 21 21 ALA N N 21 125.517 125.517 123.842 1.675 17890 70 1 . 1 1 21 21 ALA HA H 21 4.668 4.668 4.940 -0.272 17890 71 1 . 1 1 21 21 ALA C C 21 177.960 177.960 177.447 0.513 17890 72 1 . 1 1 21 21 ALA CA C 21 54.010 54.010 52.444 1.566 17890 73 1 . 1 1 21 21 ALA CB C 21 19.225 19.225 19.411 -0.186 17890 74 1 . 1 1 21 21 ALA H H 21 8.993 8.993 8.534 0.459 17890 75 1 . 1 1 22 22 GLY N N 22 109.543 109.543 111.498 -1.955 17890 76 1 . 1 1 22 22 GLY C C 22 170.422 170.422 171.885 -1.463 17890 77 1 . 1 1 22 22 GLY CA C 22 45.381 45.381 45.212 0.169 17890 78 1 . 1 1 22 22 GLY H H 22 8.411 8.411 8.965 -0.554 17890 79 1 . 1 1 23 23 ASN N N 23 119.649 119.649 119.406 0.243 17890 80 1 . 1 1 23 23 ASN HA H 23 5.887 5.887 5.678 0.209 17890 81 1 . 1 1 23 23 ASN C C 23 175.207 175.207 174.575 0.632 17890 82 1 . 1 1 23 23 ASN CA C 23 51.821 51.821 52.765 -0.944 17890 83 1 . 1 1 23 23 ASN CB C 23 38.755 38.755 39.633 -0.878 17890 84 1 . 1 1 23 23 ASN H H 23 8.092 8.092 8.413 -0.321 17890 85 1 . 1 1 24 24 TYR N N 24 120.889 120.889 121.767 -0.878 17890 86 1 . 1 1 24 24 TYR HA H 24 5.255 5.255 5.169 0.086 17890 87 1 . 1 1 24 24 TYR C C 24 175.667 175.667 174.455 1.212 17890 88 1 . 1 1 24 24 TYR CA C 24 58.113 58.113 57.228 0.885 17890 89 1 . 1 1 24 24 TYR CB C 24 43.826 43.826 43.655 0.171 17890 90 1 . 1 1 24 24 TYR H H 24 9.914 9.914 8.969 0.945 17890 91 1 . 1 1 25 25 ILE N N 25 115.978 115.978 113.564 2.414 17890 92 1 . 1 1 25 25 ILE HA H 25 5.086 5.086 5.050 0.036 17890 93 1 . 1 1 25 25 ILE C C 25 175.200 175.200 174.201 0.999 17890 94 1 . 1 1 25 25 ILE CA C 25 60.545 60.545 59.643 0.902 17890 95 1 . 1 1 25 25 ILE CB C 25 41.122 41.122 41.823 -0.701 17890 96 1 . 1 1 25 25 ILE H H 25 9.216 9.216 9.291 -0.075 17890 97 1 . 1 1 26 26 ILE N N 26 123.957 123.957 122.566 1.391 17890 98 1 . 1 1 26 26 ILE HA H 26 4.976 4.976 5.243 -0.267 17890 99 1 . 1 1 26 26 ILE C C 26 174.810 174.810 174.917 -0.107 17890 100 1 . 1 1 26 26 ILE CA C 26 60.609 60.609 60.239 0.370 17890 101 1 . 1 1 26 26 ILE CB C 26 41.122 41.122 40.175 0.948 17890 102 1 . 1 1 26 26 ILE H H 26 9.559 9.559 9.006 0.553 17890 103 1 . 1 1 27 27 TYR N N 27 121.371 121.371 123.998 -2.627 17890 104 1 . 1 1 27 27 TYR HA H 27 6.190 6.190 5.570 0.620 17890 105 1 . 1 1 27 27 TYR C C 27 173.963 173.963 173.444 0.519 17890 106 1 . 1 1 27 27 TYR CA C 27 54.669 54.669 54.930 -0.261 17890 107 1 . 1 1 27 27 TYR CB C 27 41.698 41.698 41.001 0.697 17890 108 1 . 1 1 27 27 TYR H H 27 9.378 9.378 9.080 0.298 17890 109 1 . 1 1 28 28 ASN N N 28 121.991 121.991 119.922 2.069 17890 110 1 . 1 1 28 28 ASN HA H 28 3.768 3.768 4.088 -0.320 17890 111 1 . 1 1 28 28 ASN C C 28 174.352 174.352 176.125 -1.773 17890 112 1 . 1 1 28 28 ASN CA C 28 55.120 55.120 52.963 2.157 17890 113 1 . 1 1 28 28 ASN CB C 28 41.446 41.446 39.862 1.584 17890 114 1 . 1 1 28 28 ASN H H 28 8.466 8.466 8.443 0.023 17890 115 1 . 1 1 29 29 ARG N N 29 121.103 121.103 125.836 -4.733 17890 116 1 . 1 1 29 29 ARG HA H 29 3.861 3.861 4.081 -0.220 17890 117 1 . 1 1 29 29 ARG C C 29 173.635 173.635 177.324 -3.689 17890 118 1 . 1 1 29 29 ARG CA C 29 59.293 59.293 57.791 1.502 17890 119 1 . 1 1 29 29 ARG CB C 29 30.399 30.399 30.050 0.349 17890 120 1 . 1 1 29 29 ARG H H 29 7.756 7.756 8.196 -0.440 17890 121 1 . 1 1 30 30 VAL N N 30 118.412 118.412 118.246 0.166 17890 122 1 . 1 1 30 30 VAL HA H 30 3.944 3.944 3.873 0.071 17890 123 1 . 1 1 30 30 VAL C C 30 176.199 176.199 175.707 0.492 17890 124 1 . 1 1 30 30 VAL CA C 30 62.577 62.577 63.475 -0.898 17890 125 1 . 1 1 30 30 VAL CB C 30 30.222 30.222 32.411 -2.189 17890 126 1 . 1 1 30 30 VAL H H 30 8.976 8.976 7.774 1.202 17890 127 1 . 1 1 31 31 LEU N N 31 125.418 125.418 117.986 7.432 17890 128 1 . 1 1 31 31 LEU HA H 31 4.485 4.485 4.117 0.368 17890 129 1 . 1 1 31 31 LEU C C 31 179.123 179.123 176.390 2.733 17890 130 1 . 1 1 31 31 LEU CA C 31 54.025 54.025 55.225 -1.200 17890 131 1 . 1 1 31 31 LEU CB C 31 45.581 45.581 41.949 3.632 17890 132 1 . 1 1 31 31 LEU H H 31 8.856 8.856 7.715 1.141 17890 133 1 . 1 1 32 32 SER N N 32 116.890 116.890 115.701 1.189 17890 134 1 . 1 1 32 32 SER HA H 32 5.365 5.365 4.856 0.509 17890 135 1 . 1 1 32 32 SER CA C 32 57.269 57.269 56.345 0.924 17890 136 1 . 1 1 32 32 SER CB C 32 62.213 62.213 64.262 -2.049 17890 137 1 . 1 1 32 32 SER H H 32 9.307 9.307 8.385 0.922 17890 138 1 . 1 1 33 33 PRO HA H 33 3.880 3.880 4.404 -0.524 17890 139 1 . 1 1 33 33 PRO C C 33 175.137 175.137 177.495 -2.358 17890 140 1 . 1 1 33 33 PRO CA C 33 65.285 65.285 64.554 0.731 17890 141 1 . 1 1 33 33 PRO CB C 33 32.031 32.031 31.578 0.453 17890 142 1 . 1 1 34 34 ARG N N 34 110.279 110.279 118.842 -8.563 17890 143 1 . 1 1 34 34 ARG HA H 34 4.492 4.492 4.253 0.239 17890 144 1 . 1 1 34 34 ARG C C 34 176.844 176.844 177.067 -0.223 17890 145 1 . 1 1 34 34 ARG CA C 34 54.436 54.436 55.853 -1.417 17890 146 1 . 1 1 34 34 ARG CB C 34 30.584 30.584 30.312 0.272 17890 147 1 . 1 1 34 34 ARG H H 34 7.257 7.257 7.817 -0.560 17890 148 1 . 1 1 35 35 GLY N N 35 110.288 110.288 106.450 3.838 17890 149 1 . 1 1 35 35 GLY C C 35 173.336 173.336 173.952 -0.616 17890 150 1 . 1 1 35 35 GLY CA C 35 47.030 47.030 44.904 2.126 17890 151 1 . 1 1 35 35 GLY H H 35 8.589 8.589 7.812 0.777 17890 152 1 . 1 1 36 36 GLU N N 36 116.838 116.838 119.007 -2.169 17890 153 1 . 1 1 36 36 GLU HA H 36 4.348 4.348 4.622 -0.274 17890 154 1 . 1 1 36 36 GLU C C 36 176.915 176.915 175.507 1.408 17890 155 1 . 1 1 36 36 GLU CA C 36 54.907 54.907 54.177 0.730 17890 156 1 . 1 1 36 36 GLU CB C 36 30.415 30.415 32.723 -2.308 17890 157 1 . 1 1 36 36 GLU H H 36 7.769 7.769 7.955 -0.186 17890 158 1 . 1 1 37 37 LYS N N 37 123.775 123.775 120.812 2.963 17890 159 1 . 1 1 37 37 LYS HA H 37 4.423 4.423 4.137 0.286 17890 160 1 . 1 1 37 37 LYS C C 37 176.067 176.067 175.616 0.451 17890 161 1 . 1 1 37 37 LYS CA C 37 56.901 56.901 57.490 -0.588 17890 162 1 . 1 1 37 37 LYS CB C 37 33.674 33.674 32.735 0.939 17890 163 1 . 1 1 37 37 LYS H H 37 8.667 8.667 8.631 0.036 17890 164 1 . 1 1 38 38 LEU N N 38 126.658 126.658 125.283 1.375 17890 165 1 . 1 1 38 38 LEU HA H 38 4.227 4.227 4.921 -0.694 17890 166 1 . 1 1 38 38 LEU C C 38 174.332 174.332 175.184 -0.852 17890 167 1 . 1 1 38 38 LEU CA C 38 53.343 53.343 53.673 -0.330 17890 168 1 . 1 1 38 38 LEU CB C 38 41.651 41.651 42.605 -0.954 17890 169 1 . 1 1 38 38 LEU H H 38 10.455 10.455 8.877 1.578 17890 170 1 . 1 1 39 39 ALA N N 39 127.018 127.018 126.400 0.618 17890 171 1 . 1 1 39 39 ALA HA H 39 5.229 5.229 5.261 -0.032 17890 172 1 . 1 1 39 39 ALA C C 39 178.694 178.694 176.181 2.513 17890 173 1 . 1 1 39 39 ALA CA C 39 50.225 50.225 50.308 -0.083 17890 174 1 . 1 1 39 39 ALA CB C 39 21.349 21.349 20.960 0.389 17890 175 1 . 1 1 39 39 ALA H H 39 8.773 8.773 8.610 0.164 17890 176 1 . 1 1 40 40 LEU N N 40 126.771 126.771 123.538 3.233 17890 177 1 . 1 1 40 40 LEU HA H 40 4.354 4.354 4.556 -0.202 17890 178 1 . 1 1 40 40 LEU C C 40 178.309 178.309 176.565 1.744 17890 179 1 . 1 1 40 40 LEU CA C 40 56.845 56.845 56.002 0.843 17890 180 1 . 1 1 40 40 LEU CB C 40 43.323 43.323 42.854 0.469 17890 181 1 . 1 1 40 40 LEU H H 40 9.665 9.665 8.727 0.938 17890 182 1 . 1 1 41 41 THR N N 41 126.578 126.578 124.842 1.736 17890 183 1 . 1 1 41 41 THR HA H 41 4.916 4.916 5.185 -0.269 17890 184 1 . 1 1 41 41 THR C C 41 172.547 172.547 173.473 -0.926 17890 185 1 . 1 1 41 41 THR CA C 41 63.253 63.253 61.502 1.751 17890 186 1 . 1 1 41 41 THR CB C 41 71.832 71.832 70.572 1.260 17890 187 1 . 1 1 41 41 THR H H 41 9.802 9.802 9.111 0.691 17890 188 1 . 1 1 42 42 TYR N N 42 130.506 130.506 129.605 0.901 17890 189 1 . 1 1 42 42 TYR HA H 42 5.102 5.102 4.609 0.493 17890 190 1 . 1 1 42 42 TYR CA C 42 53.986 53.986 57.900 -3.914 17890 191 1 . 1 1 42 42 TYR CB C 42 39.155 39.155 39.157 -0.002 17890 192 1 . 1 1 42 42 TYR H H 42 9.428 9.428 8.924 0.504 17890 193 1 . 1 1 43 43 PRO HA H 43 4.490 4.490 4.384 0.106 17890 194 1 . 1 1 43 43 PRO CA C 43 63.573 63.573 63.110 0.463 17890 195 1 . 1 1 43 43 PRO CB C 43 32.644 32.644 32.617 0.027 17890 196 1 . 1 1 44 44 GLY N N 44 113.736 113.736 106.317 7.419 17890 197 1 . 1 1 44 44 GLY C C 44 171.790 171.790 173.281 -1.491 17890 198 1 . 1 1 44 44 GLY CA C 44 45.716 45.716 44.973 0.743 17890 199 1 . 1 1 44 44 GLY H H 44 8.337 8.337 7.483 0.854 17890 200 1 . 1 1 45 45 ARG N N 45 113.899 113.899 116.710 -2.811 17890 201 1 . 1 1 45 45 ARG HA H 45 4.576 4.576 4.544 0.032 17890 202 1 . 1 1 45 45 ARG C C 45 175.151 175.151 173.749 1.402 17890 203 1 . 1 1 45 45 ARG CA C 45 54.165 54.165 54.352 -0.187 17890 204 1 . 1 1 45 45 ARG CB C 45 33.219 33.219 31.874 1.346 17890 205 1 . 1 1 45 45 ARG H H 45 6.463 6.463 7.338 -0.875 17890 206 1 . 1 1 46 46 GLN N N 46 119.000 119.000 118.532 0.468 17890 207 1 . 1 1 46 46 GLN HA H 46 4.449 4.449 4.486 -0.037 17890 208 1 . 1 1 46 46 GLN C C 46 177.282 177.282 176.518 0.764 17890 209 1 . 1 1 46 46 GLN CA C 46 56.613 56.613 55.253 1.359 17890 210 1 . 1 1 46 46 GLN CB C 46 30.496 30.496 29.611 0.885 17890 211 1 . 1 1 46 46 GLN H H 46 8.683 8.683 8.497 0.186 17890 212 1 . 1 1 47 47 ARG N N 47 113.526 113.526 118.469 -4.943 17890 213 1 . 1 1 47 47 ARG HA H 47 3.530 3.530 4.044 -0.514 17890 214 1 . 1 1 47 47 ARG C C 47 174.130 174.130 175.075 -0.945 17890 215 1 . 1 1 47 47 ARG CA C 47 58.816 58.816 57.165 1.651 17890 216 1 . 1 1 47 47 ARG CB C 47 29.070 29.070 27.648 1.422 17890 217 1 . 1 1 47 47 ARG H H 47 9.677 9.677 8.654 1.023 17890 218 1 . 1 1 48 48 THR N N 48 114.672 114.672 114.981 -0.309 17890 219 1 . 1 1 48 48 THR HA H 48 4.938 4.938 4.718 0.220 17890 220 1 . 1 1 48 48 THR CA C 48 59.987 59.987 59.759 0.228 17890 221 1 . 1 1 48 48 THR CB C 48 71.947 71.947 71.044 0.903 17890 222 1 . 1 1 48 48 THR H H 48 8.104 8.104 7.574 0.530 17890 223 1 . 1 1 49 49 PRO HA H 49 4.368 4.368 4.614 -0.246 17890 224 1 . 1 1 49 49 PRO C C 49 175.651 175.651 176.353 -0.702 17890 225 1 . 1 1 49 49 PRO CA C 49 64.181 64.181 63.038 1.143 17890 226 1 . 1 1 49 49 PRO CB C 49 32.697 32.697 32.205 0.492 17890 227 1 . 1 1 50 50 VAL N N 50 122.562 122.562 120.499 2.063 17890 228 1 . 1 1 50 50 VAL HA H 50 3.947 3.947 4.238 -0.291 17890 229 1 . 1 1 50 50 VAL C C 50 174.493 174.493 175.757 -1.264 17890 230 1 . 1 1 50 50 VAL CA C 50 63.811 63.811 61.199 2.612 17890 231 1 . 1 1 50 50 VAL CB C 50 32.168 32.168 34.036 -1.868 17890 232 1 . 1 1 50 50 VAL H H 50 8.123 8.123 8.341 -0.218 17890 233 1 . 1 1 51 51 THR N N 51 113.549 113.549 118.838 -5.289 17890 234 1 . 1 1 51 51 THR HA H 51 5.372 5.372 4.873 0.499 17890 235 1 . 1 1 51 51 THR C C 51 174.841 174.841 172.798 2.043 17890 236 1 . 1 1 51 51 THR CA C 51 59.196 59.196 60.835 -1.639 17890 237 1 . 1 1 51 51 THR CB C 51 72.703 72.703 71.865 0.838 17890 238 1 . 1 1 51 51 THR H H 51 7.057 7.057 8.205 -1.148 17890 239 1 . 1 1 52 52 VAL N N 52 107.374 107.374 119.646 -12.272 17890 240 1 . 1 1 52 52 VAL HA H 52 5.514 5.514 5.125 0.389 17890 241 1 . 1 1 52 52 VAL C C 52 175.697 175.697 173.944 1.753 17890 242 1 . 1 1 52 52 VAL CA C 52 58.472 58.472 59.839 -1.367 17890 243 1 . 1 1 52 52 VAL CB C 52 34.774 34.774 35.073 -0.299 17890 244 1 . 1 1 52 52 VAL H H 52 8.062 8.062 8.531 -0.469 17890 245 1 . 1 1 53 53 SER N N 53 114.662 114.662 120.944 -6.282 17890 246 1 . 1 1 53 53 SER HA H 53 4.690 4.690 4.990 -0.300 17890 247 1 . 1 1 53 53 SER CA C 53 56.828 56.828 56.097 0.731 17890 248 1 . 1 1 53 53 SER CB C 53 64.789 64.789 65.623 -0.834 17890 249 1 . 1 1 53 53 SER H H 53 8.681 8.681 9.039 -0.358 17890 250 1 . 1 1 54 54 PRO HA H 54 4.776 4.776 4.679 0.097 17890 251 1 . 1 1 54 54 PRO C C 54 177.724 177.724 176.340 1.384 17890 252 1 . 1 1 54 54 PRO CA C 54 63.425 63.425 63.029 0.396 17890 253 1 . 1 1 54 54 PRO CB C 54 32.097 32.097 32.146 -0.049 17890 254 1 . 1 1 55 55 LEU N N 55 128.655 128.655 123.535 5.120 17890 255 1 . 1 1 55 55 LEU HA H 55 4.527 4.527 4.421 0.106 17890 256 1 . 1 1 55 55 LEU C C 55 178.696 178.696 176.257 2.439 17890 257 1 . 1 1 55 55 LEU CA C 55 56.246 56.246 55.192 1.054 17890 258 1 . 1 1 55 55 LEU CB C 55 43.606 43.606 43.415 0.191 17890 259 1 . 1 1 55 55 LEU H H 55 8.675 8.675 8.251 0.424 17890 260 1 . 1 1 56 56 ASP N N 56 126.651 126.651 124.787 1.864 17890 261 1 . 1 1 56 56 ASP HA H 56 4.709 4.709 4.748 -0.039 17890 262 1 . 1 1 56 56 ASP C C 56 177.729 177.729 176.714 1.015 17890 263 1 . 1 1 56 56 ASP CA C 56 53.623 53.623 54.093 -0.470 17890 264 1 . 1 1 56 56 ASP CB C 56 41.632 41.632 42.993 -1.361 17890 265 1 . 1 1 56 56 ASP H H 56 9.683 9.683 9.012 0.671 17890 266 1 . 1 1 57 57 GLY N N 57 109.299 109.299 108.620 0.679 17890 267 1 . 1 1 57 57 GLY C C 57 174.558 174.558 174.369 0.189 17890 268 1 . 1 1 57 57 GLY CA C 57 45.955 45.955 45.055 0.900 17890 269 1 . 1 1 57 57 GLY H H 57 8.157 8.157 8.439 -0.282 17890 270 1 . 1 1 58 58 SER N N 58 116.740 116.740 115.833 0.907 17890 271 1 . 1 1 58 58 SER HA H 58 4.288 4.288 4.526 -0.238 17890 272 1 . 1 1 58 58 SER C C 58 177.252 177.252 176.057 1.195 17890 273 1 . 1 1 58 58 SER CA C 58 58.737 58.737 57.213 1.523 17890 274 1 . 1 1 58 58 SER CB C 58 64.576 64.576 64.354 0.222 17890 275 1 . 1 1 58 58 SER H H 58 8.328 8.328 7.890 0.438 17890 276 1 . 1 1 59 59 SER N N 59 119.768 119.768 119.405 0.363 17890 277 1 . 1 1 59 59 SER HA H 59 4.046 4.046 4.138 -0.092 17890 278 1 . 1 1 59 59 SER C C 59 176.671 176.671 175.787 0.884 17890 279 1 . 1 1 59 59 SER CA C 59 61.691 61.691 60.258 1.433 17890 280 1 . 1 1 59 59 SER CB C 59 63.154 63.154 62.893 0.261 17890 281 1 . 1 1 59 59 SER H H 59 9.020 9.020 8.829 0.191 17890 282 1 . 1 1 60 60 GLU N N 60 119.133 119.133 120.586 -1.453 17890 283 1 . 1 1 60 60 GLU HA H 60 4.186 4.186 4.028 0.158 17890 284 1 . 1 1 60 60 GLU C C 60 177.435 177.435 177.461 -0.026 17890 285 1 . 1 1 60 60 GLU CA C 60 60.033 60.033 58.515 1.518 17890 286 1 . 1 1 60 60 GLU CB C 60 28.226 28.226 29.604 -1.378 17890 287 1 . 1 1 60 60 GLU H H 60 8.832 8.832 7.895 0.937 17890 288 1 . 1 1 61 61 GLN N N 61 118.818 118.818 115.450 3.368 17890 289 1 . 1 1 61 61 GLN HA H 61 5.177 5.177 4.989 0.188 17890 290 1 . 1 1 61 61 GLN C C 61 173.254 173.254 175.077 -1.823 17890 291 1 . 1 1 61 61 GLN CA C 61 54.373 54.373 54.895 -0.522 17890 292 1 . 1 1 61 61 GLN CB C 61 27.922 27.922 30.110 -2.188 17890 293 1 . 1 1 61 61 GLN H H 61 7.648 7.648 7.618 0.030 17890 294 1 . 1 1 62 62 ALA N N 62 122.562 122.562 122.378 0.183 17890 295 1 . 1 1 62 62 ALA HA H 62 5.064 5.064 4.557 0.507 17890 296 1 . 1 1 62 62 ALA C C 62 176.637 176.637 175.222 1.415 17890 297 1 . 1 1 62 62 ALA CA C 62 51.179 51.179 51.107 0.072 17890 298 1 . 1 1 62 62 ALA CB C 62 20.595 20.595 21.226 -0.631 17890 299 1 . 1 1 62 62 ALA H H 62 7.315 7.315 6.965 0.350 17890 300 1 . 1 1 63 63 TRP N N 63 124.787 124.787 119.887 4.900 17890 301 1 . 1 1 63 63 TRP HA H 63 4.964 4.964 5.327 -0.363 17890 302 1 . 1 1 63 63 TRP C C 63 174.351 174.351 175.322 -0.971 17890 303 1 . 1 1 63 63 TRP CA C 63 55.902 55.902 56.123 -0.221 17890 304 1 . 1 1 63 63 TRP CB C 63 32.117 32.117 33.845 -1.728 17890 305 1 . 1 1 63 63 TRP H H 63 9.544 9.544 9.020 0.524 17890 306 1 . 1 1 64 64 ILE N N 64 122.482 122.482 119.242 3.240 17890 307 1 . 1 1 64 64 ILE HA H 64 4.694 4.694 4.979 -0.285 17890 308 1 . 1 1 64 64 ILE C C 64 177.078 177.078 174.262 2.816 17890 309 1 . 1 1 64 64 ILE CA C 64 61.031 61.031 60.572 0.459 17890 310 1 . 1 1 64 64 ILE CB C 64 40.369 40.369 41.351 -0.982 17890 311 1 . 1 1 64 64 ILE H H 64 10.235 10.235 9.400 0.835 17890 312 1 . 1 1 65 65 LEU N N 65 132.183 132.183 128.674 3.509 17890 313 1 . 1 1 65 65 LEU HA H 65 5.465 5.465 5.517 -0.052 17890 314 1 . 1 1 65 65 LEU C C 65 177.048 177.048 174.476 2.572 17890 315 1 . 1 1 65 65 LEU CA C 65 54.349 54.349 53.786 0.563 17890 316 1 . 1 1 65 65 LEU CB C 65 42.344 42.344 46.155 -3.811 17890 317 1 . 1 1 65 65 LEU H H 65 9.432 9.432 9.291 0.141 17890 318 1 . 1 1 66 66 ARG N N 66 120.807 120.807 125.573 -4.766 17890 319 1 . 1 1 66 66 ARG HA H 66 4.888 4.888 4.965 -0.077 17890 320 1 . 1 1 66 66 ARG C C 66 175.275 175.275 174.538 0.737 17890 321 1 . 1 1 66 66 ARG CA C 66 55.055 55.055 54.559 0.496 17890 322 1 . 1 1 66 66 ARG CB C 66 32.991 32.991 34.373 -1.382 17890 323 1 . 1 1 66 66 ARG H H 66 8.491 8.491 8.525 -0.034 17890 324 1 . 1 1 67 67 SER N N 67 119.709 119.709 117.629 2.079 17890 325 1 . 1 1 67 67 SER HA H 67 3.186 3.186 3.368 -0.182 17890 326 1 . 1 1 67 67 SER C C 67 174.508 174.508 173.538 0.970 17890 327 1 . 1 1 67 67 SER CA C 67 58.521 58.521 58.927 -0.406 17890 328 1 . 1 1 67 67 SER CB C 67 62.590 62.590 63.260 -0.670 17890 329 1 . 1 1 67 67 SER H H 67 8.557 8.557 8.683 -0.126 17890 330 1 . 1 1 68 68 TYR N N 68 131.011 131.011 127.495 3.516 17890 331 1 . 1 1 68 68 TYR HA H 68 4.448 4.448 4.606 -0.158 17890 332 1 . 1 1 68 68 TYR C C 68 174.687 174.687 174.814 -0.127 17890 333 1 . 1 1 68 68 TYR CA C 68 59.765 59.765 59.007 0.758 17890 334 1 . 1 1 68 68 TYR CB C 68 38.988 38.988 41.002 -2.013 17890 335 1 . 1 1 68 68 TYR H H 68 8.531 8.531 8.594 -0.063 17890 336 1 . 1 1 69 69 ASP N N 69 117.066 117.066 120.010 -2.944 17890 337 1 . 1 1 69 69 ASP HA H 69 4.625 4.625 4.851 -0.226 17890 338 1 . 1 1 69 69 ASP C C 69 176.455 176.455 176.174 0.281 17890 339 1 . 1 1 69 69 ASP CA C 69 53.091 53.091 53.891 -0.800 17890 340 1 . 1 1 69 69 ASP CB C 69 42.147 42.147 42.863 -0.716 17890 341 1 . 1 1 69 69 ASP H H 69 7.122 7.122 7.655 -0.533 17890 342 1 . 1 1 70 70 SER N N 70 122.869 122.869 119.736 3.133 17890 343 1 . 1 1 70 70 SER HA H 70 4.270 4.270 4.085 0.185 17890 344 1 . 1 1 70 70 SER C C 70 177.010 177.010 176.063 0.947 17890 345 1 . 1 1 70 70 SER CA C 70 60.837 60.837 61.422 -0.585 17890 346 1 . 1 1 70 70 SER CB C 70 62.722 62.722 63.230 -0.508 17890 347 1 . 1 1 70 70 SER H H 70 8.757 8.757 8.774 -0.017 17890 348 1 . 1 1 71 71 ASN N N 71 119.873 119.873 119.033 0.840 17890 349 1 . 1 1 71 71 ASN HA H 71 4.571 4.571 4.595 -0.024 17890 350 1 . 1 1 71 71 ASN C C 71 176.226 176.226 176.015 0.211 17890 351 1 . 1 1 71 71 ASN CA C 71 55.714 55.714 55.264 0.450 17890 352 1 . 1 1 71 71 ASN CB C 71 38.641 38.641 38.379 0.262 17890 353 1 . 1 1 71 71 ASN H H 71 8.342 8.342 8.617 -0.275 17890 354 1 . 1 1 72 72 SER N N 72 112.202 112.202 113.189 -0.987 17890 355 1 . 1 1 72 72 SER HA H 72 4.567 4.567 4.696 -0.129 17890 356 1 . 1 1 72 72 SER C C 72 173.789 173.789 173.434 0.355 17890 357 1 . 1 1 72 72 SER CA C 72 57.816 57.816 57.638 0.178 17890 358 1 . 1 1 72 72 SER CB C 72 63.935 63.935 64.342 -0.407 17890 359 1 . 1 1 72 72 SER H H 72 7.560 7.560 7.738 -0.178 17890 360 1 . 1 1 73 73 ASN N N 73 117.437 117.437 118.663 -1.226 17890 361 1 . 1 1 73 73 ASN HA H 73 4.534 4.534 4.421 0.113 17890 362 1 . 1 1 73 73 ASN C C 73 173.647 173.647 174.191 -0.544 17890 363 1 . 1 1 73 73 ASN CA C 73 54.523 54.523 54.514 0.009 17890 364 1 . 1 1 73 73 ASN CB C 73 37.213 37.213 37.065 0.148 17890 365 1 . 1 1 73 73 ASN H H 73 7.940 7.940 7.937 0.004 17890 366 1 . 1 1 74 74 THR N N 74 104.227 104.227 109.180 -4.953 17890 367 1 . 1 1 74 74 THR HA H 74 5.477 5.477 5.019 0.458 17890 368 1 . 1 1 74 74 THR C C 74 176.824 176.824 173.900 2.924 17890 369 1 . 1 1 74 74 THR CA C 74 59.768 59.768 61.542 -1.774 17890 370 1 . 1 1 74 74 THR CB C 74 71.985 71.985 70.060 1.925 17890 371 1 . 1 1 74 74 THR H H 74 7.737 7.737 7.804 -0.067 17890 372 1 . 1 1 75 75 TRP N N 75 124.636 124.636 123.461 1.175 17890 373 1 . 1 1 75 75 TRP HA H 75 5.207 5.207 5.382 -0.175 17890 374 1 . 1 1 75 75 TRP C C 75 175.876 175.876 176.204 -0.328 17890 375 1 . 1 1 75 75 TRP CA C 75 57.606 57.606 56.209 1.397 17890 376 1 . 1 1 75 75 TRP CB C 75 33.516 33.516 33.567 -0.051 17890 377 1 . 1 1 75 75 TRP H H 75 9.442 9.442 9.171 0.271 17890 378 1 . 1 1 76 76 THR N N 76 110.544 110.544 114.778 -4.234 17890 379 1 . 1 1 76 76 THR HA H 76 5.129 5.129 5.035 0.094 17890 380 1 . 1 1 76 76 THR C C 76 174.506 174.506 174.415 0.091 17890 381 1 . 1 1 76 76 THR CA C 76 60.561 60.561 61.505 -0.944 17890 382 1 . 1 1 76 76 THR CB C 76 71.688 71.688 70.095 1.593 17890 383 1 . 1 1 76 76 THR H H 76 9.415 9.415 9.381 0.034 17890 384 1 . 1 1 77 77 ILE N N 77 121.567 121.567 124.064 -2.497 17890 385 1 . 1 1 77 77 ILE HA H 77 5.139 5.139 5.213 -0.074 17890 386 1 . 1 1 77 77 ILE C C 77 176.148 176.148 175.072 1.076 17890 387 1 . 1 1 77 77 ILE CA C 77 61.708 61.708 59.700 2.009 17890 388 1 . 1 1 77 77 ILE CB C 77 40.987 40.987 39.792 1.195 17890 389 1 . 1 1 77 77 ILE H H 77 9.255 9.255 8.462 0.793 17890 390 1 . 1 1 78 78 SER N N 78 122.269 122.269 121.566 0.703 17890 391 1 . 1 1 78 78 SER HA H 78 5.601 5.601 5.289 0.312 17890 392 1 . 1 1 78 78 SER CA C 78 55.835 55.835 55.928 -0.093 17890 393 1 . 1 1 78 78 SER CB C 78 65.858 65.858 66.378 -0.519 17890 394 1 . 1 1 78 78 SER H H 78 9.226 9.226 8.726 0.500 17890 395 1 . 1 1 79 79 PRO HA H 79 3.864 3.864 4.214 -0.350 17890 396 1 . 1 1 79 79 PRO C C 79 178.175 178.175 177.336 0.839 17890 397 1 . 1 1 79 79 PRO CA C 79 62.884 62.884 62.211 0.673 17890 398 1 . 1 1 79 79 PRO CB C 79 30.272 30.272 31.899 -1.627 17890 399 1 . 1 1 80 80 VAL N N 80 121.906 121.906 119.777 2.129 17890 400 1 . 1 1 80 80 VAL HA H 80 3.581 3.581 3.787 -0.206 17890 401 1 . 1 1 80 80 VAL C C 80 177.751 177.751 176.942 0.809 17890 402 1 . 1 1 80 80 VAL CA C 80 66.067 66.067 64.722 1.344 17890 403 1 . 1 1 80 80 VAL CB C 80 31.485 31.485 31.304 0.181 17890 404 1 . 1 1 80 80 VAL H H 80 7.328 7.328 7.949 -0.621 17890 405 1 . 1 1 81 81 GLY N N 81 104.643 104.643 106.867 -2.224 17890 406 1 . 1 1 81 81 GLY C C 81 174.979 174.979 174.528 0.451 17890 407 1 . 1 1 81 81 GLY CA C 81 45.088 45.088 45.313 -0.225 17890 408 1 . 1 1 81 81 GLY H H 81 8.949 8.949 8.115 0.834 17890 409 1 . 1 1 82 82 SER N N 82 111.865 111.865 115.770 -3.904 17890 410 1 . 1 1 82 82 SER HA H 82 4.646 4.646 4.855 -0.209 17890 411 1 . 1 1 82 82 SER CA C 82 55.441 55.441 55.611 -0.170 17890 412 1 . 1 1 82 82 SER CB C 82 62.277 62.277 63.773 -1.496 17890 413 1 . 1 1 82 82 SER H H 82 6.968 6.968 7.199 -0.231 17890 414 1 . 1 1 83 83 PRO HA H 83 4.347 4.347 4.546 -0.199 17890 415 1 . 1 1 83 83 PRO C C 83 176.660 176.660 176.658 0.002 17890 416 1 . 1 1 83 83 PRO CA C 83 65.203 65.203 64.457 0.746 17890 417 1 . 1 1 83 83 PRO CB C 83 32.819 32.819 31.887 0.932 17890 418 1 . 1 1 84 84 ASN N N 84 116.542 116.542 114.731 1.811 17890 419 1 . 1 1 84 84 ASN HA H 84 5.001 5.001 4.622 0.379 17890 420 1 . 1 1 84 84 ASN C C 84 175.825 175.825 174.959 0.866 17890 421 1 . 1 1 84 84 ASN CA C 84 52.891 52.891 53.730 -0.839 17890 422 1 . 1 1 84 84 ASN CB C 84 38.744 38.744 38.167 0.577 17890 423 1 . 1 1 84 84 ASN H H 84 8.502 8.502 8.423 0.079 17890 424 1 . 1 1 85 85 SER N N 85 114.633 114.633 113.170 1.463 17890 425 1 . 1 1 85 85 SER HA H 85 4.624 4.624 4.926 -0.302 17890 426 1 . 1 1 85 85 SER C C 85 172.963 172.963 172.455 0.508 17890 427 1 . 1 1 85 85 SER CA C 85 59.210 59.210 57.505 1.705 17890 428 1 . 1 1 85 85 SER CB C 85 64.697 64.697 66.437 -1.740 17890 429 1 . 1 1 85 85 SER H H 85 7.980 7.980 7.767 0.213 17890 430 1 . 1 1 86 86 GLN N N 86 119.016 119.016 118.059 0.957 17890 431 1 . 1 1 86 86 GLN HA H 86 5.446 5.446 5.429 0.017 17890 432 1 . 1 1 86 86 GLN CA C 86 54.452 54.452 54.472 -0.020 17890 433 1 . 1 1 86 86 GLN CB C 86 34.398 34.398 34.182 0.216 17890 434 1 . 1 1 86 86 GLN H H 86 9.399 9.399 9.080 0.319 17890 435 1 . 1 1 87 87 ILE N N 87 119.691 119.691 119.842 -0.151 17890 436 1 . 1 1 87 87 ILE HA H 87 4.575 4.575 5.176 -0.601 17890 437 1 . 1 1 87 87 ILE C C 87 176.505 176.505 176.084 0.421 17890 438 1 . 1 1 87 87 ILE CA C 87 63.494 63.494 58.977 4.517 17890 439 1 . 1 1 87 87 ILE CB C 87 38.197 38.197 38.910 -0.713 17890 440 1 . 1 1 87 87 ILE H H 87 8.970 8.970 8.347 0.622 17890 441 1 . 1 1 88 88 GLY N N 88 118.378 118.378 114.679 3.699 17890 442 1 . 1 1 88 88 GLY C C 88 171.397 171.397 171.711 -0.314 17890 443 1 . 1 1 88 88 GLY CA C 88 43.604 43.604 44.962 -1.358 17890 444 1 . 1 1 88 88 GLY H H 88 9.752 9.752 9.093 0.659 17890 445 1 . 1 1 89 89 TRP N N 89 122.749 122.749 122.091 0.658 17890 446 1 . 1 1 89 89 TRP HA H 89 4.598 4.598 5.398 -0.800 17890 447 1 . 1 1 89 89 TRP C C 89 175.924 175.924 174.852 1.072 17890 448 1 . 1 1 89 89 TRP CA C 89 56.283 56.283 56.081 0.202 17890 449 1 . 1 1 89 89 TRP CB C 89 30.086 30.086 32.492 -2.406 17890 450 1 . 1 1 89 89 TRP H H 89 8.215 8.215 8.261 -0.046 17890 451 1 . 1 1 90 90 GLY N N 90 116.305 116.305 110.907 5.398 17890 452 1 . 1 1 90 90 GLY C C 90 173.725 173.725 172.592 1.133 17890 453 1 . 1 1 90 90 GLY CA C 90 45.055 45.055 44.550 0.505 17890 454 1 . 1 1 90 90 GLY H H 90 8.922 8.922 8.200 0.722 17890 455 1 . 1 1 91 91 ALA N N 91 123.795 123.795 122.072 1.723 17890 456 1 . 1 1 91 91 ALA HA H 91 4.243 4.243 4.161 0.082 17890 457 1 . 1 1 91 91 ALA C C 91 178.510 178.510 178.942 -0.432 17890 458 1 . 1 1 91 91 ALA CA C 91 53.490 53.490 53.446 0.044 17890 459 1 . 1 1 91 91 ALA CB C 91 18.409 18.409 18.792 -0.383 17890 460 1 . 1 1 91 91 ALA H H 91 8.367 8.367 8.162 0.205 17890 461 1 . 1 1 92 92 GLY N N 92 108.871 108.871 112.677 -3.806 17890 462 1 . 1 1 92 92 GLY C C 92 174.528 174.528 174.816 -0.288 17890 463 1 . 1 1 92 92 GLY CA C 92 45.258 45.258 44.742 0.516 17890 464 1 . 1 1 92 92 GLY H H 92 8.776 8.776 8.619 0.157 17890 465 1 . 1 1 93 93 ASN N N 93 114.921 114.921 117.305 -2.384 17890 466 1 . 1 1 93 93 ASN HA H 93 4.449 4.449 4.769 -0.320 17890 467 1 . 1 1 93 93 ASN C C 93 172.774 172.774 173.945 -1.171 17890 468 1 . 1 1 93 93 ASN CA C 93 54.973 54.973 54.341 0.632 17890 469 1 . 1 1 93 93 ASN CB C 93 36.329 36.329 37.037 -0.708 17890 470 1 . 1 1 93 93 ASN H H 93 8.647 8.647 8.294 0.353 17890 471 1 . 1 1 94 94 VAL N N 94 112.437 112.437 115.164 -2.727 17890 472 1 . 1 1 94 94 VAL HA H 94 5.065 5.065 4.636 0.429 17890 473 1 . 1 1 94 94 VAL CA C 94 56.915 56.915 58.223 -1.308 17890 474 1 . 1 1 94 94 VAL CB C 94 34.155 34.155 35.056 -0.901 17890 475 1 . 1 1 94 94 VAL H H 94 6.989 6.989 7.480 -0.491 17890 476 1 . 1 1 95 95 PRO HA H 95 4.928 4.928 4.972 -0.044 17890 477 1 . 1 1 95 95 PRO C C 95 176.041 176.041 175.938 0.103 17890 478 1 . 1 1 95 95 PRO CA C 95 61.201 61.201 62.449 -1.248 17890 479 1 . 1 1 95 95 PRO CB C 95 30.725 30.725 31.623 -0.898 17890 480 1 . 1 1 96 96 VAL N N 96 113.564 113.564 116.533 -2.969 17890 481 1 . 1 1 96 96 VAL HA H 96 4.735 4.735 4.906 -0.171 17890 482 1 . 1 1 96 96 VAL C C 96 173.656 173.656 175.007 -1.351 17890 483 1 . 1 1 96 96 VAL CA C 96 58.853 58.853 59.234 -0.381 17890 484 1 . 1 1 96 96 VAL CB C 96 37.153 37.153 35.536 1.617 17890 485 1 . 1 1 96 96 VAL H H 96 8.199 8.199 8.853 -0.654 17890 486 1 . 1 1 97 97 VAL N N 97 122.328 122.328 123.040 -0.712 17890 487 1 . 1 1 97 97 VAL HA H 97 4.631 4.631 4.689 -0.058 17890 488 1 . 1 1 97 97 VAL C C 97 174.776 174.776 175.568 -0.792 17890 489 1 . 1 1 97 97 VAL CA C 97 63.657 63.657 63.101 0.556 17890 490 1 . 1 1 97 97 VAL CB C 97 31.128 31.128 31.943 -0.815 17890 491 1 . 1 1 97 97 VAL H H 97 8.957 8.957 8.281 0.676 17890 492 1 . 1 1 98 98 LEU N N 98 130.258 130.258 126.328 3.930 17890 493 1 . 1 1 98 98 LEU HA H 98 5.050 5.050 4.960 0.090 17890 494 1 . 1 1 98 98 LEU CA C 98 52.823 52.823 51.583 1.240 17890 495 1 . 1 1 98 98 LEU CB C 98 46.118 46.118 45.061 1.057 17890 496 1 . 1 1 98 98 LEU H H 98 9.245 9.245 9.110 0.135 17890 497 1 . 1 1 99 99 PRO HA H 99 4.779 4.779 4.780 -0.001 17890 498 1 . 1 1 99 99 PRO CA C 99 61.489 61.489 61.127 0.362 17890 499 1 . 1 1 99 99 PRO CB C 99 30.454 30.454 31.052 -0.598 17890 500 1 . 1 1 100 100 PRO HA H 100 3.985 3.985 4.577 -0.592 17890 501 1 . 1 1 100 100 PRO C C 100 177.309 177.309 175.790 1.519 17890 502 1 . 1 1 100 100 PRO CA C 100 63.824 63.824 63.266 0.558 17890 503 1 . 1 1 100 100 PRO CB C 100 32.105 32.105 31.980 0.125 17890 504 1 . 1 1 101 101 ASN N N 101 119.284 119.284 124.962 -5.678 17890 505 1 . 1 1 101 101 ASN HA H 101 4.542 4.542 4.634 -0.092 17890 506 1 . 1 1 101 101 ASN C C 101 171.920 171.920 173.988 -2.068 17890 507 1 . 1 1 101 101 ASN CA C 101 53.200 53.200 53.593 -0.392 17890 508 1 . 1 1 101 101 ASN CB C 101 37.625 37.625 39.468 -1.843 17890 509 1 . 1 1 101 101 ASN H H 101 7.273 7.273 9.180 -1.907 17890 510 1 . 1 1 102 102 ASN N N 102 115.674 115.674 116.543 -0.869 17890 511 1 . 1 1 102 102 ASN HA H 102 3.918 3.918 4.695 -0.777 17890 512 1 . 1 1 102 102 ASN C C 102 173.264 173.264 174.174 -0.910 17890 513 1 . 1 1 102 102 ASN CA C 102 54.039 54.039 52.918 1.121 17890 514 1 . 1 1 102 102 ASN CB C 102 36.982 36.982 38.232 -1.250 17890 515 1 . 1 1 102 102 ASN H H 102 8.197 8.197 7.854 0.343 17890 516 1 . 1 1 103 103 TYR N N 103 118.775 118.775 120.813 -2.038 17890 517 1 . 1 1 103 103 TYR HA H 103 4.485 4.485 4.322 0.163 17890 518 1 . 1 1 103 103 TYR C C 103 175.248 175.248 174.984 0.264 17890 519 1 . 1 1 103 103 TYR CA C 103 57.490 57.490 59.714 -2.224 17890 520 1 . 1 1 103 103 TYR CB C 103 37.532 37.532 38.527 -0.995 17890 521 1 . 1 1 103 103 TYR H H 103 7.745 7.745 7.426 0.319 17890 522 1 . 1 1 104 104 VAL N N 104 116.205 116.205 115.312 0.893 17890 523 1 . 1 1 104 104 VAL HA H 104 4.977 4.977 4.927 0.050 17890 524 1 . 1 1 104 104 VAL C C 104 174.361 174.361 173.658 0.703 17890 525 1 . 1 1 104 104 VAL CA C 104 58.251 58.251 59.860 -1.609 17890 526 1 . 1 1 104 104 VAL CB C 104 35.543 35.543 35.510 0.033 17890 527 1 . 1 1 104 104 VAL H H 104 7.498 7.498 7.992 -0.494 17890 528 1 . 1 1 105 105 TRP N N 105 119.557 119.557 119.810 -0.253 17890 529 1 . 1 1 105 105 TRP HA H 105 4.875 4.875 5.086 -0.211 17890 530 1 . 1 1 105 105 TRP C C 105 175.526 175.526 176.251 -0.725 17890 531 1 . 1 1 105 105 TRP CA C 105 54.884 54.884 55.371 -0.487 17890 532 1 . 1 1 105 105 TRP CB C 105 32.539 32.539 32.586 -0.047 17890 533 1 . 1 1 105 105 TRP H H 105 8.926 8.926 8.968 -0.042 17890 534 1 . 1 1 106 106 THR N N 106 120.480 120.480 119.853 0.627 17890 535 1 . 1 1 106 106 THR HA H 106 4.966 4.966 4.846 0.120 17890 536 1 . 1 1 106 106 THR C C 106 174.177 174.177 174.096 0.081 17890 537 1 . 1 1 106 106 THR CA C 106 62.091 62.091 64.009 -1.918 17890 538 1 . 1 1 106 106 THR CB C 106 69.649 69.649 69.194 0.455 17890 539 1 . 1 1 106 106 THR H H 106 9.525 9.525 9.171 0.354 17890 540 1 . 1 1 107 107 LEU N N 107 127.146 127.146 129.327 -2.181 17890 541 1 . 1 1 107 107 LEU HA H 107 4.827 4.827 5.148 -0.321 17890 542 1 . 1 1 107 107 LEU CA C 107 53.709 53.709 53.454 0.255 17890 543 1 . 1 1 107 107 LEU CB C 107 41.523 41.523 43.084 -1.561 17890 544 1 . 1 1 107 107 LEU H H 107 7.591 7.591 8.793 -1.202 17890 545 1 . 1 1 108 108 THR N N 108 119.928 119.928 120.087 -0.159 17890 546 1 . 1 1 108 108 THR HA H 108 4.411 4.411 4.588 -0.177 17890 547 1 . 1 1 108 108 THR C C 108 173.319 173.319 173.222 0.097 17890 548 1 . 1 1 108 108 THR CA C 108 62.243 62.243 61.841 0.402 17890 549 1 . 1 1 108 108 THR CB C 108 70.138 70.138 70.869 -0.731 17890 550 1 . 1 1 108 108 THR H H 108 8.141 8.141 8.575 -0.434 17890 551 1 . 1 1 109 109 LEU N N 109 130.557 130.557 129.261 1.296 17890 552 1 . 1 1 109 109 LEU HA H 109 3.545 3.545 3.948 -0.403 17890 553 1 . 1 1 109 109 LEU C C 109 175.217 175.217 176.570 -1.353 17890 554 1 . 1 1 109 109 LEU CA C 109 55.286 55.286 55.202 0.084 17890 555 1 . 1 1 109 109 LEU CB C 109 40.606 40.606 42.836 -2.230 17890 556 1 . 1 1 109 109 LEU H H 109 8.924 8.924 8.670 0.254 17890 557 1 . 1 1 110 110 THR N N 110 120.160 120.160 115.301 4.859 17890 558 1 . 1 1 110 110 THR HA H 110 4.911 4.911 4.681 0.230 17890 559 1 . 1 1 110 110 THR CA C 110 60.141 60.141 60.339 -0.198 17890 560 1 . 1 1 110 110 THR CB C 110 72.785 72.785 70.874 1.911 17890 561 1 . 1 1 110 110 THR H H 110 7.677 7.677 8.501 -0.824 17890 562 1 . 1 1 111 111 SER HA H 111 4.204 4.204 4.232 -0.028 17890 563 1 . 1 1 111 111 SER C C 111 174.755 174.755 174.964 -0.209 17890 564 1 . 1 1 111 111 SER CA C 111 60.710 60.710 59.879 0.831 17890 565 1 . 1 1 111 111 SER CB C 111 62.660 62.660 62.949 -0.289 17890 566 1 . 1 1 112 112 GLY N N 112 107.313 107.313 106.913 0.400 17890 567 1 . 1 1 112 112 GLY C C 112 173.023 173.023 172.847 0.176 17890 568 1 . 1 1 112 112 GLY CA C 112 44.150 44.150 45.115 -0.965 17890 569 1 . 1 1 112 112 GLY H H 112 8.249 8.249 7.469 0.780 17890 570 1 . 1 1 113 113 GLY N N 113 105.618 105.618 107.751 -2.133 17890 571 1 . 1 1 113 113 GLY C C 113 175.844 175.844 171.807 4.037 17890 572 1 . 1 1 113 113 GLY CA C 113 42.759 42.759 45.866 -3.107 17890 573 1 . 1 1 113 113 GLY H H 113 7.444 7.444 7.387 0.057 17890 574 1 . 1 1 114 114 TYR N N 114 121.548 121.548 118.077 3.471 17890 575 1 . 1 1 114 114 TYR HA H 114 4.852 4.852 5.422 -0.570 17890 576 1 . 1 1 114 114 TYR C C 114 175.605 175.605 174.218 1.387 17890 577 1 . 1 1 114 114 TYR CA C 114 61.263 61.263 56.649 4.614 17890 578 1 . 1 1 114 114 TYR CB C 114 38.933 38.933 43.525 -4.592 17890 579 1 . 1 1 114 114 TYR H H 114 9.677 9.677 8.975 0.702 17890 580 1 . 1 1 115 115 ASN N N 115 123.274 123.274 117.458 5.816 17890 581 1 . 1 1 115 115 ASN HA H 115 5.098 5.098 5.218 -0.120 17890 582 1 . 1 1 115 115 ASN C C 115 174.355 174.355 173.188 1.167 17890 583 1 . 1 1 115 115 ASN CA C 115 51.046 51.046 52.285 -1.239 17890 584 1 . 1 1 115 115 ASN CB C 115 40.349 40.349 42.724 -2.375 17890 585 1 . 1 1 115 115 ASN H H 115 9.350 9.350 8.968 0.382 17890 586 1 . 1 1 116 116 ILE N N 116 130.611 130.611 122.551 8.060 17890 587 1 . 1 1 116 116 ILE HA H 116 4.239 4.239 4.745 -0.506 17890 588 1 . 1 1 116 116 ILE C C 116 173.998 173.998 174.004 -0.006 17890 589 1 . 1 1 116 116 ILE CA C 116 62.199 62.199 60.063 2.136 17890 590 1 . 1 1 116 116 ILE CB C 116 37.100 37.100 39.413 -2.313 17890 591 1 . 1 1 116 116 ILE H H 116 9.473 9.473 8.509 0.964 17890 592 1 . 1 1 117 117 GLN N N 117 121.633 121.633 125.089 -3.456 17890 593 1 . 1 1 117 117 GLN HA H 117 5.935 5.935 5.028 0.907 17890 594 1 . 1 1 117 117 GLN C C 117 177.902 177.902 175.863 2.039 17890 595 1 . 1 1 117 117 GLN CA C 117 53.320 53.320 53.922 -0.602 17890 596 1 . 1 1 117 117 GLN CB C 117 37.457 37.457 33.516 3.941 17890 597 1 . 1 1 117 117 GLN H H 117 8.781 8.781 8.672 0.109 17890 598 1 . 1 1 118 118 ASP N N 118 116.836 116.836 120.369 -3.533 17890 599 1 . 1 1 118 118 ASP HA H 118 4.783 4.783 3.941 0.842 17890 600 1 . 1 1 118 118 ASP C C 118 178.084 178.084 176.814 1.270 17890 601 1 . 1 1 118 118 ASP CA C 118 54.770 54.770 56.319 -1.549 17890 602 1 . 1 1 118 118 ASP CB C 118 40.368 40.368 41.199 -0.831 17890 603 1 . 1 1 118 118 ASP H H 118 9.330 9.330 8.731 0.599 17890 604 1 . 1 1 119 119 GLY N N 119 111.037 111.037 107.580 3.457 17890 605 1 . 1 1 119 119 GLY C C 119 174.196 174.196 175.310 -1.114 17890 606 1 . 1 1 119 119 GLY CA C 119 46.976 46.976 44.996 1.980 17890 607 1 . 1 1 119 119 GLY H H 119 8.986 8.986 8.372 0.614 17890 608 1 . 1 1 120 120 LYS N N 120 114.809 114.809 121.918 -7.109 17890 609 1 . 1 1 120 120 LYS HA H 120 4.349 4.349 4.487 -0.138 17890 610 1 . 1 1 120 120 LYS C C 120 175.174 175.174 176.462 -1.288 17890 611 1 . 1 1 120 120 LYS CA C 120 55.933 55.933 54.819 1.114 17890 612 1 . 1 1 120 120 LYS CB C 120 32.476 32.476 32.548 -0.072 17890 613 1 . 1 1 120 120 LYS H H 120 7.045 7.045 8.574 -1.529 17890 614 1 . 1 1 121 121 ARG N N 121 116.291 116.291 113.948 2.343 17890 615 1 . 1 1 121 121 ARG HA H 121 3.586 3.586 4.072 -0.486 17890 616 1 . 1 1 121 121 ARG C C 121 175.097 175.097 177.076 -1.979 17890 617 1 . 1 1 121 121 ARG CA C 121 58.069 58.069 57.088 0.981 17890 618 1 . 1 1 121 121 ARG CB C 121 26.623 26.623 26.911 -0.288 17890 619 1 . 1 1 121 121 ARG H H 121 7.683 7.683 8.183 -0.500 17890 620 1 . 1 1 122 122 THR N N 122 113.730 113.730 109.512 4.218 17890 621 1 . 1 1 122 122 THR HA H 122 4.540 4.540 4.222 0.318 17890 622 1 . 1 1 122 122 THR C C 122 175.302 175.302 174.591 0.711 17890 623 1 . 1 1 122 122 THR CA C 122 62.871 62.871 64.207 -1.336 17890 624 1 . 1 1 122 122 THR CB C 122 71.552 71.552 69.852 1.700 17890 625 1 . 1 1 122 122 THR H H 122 11.059 11.059 8.133 2.926 17890 626 1 . 1 1 123 123 VAL N N 123 118.350 118.350 114.341 4.009 17890 627 1 . 1 1 123 123 VAL HA H 123 4.810 4.810 4.664 0.146 17890 628 1 . 1 1 123 123 VAL C C 123 174.730 174.730 173.616 1.114 17890 629 1 . 1 1 123 123 VAL CA C 123 60.311 60.311 59.954 0.357 17890 630 1 . 1 1 123 123 VAL CB C 123 37.082 37.082 34.852 2.230 17890 631 1 . 1 1 123 123 VAL H H 123 8.181 8.181 7.555 0.626 17890 632 1 . 1 1 124 124 SER N N 124 113.053 113.053 114.053 -1.000 17890 633 1 . 1 1 124 124 SER HA H 124 5.820 5.820 5.197 0.623 17890 634 1 . 1 1 124 124 SER C C 124 175.521 175.521 173.547 1.974 17890 635 1 . 1 1 124 124 SER CA C 124 58.087 58.087 56.789 1.298 17890 636 1 . 1 1 124 124 SER CB C 124 67.405 67.405 65.847 1.558 17890 637 1 . 1 1 124 124 SER H H 124 9.138 9.138 8.645 0.493 17890 638 1 . 1 1 125 125 TRP N N 125 124.900 124.900 124.350 0.550 17890 639 1 . 1 1 125 125 TRP HA H 125 5.610 5.610 5.006 0.604 17890 640 1 . 1 1 125 125 TRP C C 125 178.114 178.114 177.433 0.681 17890 641 1 . 1 1 125 125 TRP CA C 125 55.474 55.474 56.235 -0.761 17890 642 1 . 1 1 125 125 TRP CB C 125 30.023 30.023 29.025 0.998 17890 643 1 . 1 1 125 125 TRP H H 125 8.843 8.843 8.121 0.722 17890 644 1 . 1 1 126 126 SER N N 126 119.243 119.243 113.936 5.307 17890 645 1 . 1 1 126 126 SER HA H 126 5.443 5.443 5.315 0.128 17890 646 1 . 1 1 126 126 SER C C 126 171.668 171.668 172.851 -1.183 17890 647 1 . 1 1 126 126 SER CA C 126 58.696 58.696 57.178 1.518 17890 648 1 . 1 1 126 126 SER CB C 126 66.176 66.176 66.268 -0.092 17890 649 1 . 1 1 126 126 SER H H 126 9.835 9.835 9.270 0.565 17890 650 1 . 1 1 127 127 LEU N N 127 113.708 113.708 118.196 -4.488 17890 651 1 . 1 1 127 127 LEU HA H 127 5.155 5.155 4.695 0.460 17890 652 1 . 1 1 127 127 LEU C C 127 176.563 176.563 176.776 -0.213 17890 653 1 . 1 1 127 127 LEU CA C 127 52.645 52.645 53.296 -0.651 17890 654 1 . 1 1 127 127 LEU CB C 127 43.696 43.696 45.273 -1.577 17890 655 1 . 1 1 127 127 LEU H H 127 6.559 6.559 8.217 -1.658 17890 656 1 . 1 1 128 128 ASN N N 128 121.739 121.739 118.809 2.930 17890 657 1 . 1 1 128 128 ASN HA H 128 4.689 4.689 4.892 -0.203 17890 658 1 . 1 1 128 128 ASN C C 128 175.452 175.452 175.480 -0.028 17890 659 1 . 1 1 128 128 ASN CA C 128 56.007 56.007 54.952 1.055 17890 660 1 . 1 1 128 128 ASN CB C 128 39.291 39.291 40.151 -0.860 17890 661 1 . 1 1 128 128 ASN H H 128 8.662 8.662 9.252 -0.590 17890 662 1 . 1 1 129 129 ASN N N 129 119.586 119.586 116.067 3.519 17890 663 1 . 1 1 129 129 ASN HA H 129 4.997 4.997 4.892 0.105 17890 664 1 . 1 1 129 129 ASN C C 129 175.900 175.900 174.720 1.180 17890 665 1 . 1 1 129 129 ASN CA C 129 54.233 54.233 53.196 1.037 17890 666 1 . 1 1 129 129 ASN CB C 129 41.256 41.256 40.403 0.853 17890 667 1 . 1 1 129 129 ASN H H 129 10.962 10.962 8.631 2.331 17890 668 1 . 1 1 130 130 ALA N N 130 128.292 128.292 122.053 6.239 17890 669 1 . 1 1 130 130 ALA HA H 130 3.570 3.570 4.015 -0.445 17890 670 1 . 1 1 130 130 ALA C C 130 172.620 172.620 176.558 -3.938 17890 671 1 . 1 1 130 130 ALA CA C 130 52.639 52.639 53.355 -0.716 17890 672 1 . 1 1 130 130 ALA CB C 130 16.100 16.100 17.207 -1.107 17890 673 1 . 1 1 130 130 ALA H H 130 10.629 10.629 8.464 2.165 17890 674 1 . 1 1 131 131 THR N N 131 105.584 105.584 110.435 -4.851 17890 675 1 . 1 1 131 131 THR HA H 131 4.462 4.462 4.335 0.127 17890 676 1 . 1 1 131 131 THR C C 131 173.552 173.552 174.709 -1.157 17890 677 1 . 1 1 131 131 THR CA C 131 58.338 58.338 60.860 -2.522 17890 678 1 . 1 1 131 131 THR CB C 131 71.569 71.569 70.048 1.521 17890 679 1 . 1 1 131 131 THR H H 131 7.092 7.092 7.741 -0.649 17890 680 1 . 1 1 132 132 ALA N N 132 121.773 121.773 124.031 -2.258 17890 681 1 . 1 1 132 132 ALA HA H 132 3.749 3.749 4.037 -0.288 17890 682 1 . 1 1 132 132 ALA C C 132 178.819 178.819 178.322 0.497 17890 683 1 . 1 1 132 132 ALA CA C 132 54.284 54.284 52.871 1.413 17890 684 1 . 1 1 132 132 ALA CB C 132 18.227 18.227 18.655 -0.428 17890 685 1 . 1 1 132 132 ALA H H 132 8.952 8.952 8.407 0.545 17890 686 1 . 1 1 133 133 GLY N N 133 113.965 113.965 111.701 2.264 17890 687 1 . 1 1 133 133 GLY C C 133 173.453 173.453 174.296 -0.843 17890 688 1 . 1 1 133 133 GLY CA C 133 45.166 45.166 44.907 0.259 17890 689 1 . 1 1 133 133 GLY H H 133 9.016 9.016 8.644 0.372 17890 690 1 . 1 1 134 134 GLU N N 134 123.460 123.460 121.298 2.162 17890 691 1 . 1 1 134 134 GLU HA H 134 3.958 3.958 4.324 -0.366 17890 692 1 . 1 1 134 134 GLU C C 134 176.120 176.120 175.967 0.153 17890 693 1 . 1 1 134 134 GLU CA C 134 57.399 57.399 55.915 1.484 17890 694 1 . 1 1 134 134 GLU CB C 134 31.385 31.385 30.958 0.427 17890 695 1 . 1 1 134 134 GLU H H 134 7.598 7.598 7.607 -0.009 17890 696 1 . 1 1 135 135 GLU N N 135 122.633 122.633 124.667 -2.034 17890 697 1 . 1 1 135 135 GLU HA H 135 4.311 4.311 4.269 0.041 17890 698 1 . 1 1 135 135 GLU C C 135 176.014 176.014 176.454 -0.440 17890 699 1 . 1 1 135 135 GLU CA C 135 56.182 56.182 56.364 -0.182 17890 700 1 . 1 1 135 135 GLU CB C 135 29.453 29.453 30.336 -0.883 17890 701 1 . 1 1 135 135 GLU H H 135 8.258 8.258 8.608 -0.350 17890 702 1 . 1 1 136 136 VAL N N 136 123.635 123.635 125.938 -2.302 17890 703 1 . 1 1 136 136 VAL HA H 136 3.692 3.692 3.824 -0.132 17890 704 1 . 1 1 136 136 VAL C C 136 173.932 173.932 175.265 -1.333 17890 705 1 . 1 1 136 136 VAL CA C 136 63.832 63.832 63.671 0.161 17890 706 1 . 1 1 136 136 VAL CB C 136 31.864 31.864 32.293 -0.429 17890 707 1 . 1 1 136 136 VAL H H 136 7.267 7.267 7.958 -0.691 17890 708 1 . 1 1 137 137 SER N N 137 118.950 118.950 119.620 -0.670 17890 709 1 . 1 1 137 137 SER HA H 137 4.887 4.887 5.052 -0.165 17890 710 1 . 1 1 137 137 SER C C 137 173.780 173.780 173.052 0.728 17890 711 1 . 1 1 137 137 SER CA C 137 57.895 57.895 56.482 1.413 17890 712 1 . 1 1 137 137 SER CB C 137 65.027 65.027 66.266 -1.240 17890 713 1 . 1 1 137 137 SER H H 137 8.454 8.454 8.610 -0.156 17890 714 1 . 1 1 138 138 ILE N N 138 123.511 123.511 120.281 3.230 17890 715 1 . 1 1 138 138 ILE HA H 138 4.248 4.248 5.018 -0.770 17890 716 1 . 1 1 138 138 ILE C C 138 176.142 176.142 175.478 0.664 17890 717 1 . 1 1 138 138 ILE CA C 138 60.850 60.850 59.517 1.333 17890 718 1 . 1 1 138 138 ILE CB C 138 38.595 38.595 41.688 -3.093 17890 719 1 . 1 1 138 138 ILE H H 138 7.915 7.915 8.293 -0.378 17890 720 1 . 1 1 139 139 GLY N N 139 115.638 115.638 111.135 4.503 17890 721 1 . 1 1 139 139 GLY C C 139 171.947 171.947 172.895 -0.948 17890 722 1 . 1 1 139 139 GLY CA C 139 47.086 47.086 45.345 1.741 17890 723 1 . 1 1 139 139 GLY H H 139 8.490 8.490 8.362 0.128 17890 724 1 . 1 1 140 140 ALA N N 140 128.563 128.563 121.570 6.993 17890 725 1 . 1 1 140 140 ALA HA H 140 4.396 4.396 4.342 0.054 17890 726 1 . 1 1 140 140 ALA C C 140 177.956 177.956 177.114 0.842 17890 727 1 . 1 1 140 140 ALA CA C 140 52.646 52.646 53.798 -1.152 17890 728 1 . 1 1 140 140 ALA CB C 140 19.204 19.204 19.128 0.076 17890 729 1 . 1 1 140 140 ALA H H 140 8.531 8.531 8.327 0.204 17890 730 1 . 1 1 141 141 ASP N N 141 120.886 120.886 116.481 4.405 17890 731 1 . 1 1 141 141 ASP HA H 141 4.598 4.598 4.530 0.068 17890 732 1 . 1 1 141 141 ASP C C 141 175.411 175.411 174.764 0.647 17890 733 1 . 1 1 141 141 ASP CA C 141 53.916 53.916 53.961 -0.045 17890 734 1 . 1 1 141 141 ASP CB C 141 40.692 40.692 41.842 -1.150 17890 735 1 . 1 1 141 141 ASP H H 141 8.507 8.507 7.946 0.561 17890 736 1 . 1 1 142 142 ALA N N 142 125.604 125.604 124.082 1.522 17890 737 1 . 1 1 142 142 ALA HA H 142 4.517 4.517 4.573 -0.056 17890 738 1 . 1 1 142 142 ALA C C 142 177.671 177.671 178.028 -0.357 17890 739 1 . 1 1 142 142 ALA CA C 142 51.993 51.993 51.613 0.380 17890 740 1 . 1 1 142 142 ALA CB C 142 21.535 21.535 21.118 0.417 17890 741 1 . 1 1 142 142 ALA H H 142 7.894 7.894 8.246 -0.351 17890 742 1 . 1 1 143 143 THR N N 143 118.085 118.085 116.649 1.436 17890 743 1 . 1 1 143 143 THR HA H 143 3.744 3.744 4.173 -0.429 17890 744 1 . 1 1 143 143 THR C C 143 175.464 175.464 174.995 0.469 17890 745 1 . 1 1 143 143 THR CA C 143 64.548 64.548 64.588 -0.040 17890 746 1 . 1 1 143 143 THR CB C 143 69.305 69.305 68.877 0.428 17890 747 1 . 1 1 143 143 THR H H 143 8.268 8.268 8.838 -0.570 17890 748 1 . 1 1 144 144 PHE N N 144 118.635 118.635 116.768 1.867 17890 749 1 . 1 1 144 144 PHE HA H 144 4.346 4.346 4.719 -0.373 17890 750 1 . 1 1 144 144 PHE C C 144 176.209 176.209 175.171 1.038 17890 751 1 . 1 1 144 144 PHE CA C 144 61.462 61.462 57.685 3.777 17890 752 1 . 1 1 144 144 PHE CB C 144 39.604 39.604 39.280 0.324 17890 753 1 . 1 1 144 144 PHE H H 144 8.719 8.719 7.872 0.847 17890 754 1 . 1 1 145 145 SER N N 145 113.446 113.446 115.328 -1.882 17890 755 1 . 1 1 145 145 SER HA H 145 4.866 4.866 4.141 0.725 17890 756 1 . 1 1 145 145 SER C C 145 176.605 176.605 175.853 0.752 17890 757 1 . 1 1 145 145 SER CA C 145 59.432 59.432 57.493 1.939 17890 758 1 . 1 1 145 145 SER CB C 145 62.167 62.167 63.054 -0.887 17890 759 1 . 1 1 145 145 SER H H 145 8.657 8.657 7.229 1.428 17890 760 1 . 1 1 146 146 GLY N N 146 109.277 109.277 110.494 -1.217 17890 761 1 . 1 1 146 146 GLY C C 146 174.293 174.293 173.438 0.855 17890 762 1 . 1 1 146 146 GLY CA C 146 44.940 44.940 45.242 -0.302 17890 763 1 . 1 1 146 146 GLY H H 146 7.467 7.467 7.831 -0.364 17890 764 1 . 1 1 147 147 ARG N N 147 122.863 122.863 118.097 4.766 17890 765 1 . 1 1 147 147 ARG HA H 147 5.441 5.441 4.982 0.459 17890 766 1 . 1 1 147 147 ARG C C 147 173.849 173.849 174.420 -0.571 17890 767 1 . 1 1 147 147 ARG CA C 147 52.227 52.227 54.535 -2.308 17890 768 1 . 1 1 147 147 ARG CB C 147 32.597 32.597 33.495 -0.898 17890 769 1 . 1 1 147 147 ARG H H 147 7.556 7.556 7.131 0.425 17890 770 1 . 1 1 148 148 TRP N N 148 118.465 118.465 120.837 -2.372 17890 771 1 . 1 1 148 148 TRP HA H 148 4.846 4.846 5.151 -0.305 17890 772 1 . 1 1 148 148 TRP C C 148 174.353 174.353 174.317 0.036 17890 773 1 . 1 1 148 148 TRP CA C 148 55.662 55.662 56.893 -1.231 17890 774 1 . 1 1 148 148 TRP CB C 148 31.999 31.999 33.379 -1.381 17890 775 1 . 1 1 148 148 TRP H H 148 8.709 8.709 9.252 -0.543 17890 776 1 . 1 1 149 149 VAL N N 149 125.852 125.852 118.232 7.620 17890 777 1 . 1 1 149 149 VAL HA H 149 4.143 4.143 4.501 -0.358 17890 778 1 . 1 1 149 149 VAL C C 149 173.613 173.613 173.505 0.108 17890 779 1 . 1 1 149 149 VAL CA C 149 61.740 61.740 60.165 1.575 17890 780 1 . 1 1 149 149 VAL CB C 149 32.383 32.383 35.138 -2.755 17890 781 1 . 1 1 149 149 VAL H H 149 9.700 9.700 8.865 0.835 17890 782 1 . 1 1 150 150 ILE N N 150 125.140 125.140 126.718 -1.578 17890 783 1 . 1 1 150 150 ILE HA H 150 4.862 4.862 5.067 -0.205 17890 784 1 . 1 1 150 150 ILE C C 150 175.661 175.661 174.699 0.962 17890 785 1 . 1 1 150 150 ILE CA C 150 60.821 60.821 59.435 1.386 17890 786 1 . 1 1 150 150 ILE CB C 150 38.820 38.820 39.598 -0.778 17890 787 1 . 1 1 150 150 ILE H H 150 7.747 7.747 7.907 -0.160 17890 788 1 . 1 1 151 151 GLU N N 151 126.762 126.762 127.683 -0.921 17890 789 1 . 1 1 151 151 GLU HA H 151 4.880 4.880 4.838 0.042 17890 790 1 . 1 1 151 151 GLU C C 151 174.424 174.424 174.763 -0.339 17890 791 1 . 1 1 151 151 GLU CA C 151 54.796 54.796 54.016 0.780 17890 792 1 . 1 1 151 151 GLU CB C 151 34.251 34.251 33.931 0.320 17890 793 1 . 1 1 151 151 GLU H H 151 8.892 8.892 8.805 0.087 17890 794 1 . 1 1 152 152 LYS N N 152 126.299 126.299 122.671 3.628 17890 795 1 . 1 1 152 152 LYS HA H 152 3.861 3.861 3.780 0.081 17890 796 1 . 1 1 152 152 LYS C C 152 176.282 176.282 176.648 -0.366 17890 797 1 . 1 1 152 152 LYS CA C 152 57.505 57.505 56.827 0.678 17890 798 1 . 1 1 152 152 LYS CB C 152 33.336 33.336 32.574 0.762 17890 799 1 . 1 1 152 152 LYS H H 152 8.640 8.640 8.350 0.290 17890 stop_ save_