data_17949 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 17949 _Entry.PDB_ID 2LJM 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 17949 _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 12 12 SER HA H 12 4.680 4.680 4.521 0.159 17949 2 1 1 . 1 1 12 12 SER H H 12 8.268 8.268 8.333 -0.065 17949 3 1 1 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.082 0.140 17949 4 1 1 . 1 1 13 13 ILE H H 13 8.220 8.220 8.072 0.148 17949 5 1 1 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.138 0.214 17949 6 1 1 . 1 1 14 14 GLU H H 14 8.365 8.365 7.787 0.578 17949 7 1 1 . 1 1 15 15 GLY H H 15 8.300 8.300 8.400 -0.100 17949 8 1 1 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.061 0.495 17949 9 1 1 . 1 1 16 16 ARG H H 16 8.200 8.200 8.295 -0.095 17949 10 1 1 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.530 -0.193 17949 11 1 1 . 1 1 17 17 LYS H H 17 8.446 8.446 7.969 0.477 17949 12 1 1 . 1 1 18 18 GLU HA H 18 4.644 4.644 3.988 0.656 17949 13 1 1 . 1 1 18 18 GLU H H 18 7.534 7.534 8.442 -0.908 17949 14 1 1 . 1 1 19 19 GLY H H 19 7.245 7.245 7.187 0.058 17949 15 1 1 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.386 0.540 17949 16 1 1 . 1 1 20 20 TYR H H 20 9.101 9.101 8.551 0.550 17949 17 1 1 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.873 -0.252 17949 18 1 1 . 1 1 21 21 LEU H H 21 7.703 7.703 8.642 -0.939 17949 19 1 1 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.016 1.212 17949 20 1 1 . 1 1 22 22 VAL H H 22 7.049 7.049 7.668 -0.619 17949 21 1 1 . 1 1 23 23 SER HA H 23 4.870 4.870 4.637 0.233 17949 22 1 1 . 1 1 23 23 SER H H 23 8.356 8.356 8.683 -0.327 17949 23 1 1 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.280 -0.197 17949 24 1 1 . 1 1 24 24 LYS H H 24 9.212 9.212 8.713 0.499 17949 25 1 1 . 1 1 25 25 SER HA H 25 4.440 4.440 4.190 0.250 17949 26 1 1 . 1 1 25 25 SER H H 25 8.024 8.024 8.308 -0.284 17949 27 1 1 . 1 1 26 26 THR HA H 26 4.513 4.513 4.341 0.172 17949 28 1 1 . 1 1 26 26 THR H H 26 7.595 7.595 7.933 -0.338 17949 29 1 1 . 1 1 27 27 GLY H H 27 8.388 8.388 8.395 -0.007 17949 30 1 1 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.959 -0.008 17949 31 1 1 . 1 1 28 28 CYS H H 28 8.131 8.131 8.601 -0.470 17949 32 1 1 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.810 -0.227 17949 33 1 1 . 1 1 29 29 LYS H H 29 8.302 8.302 8.374 -0.072 17949 34 1 1 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.204 0.453 17949 35 1 1 . 1 1 31 31 GLU H H 31 8.299 8.299 8.114 0.185 17949 36 1 1 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.376 0.455 17949 37 1 1 . 1 1 32 32 CYS H H 32 8.157 8.157 8.539 -0.382 17949 38 1 1 . 1 1 33 33 LEU H H 33 8.495 8.495 8.596 -0.101 17949 39 1 1 . 1 1 34 34 LYS H H 34 8.445 8.445 7.695 0.750 17949 40 1 1 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.416 -0.789 17949 41 1 1 . 1 1 35 35 LEU H H 35 8.229 8.229 8.396 -0.167 17949 42 1 1 . 1 1 36 36 GLY H H 36 9.039 9.039 8.231 0.808 17949 43 1 1 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.886 -0.266 17949 44 1 1 . 1 1 37 37 ASP H H 37 8.511 8.511 8.656 -0.145 17949 45 1 1 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.869 -0.038 17949 46 1 1 . 1 1 38 38 ASN H H 38 9.114 9.114 7.454 1.660 17949 47 1 1 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.822 -0.296 17949 48 1 1 . 1 1 39 39 ASP H H 39 9.019 9.019 8.671 0.348 17949 49 1 1 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.192 0.144 17949 50 1 1 . 1 1 40 40 TYR H H 40 8.036 8.036 7.906 0.130 17949 51 1 1 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.204 0.009 17949 52 1 1 . 1 1 41 41 CYS H H 41 8.164 8.164 8.649 -0.485 17949 53 1 1 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.081 -0.367 17949 54 1 1 . 1 1 42 42 LEU H H 42 8.236 8.236 7.473 0.763 17949 55 1 1 . 1 1 43 43 ARG HA H 43 3.864 3.864 3.881 -0.017 17949 56 1 1 . 1 1 43 43 ARG H H 43 8.018 8.018 8.297 -0.279 17949 57 1 1 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.115 -0.246 17949 58 1 1 . 1 1 44 44 GLU H H 44 8.325 8.325 7.614 0.711 17949 59 1 1 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.512 -0.174 17949 60 1 1 . 1 1 45 45 CYS H H 45 8.666 8.666 7.664 1.002 17949 61 1 1 . 1 1 46 46 LYS H H 46 7.959 7.959 7.422 0.537 17949 62 1 1 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.091 -0.187 17949 63 1 1 . 1 1 47 47 GLN H H 47 8.230 8.230 8.114 0.116 17949 64 1 1 . 1 1 48 48 GLN HA H 48 4.108 4.108 3.911 0.197 17949 65 1 1 . 1 1 48 48 GLN H H 48 7.614 7.614 8.253 -0.639 17949 66 1 1 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.561 0.394 17949 67 1 1 . 1 1 49 49 TYR H H 49 8.260 8.260 7.911 0.349 17949 68 1 1 . 1 1 50 50 GLY H H 50 7.705 7.705 7.362 0.343 17949 69 1 1 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.136 -0.253 17949 70 1 1 . 1 1 51 51 LYS H H 51 8.621 8.621 8.716 -0.095 17949 71 1 1 . 1 1 52 52 SER HA H 52 4.510 4.510 4.312 0.198 17949 72 1 1 . 1 1 52 52 SER H H 52 8.436 8.436 8.354 0.082 17949 73 1 1 . 1 1 53 53 SER HA H 53 4.637 4.637 4.508 0.129 17949 74 1 1 . 1 1 53 53 SER H H 53 7.884 7.884 7.842 0.042 17949 75 1 1 . 1 1 54 54 GLY H H 54 7.890 7.890 7.659 0.231 17949 76 1 1 . 1 1 55 55 GLY H H 55 7.893 7.893 8.019 -0.126 17949 77 1 1 . 1 1 56 56 TYR HA H 56 4.818 4.818 5.006 -0.188 17949 78 1 1 . 1 1 56 56 TYR H H 56 8.939 8.939 8.285 0.654 17949 79 1 1 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.807 0.395 17949 80 1 1 . 1 1 57 57 CYS H H 57 9.281 9.281 9.034 0.247 17949 81 1 1 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.271 0.659 17949 82 1 1 . 1 1 58 58 TYR H H 58 9.406 9.406 7.915 1.491 17949 83 1 1 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.907 -0.473 17949 84 1 1 . 1 1 59 59 ALA H H 59 8.977 8.977 8.290 0.687 17949 85 1 1 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.277 -0.168 17949 86 1 1 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.438 1.022 17949 87 1 1 . 1 1 61 61 ALA H H 61 8.089 8.089 7.810 0.279 17949 88 1 1 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.518 0.752 17949 89 1 1 . 1 1 62 62 CYS H H 62 8.706 8.706 8.680 0.026 17949 90 1 1 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.452 0.171 17949 91 1 1 . 1 1 63 63 TRP H H 63 9.739 9.739 8.443 1.296 17949 92 1 1 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.664 0.944 17949 93 1 1 . 1 1 64 64 CYS H H 64 8.649 8.649 8.380 0.269 17949 94 1 1 . 1 1 65 65 THR HA H 65 4.591 4.591 4.474 0.117 17949 95 1 1 . 1 1 65 65 THR H H 65 7.937 7.937 8.177 -0.240 17949 96 1 1 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.230 -0.220 17949 97 1 1 . 1 1 66 66 HIS H H 66 8.755 8.755 8.809 -0.054 17949 98 1 1 . 1 1 67 67 LEU HA H 67 4.176 4.176 3.989 0.187 17949 99 1 1 . 1 1 67 67 LEU H H 67 8.492 8.492 7.631 0.861 17949 100 1 1 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.482 0.066 17949 101 1 1 . 1 1 68 68 TYR H H 68 7.880 7.880 7.787 0.093 17949 102 1 1 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.091 -0.325 17949 103 1 1 . 1 1 69 69 GLU H H 69 8.787 8.787 8.999 -0.212 17949 104 1 1 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.326 -0.070 17949 105 1 1 . 1 1 70 70 GLN H H 70 7.925 7.925 8.207 -0.282 17949 106 1 1 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.095 -0.050 17949 107 1 1 . 1 1 71 71 ALA H H 71 7.490 7.490 7.684 -0.194 17949 108 1 1 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.356 -0.208 17949 109 1 1 . 1 1 72 72 VAL H H 72 8.532 8.532 8.390 0.142 17949 110 1 1 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.647 -0.031 17949 111 1 1 . 1 1 73 73 VAL H H 73 8.092 8.092 7.718 0.374 17949 112 1 1 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.044 -0.947 17949 113 1 1 . 1 1 74 74 TRP H H 74 8.500 8.500 8.487 0.013 17949 114 1 1 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.782 -2.953 17949 115 1 1 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.437 -0.238 17949 116 1 1 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.632 0.003 17949 117 1 1 . 1 1 78 78 ASN H H 78 8.235 8.235 8.585 -0.350 17949 118 1 1 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.577 0.015 17949 119 1 1 . 1 1 79 79 LYS H H 79 7.039 7.039 7.846 -0.807 17949 120 1 1 . 1 1 80 80 THR HA H 80 4.427 4.427 4.397 0.030 17949 121 1 1 . 1 1 80 80 THR H H 80 8.483 8.483 8.107 0.376 17949 122 1 1 . 1 1 81 81 CYS HA H 81 4.635 4.635 3.747 0.888 17949 123 1 1 . 1 1 81 81 CYS H H 81 8.835 8.835 8.576 0.259 17949 124 1 2 . 1 1 12 12 SER HA H 12 4.680 4.680 4.695 -0.015 17949 125 1 2 . 1 1 12 12 SER H H 12 8.268 8.268 8.240 0.028 17949 126 1 2 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.387 -0.165 17949 127 1 2 . 1 1 13 13 ILE H H 13 8.220 8.220 8.572 -0.352 17949 128 1 2 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.557 -0.205 17949 129 1 2 . 1 1 14 14 GLU H H 14 8.365 8.365 8.635 -0.270 17949 130 1 2 . 1 1 15 15 GLY H H 15 8.300 8.300 8.491 -0.191 17949 131 1 2 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.591 -0.035 17949 132 1 2 . 1 1 16 16 ARG H H 16 8.200 8.200 8.277 -0.077 17949 133 1 2 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.530 -0.193 17949 134 1 2 . 1 1 17 17 LYS H H 17 8.446 8.446 7.610 0.836 17949 135 1 2 . 1 1 18 18 GLU HA H 18 4.644 4.644 3.995 0.649 17949 136 1 2 . 1 1 18 18 GLU H H 18 7.534 7.534 8.491 -0.957 17949 137 1 2 . 1 1 19 19 GLY H H 19 7.245 7.245 7.187 0.058 17949 138 1 2 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.602 0.324 17949 139 1 2 . 1 1 20 20 TYR H H 20 9.101 9.101 8.222 0.879 17949 140 1 2 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.592 0.029 17949 141 1 2 . 1 1 21 21 LEU H H 21 7.703 7.703 8.843 -1.140 17949 142 1 2 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.992 1.236 17949 143 1 2 . 1 1 22 22 VAL H H 22 7.049 7.049 7.650 -0.601 17949 144 1 2 . 1 1 23 23 SER HA H 23 4.870 4.870 4.528 0.342 17949 145 1 2 . 1 1 23 23 SER H H 23 8.356 8.356 8.702 -0.346 17949 146 1 2 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.268 -0.185 17949 147 1 2 . 1 1 24 24 LYS H H 24 9.212 9.212 8.662 0.550 17949 148 1 2 . 1 1 25 25 SER HA H 25 4.440 4.440 4.254 0.186 17949 149 1 2 . 1 1 25 25 SER H H 25 8.024 8.024 8.028 -0.004 17949 150 1 2 . 1 1 26 26 THR HA H 26 4.513 4.513 4.403 0.110 17949 151 1 2 . 1 1 26 26 THR H H 26 7.595 7.595 7.865 -0.270 17949 152 1 2 . 1 1 27 27 GLY H H 27 8.388 8.388 8.265 0.123 17949 153 1 2 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.903 0.048 17949 154 1 2 . 1 1 28 28 CYS H H 28 8.131 8.131 8.763 -0.632 17949 155 1 2 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.802 -0.219 17949 156 1 2 . 1 1 29 29 LYS H H 29 8.302 8.302 8.229 0.073 17949 157 1 2 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.248 0.409 17949 158 1 2 . 1 1 31 31 GLU H H 31 8.299 8.299 7.935 0.364 17949 159 1 2 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.415 0.416 17949 160 1 2 . 1 1 32 32 CYS H H 32 8.157 8.157 8.619 -0.462 17949 161 1 2 . 1 1 33 33 LEU H H 33 8.495 8.495 8.512 -0.017 17949 162 1 2 . 1 1 34 34 LYS H H 34 8.445 8.445 7.808 0.637 17949 163 1 2 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.408 -0.781 17949 164 1 2 . 1 1 35 35 LEU H H 35 8.229 8.229 8.669 -0.440 17949 165 1 2 . 1 1 36 36 GLY H H 36 9.039 9.039 7.935 1.104 17949 166 1 2 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.702 -0.082 17949 167 1 2 . 1 1 37 37 ASP H H 37 8.511 8.511 8.401 0.110 17949 168 1 2 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.831 -0.000 17949 169 1 2 . 1 1 38 38 ASN H H 38 9.114 9.114 7.793 1.321 17949 170 1 2 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.807 -0.281 17949 171 1 2 . 1 1 39 39 ASP H H 39 9.019 9.019 8.720 0.299 17949 172 1 2 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.345 -0.009 17949 173 1 2 . 1 1 40 40 TYR H H 40 8.036 8.036 8.580 -0.544 17949 174 1 2 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.430 -0.217 17949 175 1 2 . 1 1 41 41 CYS H H 41 8.164 8.164 8.617 -0.453 17949 176 1 2 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.083 -0.369 17949 177 1 2 . 1 1 42 42 LEU H H 42 8.236 8.236 7.782 0.454 17949 178 1 2 . 1 1 43 43 ARG HA H 43 3.864 3.864 3.970 -0.106 17949 179 1 2 . 1 1 43 43 ARG H H 43 8.018 8.018 7.770 0.248 17949 180 1 2 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.228 -0.359 17949 181 1 2 . 1 1 44 44 GLU H H 44 8.325 8.325 8.004 0.321 17949 182 1 2 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.622 -0.284 17949 183 1 2 . 1 1 45 45 CYS H H 45 8.666 8.666 7.332 1.334 17949 184 1 2 . 1 1 46 46 LYS H H 46 7.959 7.959 7.814 0.145 17949 185 1 2 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.161 -0.257 17949 186 1 2 . 1 1 47 47 GLN H H 47 8.230 8.230 8.153 0.077 17949 187 1 2 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.219 -0.111 17949 188 1 2 . 1 1 48 48 GLN H H 48 7.614 7.614 8.409 -0.795 17949 189 1 2 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.676 0.279 17949 190 1 2 . 1 1 49 49 TYR H H 49 8.260 8.260 8.094 0.166 17949 191 1 2 . 1 1 50 50 GLY H H 50 7.705 7.705 7.980 -0.275 17949 192 1 2 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.071 -0.188 17949 193 1 2 . 1 1 51 51 LYS H H 51 8.621 8.621 8.148 0.473 17949 194 1 2 . 1 1 52 52 SER HA H 52 4.510 4.510 4.609 -0.099 17949 195 1 2 . 1 1 52 52 SER H H 52 8.436 8.436 8.450 -0.014 17949 196 1 2 . 1 1 53 53 SER HA H 53 4.637 4.637 4.670 -0.033 17949 197 1 2 . 1 1 53 53 SER H H 53 7.884 7.884 7.560 0.324 17949 198 1 2 . 1 1 54 54 GLY H H 54 7.890 7.890 8.010 -0.120 17949 199 1 2 . 1 1 55 55 GLY H H 55 7.893 7.893 8.185 -0.292 17949 200 1 2 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.907 -0.089 17949 201 1 2 . 1 1 56 56 TYR H H 56 8.939 8.939 8.544 0.395 17949 202 1 2 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.751 0.451 17949 203 1 2 . 1 1 57 57 CYS H H 57 9.281 9.281 9.074 0.207 17949 204 1 2 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.398 0.532 17949 205 1 2 . 1 1 58 58 TYR H H 58 9.406 9.406 8.055 1.351 17949 206 1 2 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.928 -0.494 17949 207 1 2 . 1 1 59 59 ALA H H 59 8.977 8.977 8.294 0.683 17949 208 1 2 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.211 -0.102 17949 209 1 2 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.498 0.962 17949 210 1 2 . 1 1 61 61 ALA H H 61 8.089 8.089 7.703 0.386 17949 211 1 2 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.337 0.933 17949 212 1 2 . 1 1 62 62 CYS H H 62 8.706 8.706 8.902 -0.196 17949 213 1 2 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.303 0.320 17949 214 1 2 . 1 1 63 63 TRP H H 63 9.739 9.739 8.301 1.438 17949 215 1 2 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.741 0.867 17949 216 1 2 . 1 1 64 64 CYS H H 64 8.649 8.649 7.635 1.014 17949 217 1 2 . 1 1 65 65 THR HA H 65 4.591 4.591 4.307 0.284 17949 218 1 2 . 1 1 65 65 THR H H 65 7.937 7.937 8.657 -0.720 17949 219 1 2 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.163 -0.153 17949 220 1 2 . 1 1 66 66 HIS H H 66 8.755 8.755 8.586 0.169 17949 221 1 2 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.333 -0.157 17949 222 1 2 . 1 1 67 67 LEU H H 67 8.492 8.492 7.617 0.875 17949 223 1 2 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.341 0.207 17949 224 1 2 . 1 1 68 68 TYR H H 68 7.880 7.880 8.556 -0.676 17949 225 1 2 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.447 -0.681 17949 226 1 2 . 1 1 69 69 GLU H H 69 8.787 8.787 7.927 0.860 17949 227 1 2 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.395 -0.139 17949 228 1 2 . 1 1 70 70 GLN H H 70 7.925 7.925 8.062 -0.137 17949 229 1 2 . 1 1 71 71 ALA HA H 71 4.045 4.045 3.903 0.142 17949 230 1 2 . 1 1 71 71 ALA H H 71 7.490 7.490 7.619 -0.129 17949 231 1 2 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.179 -0.031 17949 232 1 2 . 1 1 72 72 VAL H H 72 8.532 8.532 8.297 0.235 17949 233 1 2 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.549 0.067 17949 234 1 2 . 1 1 73 73 VAL H H 73 8.092 8.092 7.726 0.366 17949 235 1 2 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.019 -0.922 17949 236 1 2 . 1 1 74 74 TRP H H 74 8.500 8.500 8.472 0.028 17949 237 1 2 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.723 -2.894 17949 238 1 2 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.531 -0.332 17949 239 1 2 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.365 0.270 17949 240 1 2 . 1 1 78 78 ASN H H 78 8.235 8.235 8.750 -0.515 17949 241 1 2 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.459 0.133 17949 242 1 2 . 1 1 79 79 LYS H H 79 7.039 7.039 7.609 -0.570 17949 243 1 2 . 1 1 80 80 THR HA H 80 4.427 4.427 4.413 0.014 17949 244 1 2 . 1 1 80 80 THR H H 80 8.483 8.483 8.058 0.425 17949 245 1 2 . 1 1 81 81 CYS HA H 81 4.635 4.635 3.974 0.661 17949 246 1 2 . 1 1 81 81 CYS H H 81 8.835 8.835 8.407 0.428 17949 247 1 3 . 1 1 12 12 SER HA H 12 4.680 4.680 4.750 -0.070 17949 248 1 3 . 1 1 12 12 SER H H 12 8.268 8.268 8.224 0.044 17949 249 1 3 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.250 -0.028 17949 250 1 3 . 1 1 13 13 ILE H H 13 8.220 8.220 7.866 0.354 17949 251 1 3 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.448 -0.096 17949 252 1 3 . 1 1 14 14 GLU H H 14 8.365 8.365 8.470 -0.105 17949 253 1 3 . 1 1 15 15 GLY H H 15 8.300 8.300 8.405 -0.105 17949 254 1 3 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.351 0.205 17949 255 1 3 . 1 1 16 16 ARG H H 16 8.200 8.200 8.115 0.085 17949 256 1 3 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.542 -0.205 17949 257 1 3 . 1 1 17 17 LYS H H 17 8.446 8.446 7.719 0.727 17949 258 1 3 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.441 0.203 17949 259 1 3 . 1 1 18 18 GLU H H 18 7.534 7.534 8.541 -1.007 17949 260 1 3 . 1 1 19 19 GLY H H 19 7.245 7.245 7.893 -0.648 17949 261 1 3 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.853 0.073 17949 262 1 3 . 1 1 20 20 TYR H H 20 9.101 9.101 8.576 0.525 17949 263 1 3 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.740 -0.119 17949 264 1 3 . 1 1 21 21 LEU H H 21 7.703 7.703 8.751 -1.048 17949 265 1 3 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.879 1.349 17949 266 1 3 . 1 1 22 22 VAL H H 22 7.049 7.049 7.594 -0.545 17949 267 1 3 . 1 1 23 23 SER HA H 23 4.870 4.870 4.709 0.161 17949 268 1 3 . 1 1 23 23 SER H H 23 8.356 8.356 8.525 -0.169 17949 269 1 3 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.275 -0.192 17949 270 1 3 . 1 1 24 24 LYS H H 24 9.212 9.212 8.722 0.490 17949 271 1 3 . 1 1 25 25 SER HA H 25 4.440 4.440 4.273 0.167 17949 272 1 3 . 1 1 25 25 SER H H 25 8.024 8.024 7.948 0.076 17949 273 1 3 . 1 1 26 26 THR HA H 26 4.513 4.513 4.370 0.143 17949 274 1 3 . 1 1 26 26 THR H H 26 7.595 7.595 7.944 -0.349 17949 275 1 3 . 1 1 27 27 GLY H H 27 8.388 8.388 8.219 0.169 17949 276 1 3 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.757 0.194 17949 277 1 3 . 1 1 28 28 CYS H H 28 8.131 8.131 8.492 -0.361 17949 278 1 3 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.547 0.036 17949 279 1 3 . 1 1 29 29 LYS H H 29 8.302 8.302 8.152 0.150 17949 280 1 3 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.289 0.368 17949 281 1 3 . 1 1 31 31 GLU H H 31 8.299 8.299 7.729 0.570 17949 282 1 3 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.411 0.420 17949 283 1 3 . 1 1 32 32 CYS H H 32 8.157 8.157 8.327 -0.170 17949 284 1 3 . 1 1 33 33 LEU H H 33 8.495 8.495 8.231 0.264 17949 285 1 3 . 1 1 34 34 LYS H H 34 8.445 8.445 7.732 0.713 17949 286 1 3 . 1 1 35 35 LEU HA H 35 3.627 3.627 3.984 -0.357 17949 287 1 3 . 1 1 35 35 LEU H H 35 8.229 8.229 8.859 -0.630 17949 288 1 3 . 1 1 36 36 GLY H H 36 9.039 9.039 8.642 0.397 17949 289 1 3 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.938 -0.318 17949 290 1 3 . 1 1 37 37 ASP H H 37 8.511 8.511 7.763 0.748 17949 291 1 3 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.880 -0.049 17949 292 1 3 . 1 1 38 38 ASN H H 38 9.114 9.114 7.691 1.423 17949 293 1 3 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.527 -0.001 17949 294 1 3 . 1 1 39 39 ASP H H 39 9.019 9.019 8.674 0.345 17949 295 1 3 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.076 0.260 17949 296 1 3 . 1 1 40 40 TYR H H 40 8.036 8.036 8.165 -0.129 17949 297 1 3 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.218 -0.006 17949 298 1 3 . 1 1 41 41 CYS H H 41 8.164 8.164 8.152 0.012 17949 299 1 3 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.324 -0.610 17949 300 1 3 . 1 1 42 42 LEU H H 42 8.236 8.236 7.792 0.444 17949 301 1 3 . 1 1 43 43 ARG HA H 43 3.864 3.864 3.944 -0.080 17949 302 1 3 . 1 1 43 43 ARG H H 43 8.018 8.018 8.530 -0.512 17949 303 1 3 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.124 -0.255 17949 304 1 3 . 1 1 44 44 GLU H H 44 8.325 8.325 7.743 0.582 17949 305 1 3 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.846 -0.508 17949 306 1 3 . 1 1 45 45 CYS H H 45 8.666 8.666 7.498 1.168 17949 307 1 3 . 1 1 46 46 LYS H H 46 7.959 7.959 7.456 0.503 17949 308 1 3 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.351 -0.447 17949 309 1 3 . 1 1 47 47 GLN H H 47 8.230 8.230 8.133 0.097 17949 310 1 3 . 1 1 48 48 GLN HA H 48 4.108 4.108 3.932 0.176 17949 311 1 3 . 1 1 48 48 GLN H H 48 7.614 7.614 8.455 -0.841 17949 312 1 3 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.746 0.209 17949 313 1 3 . 1 1 49 49 TYR H H 49 8.260 8.260 7.361 0.899 17949 314 1 3 . 1 1 50 50 GLY H H 50 7.705 7.705 8.209 -0.504 17949 315 1 3 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.508 -0.625 17949 316 1 3 . 1 1 51 51 LYS H H 51 8.621 8.621 8.196 0.425 17949 317 1 3 . 1 1 52 52 SER HA H 52 4.510 4.510 4.669 -0.159 17949 318 1 3 . 1 1 52 52 SER H H 52 8.436 8.436 8.617 -0.181 17949 319 1 3 . 1 1 53 53 SER HA H 53 4.637 4.637 4.628 0.009 17949 320 1 3 . 1 1 53 53 SER H H 53 7.884 7.884 7.661 0.223 17949 321 1 3 . 1 1 54 54 GLY H H 54 7.890 7.890 8.391 -0.501 17949 322 1 3 . 1 1 55 55 GLY H H 55 7.893 7.893 7.965 -0.072 17949 323 1 3 . 1 1 56 56 TYR HA H 56 4.818 4.818 5.014 -0.196 17949 324 1 3 . 1 1 56 56 TYR H H 56 8.939 8.939 8.422 0.517 17949 325 1 3 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.760 0.442 17949 326 1 3 . 1 1 57 57 CYS H H 57 9.281 9.281 9.065 0.216 17949 327 1 3 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.260 0.670 17949 328 1 3 . 1 1 58 58 TYR H H 58 9.406 9.406 8.040 1.366 17949 329 1 3 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.946 -0.512 17949 330 1 3 . 1 1 59 59 ALA H H 59 8.977 8.977 8.406 0.571 17949 331 1 3 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.236 -0.127 17949 332 1 3 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.379 1.081 17949 333 1 3 . 1 1 61 61 ALA H H 61 8.089 8.089 7.662 0.427 17949 334 1 3 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.390 0.880 17949 335 1 3 . 1 1 62 62 CYS H H 62 8.706 8.706 8.710 -0.004 17949 336 1 3 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.544 0.079 17949 337 1 3 . 1 1 63 63 TRP H H 63 9.739 9.739 8.927 0.812 17949 338 1 3 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.764 0.844 17949 339 1 3 . 1 1 64 64 CYS H H 64 8.649 8.649 8.389 0.260 17949 340 1 3 . 1 1 65 65 THR HA H 65 4.591 4.591 4.357 0.234 17949 341 1 3 . 1 1 65 65 THR H H 65 7.937 7.937 8.246 -0.309 17949 342 1 3 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.094 -0.084 17949 343 1 3 . 1 1 66 66 HIS H H 66 8.755 8.755 8.560 0.195 17949 344 1 3 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.276 -0.100 17949 345 1 3 . 1 1 67 67 LEU H H 67 8.492 8.492 8.014 0.478 17949 346 1 3 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.563 -0.015 17949 347 1 3 . 1 1 68 68 TYR H H 68 7.880 7.880 8.279 -0.399 17949 348 1 3 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.154 -0.388 17949 349 1 3 . 1 1 69 69 GLU H H 69 8.787 8.787 8.810 -0.023 17949 350 1 3 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.274 -0.018 17949 351 1 3 . 1 1 70 70 GLN H H 70 7.925 7.925 8.202 -0.277 17949 352 1 3 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.293 -0.248 17949 353 1 3 . 1 1 71 71 ALA H H 71 7.490 7.490 7.363 0.127 17949 354 1 3 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.011 0.137 17949 355 1 3 . 1 1 72 72 VAL H H 72 8.532 8.532 8.289 0.243 17949 356 1 3 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.422 0.194 17949 357 1 3 . 1 1 73 73 VAL H H 73 8.092 8.092 8.204 -0.112 17949 358 1 3 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.058 -0.961 17949 359 1 3 . 1 1 74 74 TRP H H 74 8.500 8.500 8.466 0.034 17949 360 1 3 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.386 -2.557 17949 361 1 3 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.460 -0.261 17949 362 1 3 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.432 0.203 17949 363 1 3 . 1 1 78 78 ASN H H 78 8.235 8.235 8.816 -0.581 17949 364 1 3 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.488 0.104 17949 365 1 3 . 1 1 79 79 LYS H H 79 7.039 7.039 7.630 -0.591 17949 366 1 3 . 1 1 80 80 THR HA H 80 4.427 4.427 4.387 0.040 17949 367 1 3 . 1 1 80 80 THR H H 80 8.483 8.483 8.283 0.200 17949 368 1 3 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.598 0.037 17949 369 1 3 . 1 1 81 81 CYS H H 81 8.835 8.835 8.930 -0.095 17949 370 1 4 . 1 1 12 12 SER HA H 12 4.680 4.680 4.580 0.100 17949 371 1 4 . 1 1 12 12 SER H H 12 8.268 8.268 8.515 -0.247 17949 372 1 4 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.089 0.133 17949 373 1 4 . 1 1 13 13 ILE H H 13 8.220 8.220 7.847 0.373 17949 374 1 4 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.588 -0.236 17949 375 1 4 . 1 1 14 14 GLU H H 14 8.365 8.365 8.177 0.188 17949 376 1 4 . 1 1 15 15 GLY H H 15 8.300 8.300 8.475 -0.175 17949 377 1 4 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.447 0.109 17949 378 1 4 . 1 1 16 16 ARG H H 16 8.200 8.200 8.306 -0.106 17949 379 1 4 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.484 -0.147 17949 380 1 4 . 1 1 17 17 LYS H H 17 8.446 8.446 7.843 0.603 17949 381 1 4 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.364 0.280 17949 382 1 4 . 1 1 18 18 GLU H H 18 7.534 7.534 8.561 -1.027 17949 383 1 4 . 1 1 19 19 GLY H H 19 7.245 7.245 7.266 -0.021 17949 384 1 4 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.439 0.487 17949 385 1 4 . 1 1 20 20 TYR H H 20 9.101 9.101 8.311 0.790 17949 386 1 4 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.700 -0.079 17949 387 1 4 . 1 1 21 21 LEU H H 21 7.703 7.703 8.886 -1.183 17949 388 1 4 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.029 1.199 17949 389 1 4 . 1 1 22 22 VAL H H 22 7.049 7.049 7.814 -0.765 17949 390 1 4 . 1 1 23 23 SER HA H 23 4.870 4.870 4.603 0.267 17949 391 1 4 . 1 1 23 23 SER H H 23 8.356 8.356 8.540 -0.184 17949 392 1 4 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.076 0.007 17949 393 1 4 . 1 1 24 24 LYS H H 24 9.212 9.212 8.694 0.518 17949 394 1 4 . 1 1 25 25 SER HA H 25 4.440 4.440 4.171 0.269 17949 395 1 4 . 1 1 25 25 SER H H 25 8.024 8.024 7.909 0.115 17949 396 1 4 . 1 1 26 26 THR HA H 26 4.513 4.513 4.391 0.122 17949 397 1 4 . 1 1 26 26 THR H H 26 7.595 7.595 7.930 -0.335 17949 398 1 4 . 1 1 27 27 GLY H H 27 8.388 8.388 8.393 -0.005 17949 399 1 4 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.708 0.243 17949 400 1 4 . 1 1 28 28 CYS H H 28 8.131 8.131 8.516 -0.385 17949 401 1 4 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.846 -0.263 17949 402 1 4 . 1 1 29 29 LYS H H 29 8.302 8.302 8.166 0.136 17949 403 1 4 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.392 0.265 17949 404 1 4 . 1 1 31 31 GLU H H 31 8.299 8.299 7.852 0.447 17949 405 1 4 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.601 0.230 17949 406 1 4 . 1 1 32 32 CYS H H 32 8.157 8.157 8.566 -0.409 17949 407 1 4 . 1 1 33 33 LEU H H 33 8.495 8.495 8.323 0.172 17949 408 1 4 . 1 1 34 34 LYS H H 34 8.445 8.445 7.301 1.144 17949 409 1 4 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.204 -0.577 17949 410 1 4 . 1 1 35 35 LEU H H 35 8.229 8.229 8.398 -0.169 17949 411 1 4 . 1 1 36 36 GLY H H 36 9.039 9.039 8.672 0.367 17949 412 1 4 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.532 0.088 17949 413 1 4 . 1 1 37 37 ASP H H 37 8.511 8.511 8.596 -0.085 17949 414 1 4 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.772 0.059 17949 415 1 4 . 1 1 38 38 ASN H H 38 9.114 9.114 8.010 1.104 17949 416 1 4 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.845 -0.319 17949 417 1 4 . 1 1 39 39 ASP H H 39 9.019 9.019 8.745 0.274 17949 418 1 4 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.313 0.023 17949 419 1 4 . 1 1 40 40 TYR H H 40 8.036 8.036 8.470 -0.434 17949 420 1 4 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.462 -0.249 17949 421 1 4 . 1 1 41 41 CYS H H 41 8.164 8.164 8.180 -0.016 17949 422 1 4 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.253 -0.539 17949 423 1 4 . 1 1 42 42 LEU H H 42 8.236 8.236 8.242 -0.005 17949 424 1 4 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.338 -0.474 17949 425 1 4 . 1 1 43 43 ARG H H 43 8.018 8.018 7.811 0.207 17949 426 1 4 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.361 -0.492 17949 427 1 4 . 1 1 44 44 GLU H H 44 8.325 8.325 7.829 0.496 17949 428 1 4 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.610 -0.272 17949 429 1 4 . 1 1 45 45 CYS H H 45 8.666 8.666 7.602 1.064 17949 430 1 4 . 1 1 46 46 LYS H H 46 7.959 7.959 7.788 0.171 17949 431 1 4 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.123 -0.219 17949 432 1 4 . 1 1 47 47 GLN H H 47 8.230 8.230 8.207 0.023 17949 433 1 4 . 1 1 48 48 GLN HA H 48 4.108 4.108 3.965 0.143 17949 434 1 4 . 1 1 48 48 GLN H H 48 7.614 7.614 8.088 -0.474 17949 435 1 4 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.422 0.533 17949 436 1 4 . 1 1 49 49 TYR H H 49 8.260 8.260 7.278 0.982 17949 437 1 4 . 1 1 50 50 GLY H H 50 7.705 7.705 8.012 -0.307 17949 438 1 4 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.414 -0.531 17949 439 1 4 . 1 1 51 51 LYS H H 51 8.621 8.621 8.101 0.520 17949 440 1 4 . 1 1 52 52 SER HA H 52 4.510 4.510 4.155 0.355 17949 441 1 4 . 1 1 52 52 SER H H 52 8.436 8.436 8.518 -0.082 17949 442 1 4 . 1 1 53 53 SER HA H 53 4.637 4.637 4.684 -0.047 17949 443 1 4 . 1 1 53 53 SER H H 53 7.884 7.884 7.959 -0.075 17949 444 1 4 . 1 1 54 54 GLY H H 54 7.890 7.890 7.918 -0.028 17949 445 1 4 . 1 1 55 55 GLY H H 55 7.893 7.893 8.234 -0.341 17949 446 1 4 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.897 -0.079 17949 447 1 4 . 1 1 56 56 TYR H H 56 8.939 8.939 8.065 0.874 17949 448 1 4 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.898 0.304 17949 449 1 4 . 1 1 57 57 CYS H H 57 9.281 9.281 9.261 0.020 17949 450 1 4 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.277 0.653 17949 451 1 4 . 1 1 58 58 TYR H H 58 9.406 9.406 7.993 1.413 17949 452 1 4 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.994 -0.560 17949 453 1 4 . 1 1 59 59 ALA H H 59 8.977 8.977 8.417 0.560 17949 454 1 4 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.177 -0.068 17949 455 1 4 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.533 0.927 17949 456 1 4 . 1 1 61 61 ALA H H 61 8.089 8.089 7.921 0.168 17949 457 1 4 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.463 0.807 17949 458 1 4 . 1 1 62 62 CYS H H 62 8.706 8.706 8.676 0.030 17949 459 1 4 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.414 0.209 17949 460 1 4 . 1 1 63 63 TRP H H 63 9.739 9.739 8.691 1.048 17949 461 1 4 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.407 1.201 17949 462 1 4 . 1 1 64 64 CYS H H 64 8.649 8.649 7.870 0.779 17949 463 1 4 . 1 1 65 65 THR HA H 65 4.591 4.591 4.301 0.290 17949 464 1 4 . 1 1 65 65 THR H H 65 7.937 7.937 8.122 -0.185 17949 465 1 4 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.197 -0.187 17949 466 1 4 . 1 1 66 66 HIS H H 66 8.755 8.755 8.665 0.090 17949 467 1 4 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.102 0.074 17949 468 1 4 . 1 1 67 67 LEU H H 67 8.492 8.492 7.468 1.024 17949 469 1 4 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.479 0.069 17949 470 1 4 . 1 1 68 68 TYR H H 68 7.880 7.880 8.546 -0.666 17949 471 1 4 . 1 1 69 69 GLU HA H 69 3.766 3.766 3.887 -0.121 17949 472 1 4 . 1 1 69 69 GLU H H 69 8.787 8.787 9.072 -0.285 17949 473 1 4 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.194 0.062 17949 474 1 4 . 1 1 70 70 GLN H H 70 7.925 7.925 8.030 -0.105 17949 475 1 4 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.293 -0.248 17949 476 1 4 . 1 1 71 71 ALA H H 71 7.490 7.490 7.522 -0.032 17949 477 1 4 . 1 1 72 72 VAL HA H 72 4.148 4.148 3.981 0.167 17949 478 1 4 . 1 1 72 72 VAL H H 72 8.532 8.532 8.126 0.406 17949 479 1 4 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.605 0.011 17949 480 1 4 . 1 1 73 73 VAL H H 73 8.092 8.092 7.942 0.150 17949 481 1 4 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.019 -0.922 17949 482 1 4 . 1 1 74 74 TRP H H 74 8.500 8.500 8.581 -0.081 17949 483 1 4 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.885 -3.056 17949 484 1 4 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.422 -0.223 17949 485 1 4 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.958 -0.323 17949 486 1 4 . 1 1 78 78 ASN H H 78 8.235 8.235 8.608 -0.373 17949 487 1 4 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.646 -0.054 17949 488 1 4 . 1 1 79 79 LYS H H 79 7.039 7.039 7.467 -0.428 17949 489 1 4 . 1 1 80 80 THR HA H 80 4.427 4.427 4.484 -0.057 17949 490 1 4 . 1 1 80 80 THR H H 80 8.483 8.483 8.077 0.406 17949 491 1 4 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.125 0.510 17949 492 1 4 . 1 1 81 81 CYS H H 81 8.835 8.835 8.512 0.323 17949 493 1 5 . 1 1 12 12 SER HA H 12 4.680 4.680 4.626 0.054 17949 494 1 5 . 1 1 12 12 SER H H 12 8.268 8.268 8.095 0.173 17949 495 1 5 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.147 0.075 17949 496 1 5 . 1 1 13 13 ILE H H 13 8.220 8.220 7.618 0.602 17949 497 1 5 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.488 -0.136 17949 498 1 5 . 1 1 14 14 GLU H H 14 8.365 8.365 8.222 0.143 17949 499 1 5 . 1 1 15 15 GLY H H 15 8.300 8.300 8.396 -0.096 17949 500 1 5 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.007 0.549 17949 501 1 5 . 1 1 16 16 ARG H H 16 8.200 8.200 8.605 -0.405 17949 502 1 5 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.549 -0.212 17949 503 1 5 . 1 1 17 17 LYS H H 17 8.446 8.446 7.787 0.659 17949 504 1 5 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.259 0.385 17949 505 1 5 . 1 1 18 18 GLU H H 18 7.534 7.534 8.393 -0.859 17949 506 1 5 . 1 1 19 19 GLY H H 19 7.245 7.245 8.062 -0.817 17949 507 1 5 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.486 0.440 17949 508 1 5 . 1 1 20 20 TYR H H 20 9.101 9.101 8.097 1.004 17949 509 1 5 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.189 0.432 17949 510 1 5 . 1 1 21 21 LEU H H 21 7.703 7.703 8.504 -0.801 17949 511 1 5 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.939 1.289 17949 512 1 5 . 1 1 22 22 VAL H H 22 7.049 7.049 7.792 -0.743 17949 513 1 5 . 1 1 23 23 SER HA H 23 4.870 4.870 4.797 0.073 17949 514 1 5 . 1 1 23 23 SER H H 23 8.356 8.356 7.800 0.556 17949 515 1 5 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.296 -0.213 17949 516 1 5 . 1 1 24 24 LYS H H 24 9.212 9.212 8.792 0.420 17949 517 1 5 . 1 1 25 25 SER HA H 25 4.440 4.440 4.639 -0.199 17949 518 1 5 . 1 1 25 25 SER H H 25 8.024 8.024 8.209 -0.185 17949 519 1 5 . 1 1 26 26 THR HA H 26 4.513 4.513 4.629 -0.116 17949 520 1 5 . 1 1 26 26 THR H H 26 7.595 7.595 8.002 -0.407 17949 521 1 5 . 1 1 27 27 GLY H H 27 8.388 8.388 8.606 -0.218 17949 522 1 5 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.546 0.405 17949 523 1 5 . 1 1 28 28 CYS H H 28 8.131 8.131 7.972 0.159 17949 524 1 5 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.496 0.087 17949 525 1 5 . 1 1 29 29 LYS H H 29 8.302 8.302 8.256 0.046 17949 526 1 5 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.266 0.391 17949 527 1 5 . 1 1 31 31 GLU H H 31 8.299 8.299 8.565 -0.266 17949 528 1 5 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.745 0.086 17949 529 1 5 . 1 1 32 32 CYS H H 32 8.157 8.157 8.821 -0.664 17949 530 1 5 . 1 1 33 33 LEU H H 33 8.495 8.495 8.704 -0.209 17949 531 1 5 . 1 1 34 34 LYS H H 34 8.445 8.445 8.132 0.313 17949 532 1 5 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.554 -0.927 17949 533 1 5 . 1 1 35 35 LEU H H 35 8.229 8.229 8.350 -0.121 17949 534 1 5 . 1 1 36 36 GLY H H 36 9.039 9.039 7.817 1.222 17949 535 1 5 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.775 -0.155 17949 536 1 5 . 1 1 37 37 ASP H H 37 8.511 8.511 8.368 0.143 17949 537 1 5 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.462 0.369 17949 538 1 5 . 1 1 38 38 ASN H H 38 9.114 9.114 8.189 0.925 17949 539 1 5 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.134 0.392 17949 540 1 5 . 1 1 39 39 ASP H H 39 9.019 9.019 8.807 0.212 17949 541 1 5 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.090 0.246 17949 542 1 5 . 1 1 40 40 TYR H H 40 8.036 8.036 7.515 0.521 17949 543 1 5 . 1 1 41 41 CYS HA H 41 4.213 4.213 3.903 0.310 17949 544 1 5 . 1 1 41 41 CYS H H 41 8.164 8.164 8.271 -0.107 17949 545 1 5 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.140 -0.426 17949 546 1 5 . 1 1 42 42 LEU H H 42 8.236 8.236 7.765 0.471 17949 547 1 5 . 1 1 43 43 ARG HA H 43 3.864 3.864 3.999 -0.135 17949 548 1 5 . 1 1 43 43 ARG H H 43 8.018 8.018 8.814 -0.796 17949 549 1 5 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.415 -0.546 17949 550 1 5 . 1 1 44 44 GLU H H 44 8.325 8.325 7.878 0.447 17949 551 1 5 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.880 -0.542 17949 552 1 5 . 1 1 45 45 CYS H H 45 8.666 8.666 7.493 1.173 17949 553 1 5 . 1 1 46 46 LYS H H 46 7.959 7.959 7.740 0.219 17949 554 1 5 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.225 -0.321 17949 555 1 5 . 1 1 47 47 GLN H H 47 8.230 8.230 8.144 0.086 17949 556 1 5 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.351 -0.243 17949 557 1 5 . 1 1 48 48 GLN H H 48 7.614 7.614 8.156 -0.542 17949 558 1 5 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.756 0.199 17949 559 1 5 . 1 1 49 49 TYR H H 49 8.260 8.260 7.580 0.680 17949 560 1 5 . 1 1 50 50 GLY H H 50 7.705 7.705 7.607 0.098 17949 561 1 5 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.479 -0.596 17949 562 1 5 . 1 1 51 51 LYS H H 51 8.621 8.621 8.606 0.015 17949 563 1 5 . 1 1 52 52 SER HA H 52 4.510 4.510 4.554 -0.044 17949 564 1 5 . 1 1 52 52 SER H H 52 8.436 8.436 7.917 0.519 17949 565 1 5 . 1 1 53 53 SER HA H 53 4.637 4.637 4.319 0.318 17949 566 1 5 . 1 1 53 53 SER H H 53 7.884 7.884 7.830 0.054 17949 567 1 5 . 1 1 54 54 GLY H H 54 7.890 7.890 8.074 -0.184 17949 568 1 5 . 1 1 55 55 GLY H H 55 7.893 7.893 7.671 0.222 17949 569 1 5 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.818 0.000 17949 570 1 5 . 1 1 56 56 TYR H H 56 8.939 8.939 8.451 0.488 17949 571 1 5 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.768 0.434 17949 572 1 5 . 1 1 57 57 CYS H H 57 9.281 9.281 9.051 0.230 17949 573 1 5 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.272 0.658 17949 574 1 5 . 1 1 58 58 TYR H H 58 9.406 9.406 8.221 1.185 17949 575 1 5 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.980 -0.546 17949 576 1 5 . 1 1 59 59 ALA H H 59 8.977 8.977 8.356 0.621 17949 577 1 5 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.312 -0.203 17949 578 1 5 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.543 0.917 17949 579 1 5 . 1 1 61 61 ALA H H 61 8.089 8.089 7.904 0.185 17949 580 1 5 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.260 1.010 17949 581 1 5 . 1 1 62 62 CYS H H 62 8.706 8.706 8.701 0.005 17949 582 1 5 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.423 0.200 17949 583 1 5 . 1 1 63 63 TRP H H 63 9.739 9.739 8.570 1.169 17949 584 1 5 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.489 1.119 17949 585 1 5 . 1 1 64 64 CYS H H 64 8.649 8.649 8.041 0.608 17949 586 1 5 . 1 1 65 65 THR HA H 65 4.591 4.591 4.291 0.300 17949 587 1 5 . 1 1 65 65 THR H H 65 7.937 7.937 8.346 -0.409 17949 588 1 5 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.195 -0.185 17949 589 1 5 . 1 1 66 66 HIS H H 66 8.755 8.755 8.502 0.253 17949 590 1 5 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.018 0.158 17949 591 1 5 . 1 1 67 67 LEU H H 67 8.492 8.492 7.754 0.738 17949 592 1 5 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.679 -0.131 17949 593 1 5 . 1 1 68 68 TYR H H 68 7.880 7.880 8.127 -0.247 17949 594 1 5 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.095 -0.329 17949 595 1 5 . 1 1 69 69 GLU H H 69 8.787 8.787 8.736 0.051 17949 596 1 5 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.192 0.064 17949 597 1 5 . 1 1 70 70 GLN H H 70 7.925 7.925 8.221 -0.296 17949 598 1 5 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.103 -0.058 17949 599 1 5 . 1 1 71 71 ALA H H 71 7.490 7.490 7.277 0.213 17949 600 1 5 . 1 1 72 72 VAL HA H 72 4.148 4.148 3.952 0.196 17949 601 1 5 . 1 1 72 72 VAL H H 72 8.532 8.532 7.890 0.642 17949 602 1 5 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.316 0.300 17949 603 1 5 . 1 1 73 73 VAL H H 73 8.092 8.092 7.765 0.327 17949 604 1 5 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.847 -0.750 17949 605 1 5 . 1 1 74 74 TRP H H 74 8.500 8.500 8.151 0.349 17949 606 1 5 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.153 -2.324 17949 607 1 5 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.414 -0.215 17949 608 1 5 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.746 -0.111 17949 609 1 5 . 1 1 78 78 ASN H H 78 8.235 8.235 7.994 0.241 17949 610 1 5 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.354 0.238 17949 611 1 5 . 1 1 79 79 LYS H H 79 7.039 7.039 7.655 -0.616 17949 612 1 5 . 1 1 80 80 THR HA H 80 4.427 4.427 4.063 0.364 17949 613 1 5 . 1 1 80 80 THR H H 80 8.483 8.483 8.027 0.456 17949 614 1 5 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.188 0.447 17949 615 1 5 . 1 1 81 81 CYS H H 81 8.835 8.835 8.383 0.452 17949 616 1 6 . 1 1 12 12 SER HA H 12 4.680 4.680 4.598 0.082 17949 617 1 6 . 1 1 12 12 SER H H 12 8.268 8.268 8.183 0.085 17949 618 1 6 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.315 -0.093 17949 619 1 6 . 1 1 13 13 ILE H H 13 8.220 8.220 8.636 -0.416 17949 620 1 6 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.534 -0.182 17949 621 1 6 . 1 1 14 14 GLU H H 14 8.365 8.365 7.757 0.608 17949 622 1 6 . 1 1 15 15 GLY H H 15 8.300 8.300 8.849 -0.549 17949 623 1 6 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.416 0.140 17949 624 1 6 . 1 1 16 16 ARG H H 16 8.200 8.200 8.402 -0.202 17949 625 1 6 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.506 -0.169 17949 626 1 6 . 1 1 17 17 LYS H H 17 8.446 8.446 7.771 0.675 17949 627 1 6 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.027 0.617 17949 628 1 6 . 1 1 18 18 GLU H H 18 7.534 7.534 8.763 -1.229 17949 629 1 6 . 1 1 19 19 GLY H H 19 7.245 7.245 7.418 -0.173 17949 630 1 6 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.396 0.530 17949 631 1 6 . 1 1 20 20 TYR H H 20 9.101 9.101 8.324 0.777 17949 632 1 6 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.002 0.619 17949 633 1 6 . 1 1 21 21 LEU H H 21 7.703 7.703 8.314 -0.611 17949 634 1 6 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.940 1.288 17949 635 1 6 . 1 1 22 22 VAL H H 22 7.049 7.049 7.592 -0.543 17949 636 1 6 . 1 1 23 23 SER HA H 23 4.870 4.870 4.811 0.059 17949 637 1 6 . 1 1 23 23 SER H H 23 8.356 8.356 8.404 -0.048 17949 638 1 6 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.310 -0.227 17949 639 1 6 . 1 1 24 24 LYS H H 24 9.212 9.212 8.744 0.468 17949 640 1 6 . 1 1 25 25 SER HA H 25 4.440 4.440 4.276 0.164 17949 641 1 6 . 1 1 25 25 SER H H 25 8.024 8.024 8.204 -0.180 17949 642 1 6 . 1 1 26 26 THR HA H 26 4.513 4.513 4.404 0.109 17949 643 1 6 . 1 1 26 26 THR H H 26 7.595 7.595 7.954 -0.359 17949 644 1 6 . 1 1 27 27 GLY H H 27 8.388 8.388 8.240 0.148 17949 645 1 6 . 1 1 28 28 CYS HA H 28 4.951 4.951 5.041 -0.090 17949 646 1 6 . 1 1 28 28 CYS H H 28 8.131 8.131 8.576 -0.445 17949 647 1 6 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.697 -0.114 17949 648 1 6 . 1 1 29 29 LYS H H 29 8.302 8.302 8.275 0.027 17949 649 1 6 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.217 0.440 17949 650 1 6 . 1 1 31 31 GLU H H 31 8.299 8.299 8.599 -0.300 17949 651 1 6 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.543 0.288 17949 652 1 6 . 1 1 32 32 CYS H H 32 8.157 8.157 8.671 -0.514 17949 653 1 6 . 1 1 33 33 LEU H H 33 8.495 8.495 8.829 -0.334 17949 654 1 6 . 1 1 34 34 LYS H H 34 8.445 8.445 8.249 0.196 17949 655 1 6 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.982 -1.355 17949 656 1 6 . 1 1 35 35 LEU H H 35 8.229 8.229 7.838 0.391 17949 657 1 6 . 1 1 36 36 GLY H H 36 9.039 9.039 8.561 0.478 17949 658 1 6 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.366 0.254 17949 659 1 6 . 1 1 37 37 ASP H H 37 8.511 8.511 8.432 0.079 17949 660 1 6 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.891 -0.060 17949 661 1 6 . 1 1 38 38 ASN H H 38 9.114 9.114 7.817 1.297 17949 662 1 6 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.808 -0.282 17949 663 1 6 . 1 1 39 39 ASP H H 39 9.019 9.019 8.765 0.254 17949 664 1 6 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.496 -0.160 17949 665 1 6 . 1 1 40 40 TYR H H 40 8.036 8.036 8.276 -0.240 17949 666 1 6 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.188 0.025 17949 667 1 6 . 1 1 41 41 CYS H H 41 8.164 8.164 8.325 -0.161 17949 668 1 6 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.297 -0.583 17949 669 1 6 . 1 1 42 42 LEU H H 42 8.236 8.236 8.183 0.053 17949 670 1 6 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.388 -0.524 17949 671 1 6 . 1 1 43 43 ARG H H 43 8.018 8.018 7.396 0.622 17949 672 1 6 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.389 -0.520 17949 673 1 6 . 1 1 44 44 GLU H H 44 8.325 8.325 7.866 0.459 17949 674 1 6 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.600 -0.262 17949 675 1 6 . 1 1 45 45 CYS H H 45 8.666 8.666 7.502 1.164 17949 676 1 6 . 1 1 46 46 LYS H H 46 7.959 7.959 7.760 0.199 17949 677 1 6 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.438 -0.534 17949 678 1 6 . 1 1 47 47 GLN H H 47 8.230 8.230 8.160 0.070 17949 679 1 6 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.348 -0.240 17949 680 1 6 . 1 1 48 48 GLN H H 48 7.614 7.614 8.624 -1.010 17949 681 1 6 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.476 0.479 17949 682 1 6 . 1 1 49 49 TYR H H 49 8.260 8.260 7.724 0.536 17949 683 1 6 . 1 1 50 50 GLY H H 50 7.705 7.705 7.617 0.088 17949 684 1 6 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.156 -0.273 17949 685 1 6 . 1 1 51 51 LYS H H 51 8.621 8.621 8.679 -0.058 17949 686 1 6 . 1 1 52 52 SER HA H 52 4.510 4.510 4.529 -0.019 17949 687 1 6 . 1 1 52 52 SER H H 52 8.436 8.436 7.910 0.526 17949 688 1 6 . 1 1 53 53 SER HA H 53 4.637 4.637 4.363 0.274 17949 689 1 6 . 1 1 53 53 SER H H 53 7.884 7.884 7.683 0.201 17949 690 1 6 . 1 1 54 54 GLY H H 54 7.890 7.890 8.114 -0.224 17949 691 1 6 . 1 1 55 55 GLY H H 55 7.893 7.893 7.954 -0.061 17949 692 1 6 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.895 -0.077 17949 693 1 6 . 1 1 56 56 TYR H H 56 8.939 8.939 8.767 0.172 17949 694 1 6 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.620 0.582 17949 695 1 6 . 1 1 57 57 CYS H H 57 9.281 9.281 9.161 0.120 17949 696 1 6 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.226 0.704 17949 697 1 6 . 1 1 58 58 TYR H H 58 9.406 9.406 8.394 1.012 17949 698 1 6 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.939 -0.505 17949 699 1 6 . 1 1 59 59 ALA H H 59 8.977 8.977 8.271 0.706 17949 700 1 6 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.316 -0.207 17949 701 1 6 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.463 0.998 17949 702 1 6 . 1 1 61 61 ALA H H 61 8.089 8.089 7.630 0.459 17949 703 1 6 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.275 0.995 17949 704 1 6 . 1 1 62 62 CYS H H 62 8.706 8.706 8.684 0.022 17949 705 1 6 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.426 0.197 17949 706 1 6 . 1 1 63 63 TRP H H 63 9.739 9.739 8.360 1.379 17949 707 1 6 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.568 1.040 17949 708 1 6 . 1 1 64 64 CYS H H 64 8.649 8.649 7.382 1.267 17949 709 1 6 . 1 1 65 65 THR HA H 65 4.591 4.591 4.386 0.205 17949 710 1 6 . 1 1 65 65 THR H H 65 7.937 7.937 8.164 -0.227 17949 711 1 6 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.178 -0.168 17949 712 1 6 . 1 1 66 66 HIS H H 66 8.755 8.755 8.706 0.049 17949 713 1 6 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.599 -0.423 17949 714 1 6 . 1 1 67 67 LEU H H 67 8.492 8.492 7.744 0.748 17949 715 1 6 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.452 0.096 17949 716 1 6 . 1 1 68 68 TYR H H 68 7.880 7.880 8.445 -0.565 17949 717 1 6 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.323 -0.557 17949 718 1 6 . 1 1 69 69 GLU H H 69 8.787 8.787 8.840 -0.053 17949 719 1 6 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.277 -0.021 17949 720 1 6 . 1 1 70 70 GLN H H 70 7.925 7.925 8.220 -0.295 17949 721 1 6 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.325 -0.280 17949 722 1 6 . 1 1 71 71 ALA H H 71 7.490 7.490 7.350 0.140 17949 723 1 6 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.048 0.100 17949 724 1 6 . 1 1 72 72 VAL H H 72 8.532 8.532 8.021 0.511 17949 725 1 6 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.526 0.090 17949 726 1 6 . 1 1 73 73 VAL H H 73 8.092 8.092 7.841 0.251 17949 727 1 6 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.885 -0.788 17949 728 1 6 . 1 1 74 74 TRP H H 74 8.500 8.500 8.269 0.231 17949 729 1 6 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.725 -2.896 17949 730 1 6 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.355 -0.156 17949 731 1 6 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.600 0.035 17949 732 1 6 . 1 1 78 78 ASN H H 78 8.235 8.235 8.271 -0.036 17949 733 1 6 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.321 0.271 17949 734 1 6 . 1 1 79 79 LYS H H 79 7.039 7.039 8.194 -1.155 17949 735 1 6 . 1 1 80 80 THR HA H 80 4.427 4.427 4.148 0.279 17949 736 1 6 . 1 1 80 80 THR H H 80 8.483 8.483 8.225 0.258 17949 737 1 6 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.366 0.269 17949 738 1 6 . 1 1 81 81 CYS H H 81 8.835 8.835 8.248 0.587 17949 739 1 7 . 1 1 12 12 SER HA H 12 4.680 4.680 4.704 -0.024 17949 740 1 7 . 1 1 12 12 SER H H 12 8.268 8.268 8.377 -0.109 17949 741 1 7 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.078 0.144 17949 742 1 7 . 1 1 13 13 ILE H H 13 8.220 8.220 8.510 -0.290 17949 743 1 7 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.297 0.055 17949 744 1 7 . 1 1 14 14 GLU H H 14 8.365 8.365 8.572 -0.207 17949 745 1 7 . 1 1 15 15 GLY H H 15 8.300 8.300 8.378 -0.078 17949 746 1 7 . 1 1 16 16 ARG HA H 16 4.556 4.556 3.667 0.889 17949 747 1 7 . 1 1 16 16 ARG H H 16 8.200 8.200 8.425 -0.225 17949 748 1 7 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.456 -0.119 17949 749 1 7 . 1 1 17 17 LYS H H 17 8.446 8.446 7.795 0.651 17949 750 1 7 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.457 0.187 17949 751 1 7 . 1 1 18 18 GLU H H 18 7.534 7.534 8.463 -0.929 17949 752 1 7 . 1 1 19 19 GLY H H 19 7.245 7.245 7.982 -0.737 17949 753 1 7 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.642 0.284 17949 754 1 7 . 1 1 20 20 TYR H H 20 9.101 9.101 8.255 0.846 17949 755 1 7 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.671 -0.050 17949 756 1 7 . 1 1 21 21 LEU H H 21 7.703 7.703 8.700 -0.997 17949 757 1 7 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.049 1.179 17949 758 1 7 . 1 1 22 22 VAL H H 22 7.049 7.049 7.840 -0.791 17949 759 1 7 . 1 1 23 23 SER HA H 23 4.870 4.870 4.600 0.270 17949 760 1 7 . 1 1 23 23 SER H H 23 8.356 8.356 8.452 -0.096 17949 761 1 7 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.089 -0.006 17949 762 1 7 . 1 1 24 24 LYS H H 24 9.212 9.212 8.666 0.546 17949 763 1 7 . 1 1 25 25 SER HA H 25 4.440 4.440 4.151 0.289 17949 764 1 7 . 1 1 25 25 SER H H 25 8.024 8.024 7.987 0.037 17949 765 1 7 . 1 1 26 26 THR HA H 26 4.513 4.513 4.382 0.131 17949 766 1 7 . 1 1 26 26 THR H H 26 7.595 7.595 8.006 -0.411 17949 767 1 7 . 1 1 27 27 GLY H H 27 8.388 8.388 8.392 -0.004 17949 768 1 7 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.826 0.125 17949 769 1 7 . 1 1 28 28 CYS H H 28 8.131 8.131 8.511 -0.380 17949 770 1 7 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.835 -0.252 17949 771 1 7 . 1 1 29 29 LYS H H 29 8.302 8.302 8.215 0.087 17949 772 1 7 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.447 0.210 17949 773 1 7 . 1 1 31 31 GLU H H 31 8.299 8.299 8.048 0.251 17949 774 1 7 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.852 -0.021 17949 775 1 7 . 1 1 32 32 CYS H H 32 8.157 8.157 8.689 -0.532 17949 776 1 7 . 1 1 33 33 LEU H H 33 8.495 8.495 8.410 0.085 17949 777 1 7 . 1 1 34 34 LYS H H 34 8.445 8.445 7.769 0.676 17949 778 1 7 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.384 -0.757 17949 779 1 7 . 1 1 35 35 LEU H H 35 8.229 8.229 8.670 -0.441 17949 780 1 7 . 1 1 36 36 GLY H H 36 9.039 9.039 7.661 1.378 17949 781 1 7 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.428 0.192 17949 782 1 7 . 1 1 37 37 ASP H H 37 8.511 8.511 8.808 -0.297 17949 783 1 7 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.978 -0.147 17949 784 1 7 . 1 1 38 38 ASN H H 38 9.114 9.114 8.241 0.873 17949 785 1 7 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.559 -0.033 17949 786 1 7 . 1 1 39 39 ASP H H 39 9.019 9.019 8.790 0.229 17949 787 1 7 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.196 0.140 17949 788 1 7 . 1 1 40 40 TYR H H 40 8.036 8.036 8.356 -0.320 17949 789 1 7 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.451 -0.238 17949 790 1 7 . 1 1 41 41 CYS H H 41 8.164 8.164 8.352 -0.188 17949 791 1 7 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.252 -0.538 17949 792 1 7 . 1 1 42 42 LEU H H 42 8.236 8.236 7.708 0.528 17949 793 1 7 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.358 -0.494 17949 794 1 7 . 1 1 43 43 ARG H H 43 8.018 8.018 7.323 0.695 17949 795 1 7 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.205 -0.336 17949 796 1 7 . 1 1 44 44 GLU H H 44 8.325 8.325 7.679 0.646 17949 797 1 7 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.523 -0.185 17949 798 1 7 . 1 1 45 45 CYS H H 45 8.666 8.666 7.833 0.833 17949 799 1 7 . 1 1 46 46 LYS H H 46 7.959 7.959 7.606 0.353 17949 800 1 7 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.101 -0.197 17949 801 1 7 . 1 1 47 47 GLN H H 47 8.230 8.230 8.158 0.072 17949 802 1 7 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.082 0.026 17949 803 1 7 . 1 1 48 48 GLN H H 48 7.614 7.614 7.893 -0.279 17949 804 1 7 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.596 0.359 17949 805 1 7 . 1 1 49 49 TYR H H 49 8.260 8.260 7.740 0.520 17949 806 1 7 . 1 1 50 50 GLY H H 50 7.705 7.705 7.621 0.084 17949 807 1 7 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.005 -0.122 17949 808 1 7 . 1 1 51 51 LYS H H 51 8.621 8.621 8.658 -0.037 17949 809 1 7 . 1 1 52 52 SER HA H 52 4.510 4.510 4.300 0.210 17949 810 1 7 . 1 1 52 52 SER H H 52 8.436 8.436 8.323 0.113 17949 811 1 7 . 1 1 53 53 SER HA H 53 4.637 4.637 4.904 -0.267 17949 812 1 7 . 1 1 53 53 SER H H 53 7.884 7.884 7.538 0.346 17949 813 1 7 . 1 1 54 54 GLY H H 54 7.890 7.890 7.858 0.032 17949 814 1 7 . 1 1 55 55 GLY H H 55 7.893 7.893 7.945 -0.052 17949 815 1 7 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.836 -0.018 17949 816 1 7 . 1 1 56 56 TYR H H 56 8.939 8.939 7.896 1.043 17949 817 1 7 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.686 0.516 17949 818 1 7 . 1 1 57 57 CYS H H 57 9.281 9.281 8.626 0.655 17949 819 1 7 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.450 0.480 17949 820 1 7 . 1 1 58 58 TYR H H 58 9.406 9.406 8.121 1.285 17949 821 1 7 . 1 1 59 59 ALA HA H 59 3.434 3.434 4.038 -0.604 17949 822 1 7 . 1 1 59 59 ALA H H 59 8.977 8.977 8.389 0.588 17949 823 1 7 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.173 -0.064 17949 824 1 7 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.512 0.948 17949 825 1 7 . 1 1 61 61 ALA H H 61 8.089 8.089 7.794 0.295 17949 826 1 7 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.395 0.875 17949 827 1 7 . 1 1 62 62 CYS H H 62 8.706 8.706 8.661 0.045 17949 828 1 7 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.400 0.223 17949 829 1 7 . 1 1 63 63 TRP H H 63 9.739 9.739 8.364 1.375 17949 830 1 7 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.390 1.218 17949 831 1 7 . 1 1 64 64 CYS H H 64 8.649 8.649 8.154 0.495 17949 832 1 7 . 1 1 65 65 THR HA H 65 4.591 4.591 4.289 0.302 17949 833 1 7 . 1 1 65 65 THR H H 65 7.937 7.937 8.341 -0.404 17949 834 1 7 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.221 -0.211 17949 835 1 7 . 1 1 66 66 HIS H H 66 8.755 8.755 8.567 0.188 17949 836 1 7 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.416 -0.240 17949 837 1 7 . 1 1 67 67 LEU H H 67 8.492 8.492 7.145 1.347 17949 838 1 7 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.467 0.081 17949 839 1 7 . 1 1 68 68 TYR H H 68 7.880 7.880 8.211 -0.331 17949 840 1 7 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.092 -0.326 17949 841 1 7 . 1 1 69 69 GLU H H 69 8.787 8.787 8.622 0.165 17949 842 1 7 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.175 0.081 17949 843 1 7 . 1 1 70 70 GLN H H 70 7.925 7.925 8.134 -0.209 17949 844 1 7 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.321 -0.276 17949 845 1 7 . 1 1 71 71 ALA H H 71 7.490 7.490 7.735 -0.245 17949 846 1 7 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.205 -0.057 17949 847 1 7 . 1 1 72 72 VAL H H 72 8.532 8.532 8.446 0.086 17949 848 1 7 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.578 0.038 17949 849 1 7 . 1 1 73 73 VAL H H 73 8.092 8.092 7.793 0.299 17949 850 1 7 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.962 -0.865 17949 851 1 7 . 1 1 74 74 TRP H H 74 8.500 8.500 8.359 0.141 17949 852 1 7 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.720 -2.891 17949 853 1 7 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.360 -0.161 17949 854 1 7 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.778 -0.143 17949 855 1 7 . 1 1 78 78 ASN H H 78 8.235 8.235 8.453 -0.218 17949 856 1 7 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.624 -0.032 17949 857 1 7 . 1 1 79 79 LYS H H 79 7.039 7.039 7.805 -0.766 17949 858 1 7 . 1 1 80 80 THR HA H 80 4.427 4.427 4.367 0.060 17949 859 1 7 . 1 1 80 80 THR H H 80 8.483 8.483 8.348 0.135 17949 860 1 7 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.329 0.306 17949 861 1 7 . 1 1 81 81 CYS H H 81 8.835 8.835 8.366 0.469 17949 862 1 8 . 1 1 12 12 SER HA H 12 4.680 4.680 4.665 0.015 17949 863 1 8 . 1 1 12 12 SER H H 12 8.268 8.268 8.176 0.092 17949 864 1 8 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.164 0.058 17949 865 1 8 . 1 1 13 13 ILE H H 13 8.220 8.220 8.244 -0.024 17949 866 1 8 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.639 -0.287 17949 867 1 8 . 1 1 14 14 GLU H H 14 8.365 8.365 8.665 -0.300 17949 868 1 8 . 1 1 15 15 GLY H H 15 8.300 8.300 8.342 -0.042 17949 869 1 8 . 1 1 16 16 ARG HA H 16 4.556 4.556 3.975 0.581 17949 870 1 8 . 1 1 16 16 ARG H H 16 8.200 8.200 8.353 -0.153 17949 871 1 8 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.536 -0.199 17949 872 1 8 . 1 1 17 17 LYS H H 17 8.446 8.446 7.513 0.933 17949 873 1 8 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.700 -0.056 17949 874 1 8 . 1 1 18 18 GLU H H 18 7.534 7.534 8.236 -0.702 17949 875 1 8 . 1 1 19 19 GLY H H 19 7.245 7.245 7.302 -0.057 17949 876 1 8 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.757 0.169 17949 877 1 8 . 1 1 20 20 TYR H H 20 9.101 9.101 8.327 0.774 17949 878 1 8 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.086 0.535 17949 879 1 8 . 1 1 21 21 LEU H H 21 7.703 7.703 8.718 -1.015 17949 880 1 8 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.972 1.256 17949 881 1 8 . 1 1 22 22 VAL H H 22 7.049 7.049 7.952 -0.903 17949 882 1 8 . 1 1 23 23 SER HA H 23 4.870 4.870 4.666 0.204 17949 883 1 8 . 1 1 23 23 SER H H 23 8.356 8.356 8.249 0.107 17949 884 1 8 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.393 -0.310 17949 885 1 8 . 1 1 24 24 LYS H H 24 9.212 9.212 8.672 0.540 17949 886 1 8 . 1 1 25 25 SER HA H 25 4.440 4.440 4.533 -0.093 17949 887 1 8 . 1 1 25 25 SER H H 25 8.024 8.024 8.063 -0.039 17949 888 1 8 . 1 1 26 26 THR HA H 26 4.513 4.513 4.602 -0.089 17949 889 1 8 . 1 1 26 26 THR H H 26 7.595 7.595 7.734 -0.139 17949 890 1 8 . 1 1 27 27 GLY H H 27 8.388 8.388 8.571 -0.183 17949 891 1 8 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.648 0.303 17949 892 1 8 . 1 1 28 28 CYS H H 28 8.131 8.131 7.944 0.187 17949 893 1 8 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.550 0.033 17949 894 1 8 . 1 1 29 29 LYS H H 29 8.302 8.302 8.168 0.134 17949 895 1 8 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.183 0.474 17949 896 1 8 . 1 1 31 31 GLU H H 31 8.299 8.299 7.849 0.450 17949 897 1 8 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.744 0.087 17949 898 1 8 . 1 1 32 32 CYS H H 32 8.157 8.157 8.453 -0.296 17949 899 1 8 . 1 1 33 33 LEU H H 33 8.495 8.495 8.656 -0.161 17949 900 1 8 . 1 1 34 34 LYS H H 34 8.445 8.445 8.592 -0.147 17949 901 1 8 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.260 -0.633 17949 902 1 8 . 1 1 35 35 LEU H H 35 8.229 8.229 8.430 -0.201 17949 903 1 8 . 1 1 36 36 GLY H H 36 9.039 9.039 8.979 0.060 17949 904 1 8 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.699 -0.079 17949 905 1 8 . 1 1 37 37 ASP H H 37 8.511 8.511 8.411 0.100 17949 906 1 8 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.991 -0.160 17949 907 1 8 . 1 1 38 38 ASN H H 38 9.114 9.114 7.731 1.383 17949 908 1 8 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.962 -0.436 17949 909 1 8 . 1 1 39 39 ASP H H 39 9.019 9.019 8.716 0.303 17949 910 1 8 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.413 -0.077 17949 911 1 8 . 1 1 40 40 TYR H H 40 8.036 8.036 8.564 -0.528 17949 912 1 8 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.379 -0.166 17949 913 1 8 . 1 1 41 41 CYS H H 41 8.164 8.164 8.252 -0.088 17949 914 1 8 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.307 -0.593 17949 915 1 8 . 1 1 42 42 LEU H H 42 8.236 8.236 8.061 0.175 17949 916 1 8 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.335 -0.471 17949 917 1 8 . 1 1 43 43 ARG H H 43 8.018 8.018 7.129 0.889 17949 918 1 8 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.294 -0.425 17949 919 1 8 . 1 1 44 44 GLU H H 44 8.325 8.325 7.761 0.564 17949 920 1 8 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.122 0.216 17949 921 1 8 . 1 1 45 45 CYS H H 45 8.666 8.666 7.357 1.309 17949 922 1 8 . 1 1 46 46 LYS H H 46 7.959 7.959 7.999 -0.040 17949 923 1 8 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.291 -0.387 17949 924 1 8 . 1 1 47 47 GLN H H 47 8.230 8.230 7.910 0.320 17949 925 1 8 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.546 -0.438 17949 926 1 8 . 1 1 48 48 GLN H H 48 7.614 7.614 8.728 -1.114 17949 927 1 8 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.176 0.779 17949 928 1 8 . 1 1 49 49 TYR H H 49 8.260 8.260 8.578 -0.318 17949 929 1 8 . 1 1 50 50 GLY H H 50 7.705 7.705 7.583 0.122 17949 930 1 8 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.556 -0.673 17949 931 1 8 . 1 1 51 51 LYS H H 51 8.621 8.621 8.548 0.073 17949 932 1 8 . 1 1 52 52 SER HA H 52 4.510 4.510 4.524 -0.014 17949 933 1 8 . 1 1 52 52 SER H H 52 8.436 8.436 8.395 0.041 17949 934 1 8 . 1 1 53 53 SER HA H 53 4.637 4.637 4.288 0.349 17949 935 1 8 . 1 1 53 53 SER H H 53 7.884 7.884 7.363 0.521 17949 936 1 8 . 1 1 54 54 GLY H H 54 7.890 7.890 8.017 -0.127 17949 937 1 8 . 1 1 55 55 GLY H H 55 7.893 7.893 7.764 0.129 17949 938 1 8 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.892 -0.074 17949 939 1 8 . 1 1 56 56 TYR H H 56 8.939 8.939 8.274 0.665 17949 940 1 8 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.707 0.495 17949 941 1 8 . 1 1 57 57 CYS H H 57 9.281 9.281 9.177 0.104 17949 942 1 8 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.292 0.638 17949 943 1 8 . 1 1 58 58 TYR H H 58 9.406 9.406 8.090 1.316 17949 944 1 8 . 1 1 59 59 ALA HA H 59 3.434 3.434 4.001 -0.567 17949 945 1 8 . 1 1 59 59 ALA H H 59 8.977 8.977 8.423 0.554 17949 946 1 8 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.166 -0.057 17949 947 1 8 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.459 1.001 17949 948 1 8 . 1 1 61 61 ALA H H 61 8.089 8.089 7.784 0.305 17949 949 1 8 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.328 0.942 17949 950 1 8 . 1 1 62 62 CYS H H 62 8.706 8.706 8.725 -0.019 17949 951 1 8 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.473 0.150 17949 952 1 8 . 1 1 63 63 TRP H H 63 9.739 9.739 7.960 1.779 17949 953 1 8 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.510 1.098 17949 954 1 8 . 1 1 64 64 CYS H H 64 8.649 8.649 7.646 1.003 17949 955 1 8 . 1 1 65 65 THR HA H 65 4.591 4.591 4.337 0.254 17949 956 1 8 . 1 1 65 65 THR H H 65 7.937 7.937 8.132 -0.195 17949 957 1 8 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.131 -0.121 17949 958 1 8 . 1 1 66 66 HIS H H 66 8.755 8.755 8.487 0.268 17949 959 1 8 . 1 1 67 67 LEU HA H 67 4.176 4.176 3.894 0.282 17949 960 1 8 . 1 1 67 67 LEU H H 67 8.492 8.492 7.585 0.907 17949 961 1 8 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.624 -0.076 17949 962 1 8 . 1 1 68 68 TYR H H 68 7.880 7.880 8.246 -0.366 17949 963 1 8 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.123 -0.357 17949 964 1 8 . 1 1 69 69 GLU H H 69 8.787 8.787 8.924 -0.137 17949 965 1 8 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.148 0.108 17949 966 1 8 . 1 1 70 70 GLN H H 70 7.925 7.925 8.143 -0.218 17949 967 1 8 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.021 0.024 17949 968 1 8 . 1 1 71 71 ALA H H 71 7.490 7.490 7.583 -0.093 17949 969 1 8 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.170 -0.022 17949 970 1 8 . 1 1 72 72 VAL H H 72 8.532 8.532 8.145 0.387 17949 971 1 8 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.681 -0.065 17949 972 1 8 . 1 1 73 73 VAL H H 73 8.092 8.092 7.885 0.207 17949 973 1 8 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.993 -0.896 17949 974 1 8 . 1 1 74 74 TRP H H 74 8.500 8.500 8.379 0.121 17949 975 1 8 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.600 -2.771 17949 976 1 8 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.417 -0.218 17949 977 1 8 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.744 -0.109 17949 978 1 8 . 1 1 78 78 ASN H H 78 8.235 8.235 8.077 0.158 17949 979 1 8 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.600 -0.008 17949 980 1 8 . 1 1 79 79 LYS H H 79 7.039 7.039 7.820 -0.781 17949 981 1 8 . 1 1 80 80 THR HA H 80 4.427 4.427 4.173 0.254 17949 982 1 8 . 1 1 80 80 THR H H 80 8.483 8.483 8.222 0.261 17949 983 1 8 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.313 0.322 17949 984 1 8 . 1 1 81 81 CYS H H 81 8.835 8.835 8.379 0.456 17949 985 1 9 . 1 1 12 12 SER HA H 12 4.680 4.680 4.233 0.447 17949 986 1 9 . 1 1 12 12 SER H H 12 8.268 8.268 8.399 -0.131 17949 987 1 9 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.247 -0.025 17949 988 1 9 . 1 1 13 13 ILE H H 13 8.220 8.220 7.720 0.500 17949 989 1 9 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.544 -0.192 17949 990 1 9 . 1 1 14 14 GLU H H 14 8.365 8.365 8.603 -0.238 17949 991 1 9 . 1 1 15 15 GLY H H 15 8.300 8.300 8.367 -0.067 17949 992 1 9 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.566 -0.010 17949 993 1 9 . 1 1 16 16 ARG H H 16 8.200 8.200 8.487 -0.287 17949 994 1 9 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.536 -0.199 17949 995 1 9 . 1 1 17 17 LYS H H 17 8.446 8.446 7.832 0.614 17949 996 1 9 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.008 0.636 17949 997 1 9 . 1 1 18 18 GLU H H 18 7.534 7.534 8.569 -1.035 17949 998 1 9 . 1 1 19 19 GLY H H 19 7.245 7.245 7.360 -0.115 17949 999 1 9 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.730 0.196 17949 1000 1 9 . 1 1 20 20 TYR H H 20 9.101 9.101 8.166 0.935 17949 1001 1 9 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.377 0.244 17949 1002 1 9 . 1 1 21 21 LEU H H 21 7.703 7.703 8.648 -0.945 17949 1003 1 9 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.072 1.156 17949 1004 1 9 . 1 1 22 22 VAL H H 22 7.049 7.049 7.788 -0.739 17949 1005 1 9 . 1 1 23 23 SER HA H 23 4.870 4.870 4.596 0.274 17949 1006 1 9 . 1 1 23 23 SER H H 23 8.356 8.356 8.380 -0.024 17949 1007 1 9 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.266 -0.182 17949 1008 1 9 . 1 1 24 24 LYS H H 24 9.212 9.212 8.661 0.551 17949 1009 1 9 . 1 1 25 25 SER HA H 25 4.440 4.440 4.248 0.192 17949 1010 1 9 . 1 1 25 25 SER H H 25 8.024 8.024 8.407 -0.383 17949 1011 1 9 . 1 1 26 26 THR HA H 26 4.513 4.513 4.423 0.090 17949 1012 1 9 . 1 1 26 26 THR H H 26 7.595 7.595 7.693 -0.098 17949 1013 1 9 . 1 1 27 27 GLY H H 27 8.388 8.388 8.292 0.096 17949 1014 1 9 . 1 1 28 28 CYS HA H 28 4.951 4.951 5.106 -0.155 17949 1015 1 9 . 1 1 28 28 CYS H H 28 8.131 8.131 8.091 0.040 17949 1016 1 9 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.844 -0.261 17949 1017 1 9 . 1 1 29 29 LYS H H 29 8.302 8.302 8.331 -0.029 17949 1018 1 9 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.435 0.222 17949 1019 1 9 . 1 1 31 31 GLU H H 31 8.299 8.299 7.579 0.720 17949 1020 1 9 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.914 -0.083 17949 1021 1 9 . 1 1 32 32 CYS H H 32 8.157 8.157 8.506 -0.349 17949 1022 1 9 . 1 1 33 33 LEU H H 33 8.495 8.495 8.366 0.129 17949 1023 1 9 . 1 1 34 34 LYS H H 34 8.445 8.445 7.962 0.483 17949 1024 1 9 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.490 -0.863 17949 1025 1 9 . 1 1 35 35 LEU H H 35 8.229 8.229 8.512 -0.283 17949 1026 1 9 . 1 1 36 36 GLY H H 36 9.039 9.039 8.706 0.333 17949 1027 1 9 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.735 -0.115 17949 1028 1 9 . 1 1 37 37 ASP H H 37 8.511 8.511 8.394 0.117 17949 1029 1 9 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.847 -0.016 17949 1030 1 9 . 1 1 38 38 ASN H H 38 9.114 9.114 7.780 1.334 17949 1031 1 9 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.831 -0.305 17949 1032 1 9 . 1 1 39 39 ASP H H 39 9.019 9.019 8.792 0.227 17949 1033 1 9 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.351 -0.015 17949 1034 1 9 . 1 1 40 40 TYR H H 40 8.036 8.036 8.166 -0.130 17949 1035 1 9 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.207 0.006 17949 1036 1 9 . 1 1 41 41 CYS H H 41 8.164 8.164 8.619 -0.455 17949 1037 1 9 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.084 -0.370 17949 1038 1 9 . 1 1 42 42 LEU H H 42 8.236 8.236 7.905 0.331 17949 1039 1 9 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.042 -0.178 17949 1040 1 9 . 1 1 43 43 ARG H H 43 8.018 8.018 7.349 0.669 17949 1041 1 9 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.138 -0.269 17949 1042 1 9 . 1 1 44 44 GLU H H 44 8.325 8.325 7.535 0.790 17949 1043 1 9 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.102 0.236 17949 1044 1 9 . 1 1 45 45 CYS H H 45 8.666 8.666 7.112 1.554 17949 1045 1 9 . 1 1 46 46 LYS H H 46 7.959 7.959 7.535 0.424 17949 1046 1 9 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.323 -0.419 17949 1047 1 9 . 1 1 47 47 GLN H H 47 8.230 8.230 8.184 0.046 17949 1048 1 9 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.623 -0.515 17949 1049 1 9 . 1 1 48 48 GLN H H 48 7.614 7.614 8.684 -1.070 17949 1050 1 9 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.662 0.293 17949 1051 1 9 . 1 1 49 49 TYR H H 49 8.260 8.260 8.056 0.204 17949 1052 1 9 . 1 1 50 50 GLY H H 50 7.705 7.705 7.985 -0.280 17949 1053 1 9 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.326 -0.443 17949 1054 1 9 . 1 1 51 51 LYS H H 51 8.621 8.621 8.590 0.031 17949 1055 1 9 . 1 1 52 52 SER HA H 52 4.510 4.510 4.518 -0.008 17949 1056 1 9 . 1 1 52 52 SER H H 52 8.436 8.436 8.404 0.032 17949 1057 1 9 . 1 1 53 53 SER HA H 53 4.637 4.637 4.609 0.028 17949 1058 1 9 . 1 1 53 53 SER H H 53 7.884 7.884 7.579 0.305 17949 1059 1 9 . 1 1 54 54 GLY H H 54 7.890 7.890 7.694 0.196 17949 1060 1 9 . 1 1 55 55 GLY H H 55 7.893 7.893 7.756 0.137 17949 1061 1 9 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.857 -0.039 17949 1062 1 9 . 1 1 56 56 TYR H H 56 8.939 8.939 8.290 0.649 17949 1063 1 9 . 1 1 57 57 CYS HA H 57 5.202 5.202 5.010 0.192 17949 1064 1 9 . 1 1 57 57 CYS H H 57 9.281 9.281 8.687 0.594 17949 1065 1 9 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.530 0.400 17949 1066 1 9 . 1 1 58 58 TYR H H 58 9.406 9.406 8.616 0.790 17949 1067 1 9 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.995 -0.561 17949 1068 1 9 . 1 1 59 59 ALA H H 59 8.977 8.977 8.487 0.490 17949 1069 1 9 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.553 -0.444 17949 1070 1 9 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.441 1.019 17949 1071 1 9 . 1 1 61 61 ALA H H 61 8.089 8.089 7.664 0.425 17949 1072 1 9 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.409 0.861 17949 1073 1 9 . 1 1 62 62 CYS H H 62 8.706 8.706 8.455 0.251 17949 1074 1 9 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.109 0.514 17949 1075 1 9 . 1 1 63 63 TRP H H 63 9.739 9.739 8.310 1.429 17949 1076 1 9 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.238 1.370 17949 1077 1 9 . 1 1 64 64 CYS H H 64 8.649 8.649 7.775 0.874 17949 1078 1 9 . 1 1 65 65 THR HA H 65 4.591 4.591 4.495 0.096 17949 1079 1 9 . 1 1 65 65 THR H H 65 7.937 7.937 8.496 -0.559 17949 1080 1 9 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.253 -0.243 17949 1081 1 9 . 1 1 66 66 HIS H H 66 8.755 8.755 8.642 0.113 17949 1082 1 9 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.045 0.131 17949 1083 1 9 . 1 1 67 67 LEU H H 67 8.492 8.492 7.510 0.982 17949 1084 1 9 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.729 -0.181 17949 1085 1 9 . 1 1 68 68 TYR H H 68 7.880 7.880 8.060 -0.180 17949 1086 1 9 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.018 -0.252 17949 1087 1 9 . 1 1 69 69 GLU H H 69 8.787 8.787 8.827 -0.040 17949 1088 1 9 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.157 0.099 17949 1089 1 9 . 1 1 70 70 GLN H H 70 7.925 7.925 8.189 -0.264 17949 1090 1 9 . 1 1 71 71 ALA HA H 71 4.045 4.045 3.926 0.119 17949 1091 1 9 . 1 1 71 71 ALA H H 71 7.490 7.490 7.297 0.193 17949 1092 1 9 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.127 0.021 17949 1093 1 9 . 1 1 72 72 VAL H H 72 8.532 8.532 8.085 0.447 17949 1094 1 9 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.455 0.161 17949 1095 1 9 . 1 1 73 73 VAL H H 73 8.092 8.092 7.963 0.129 17949 1096 1 9 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.029 -0.932 17949 1097 1 9 . 1 1 74 74 TRP H H 74 8.500 8.500 8.434 0.066 17949 1098 1 9 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.221 -2.392 17949 1099 1 9 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.421 -0.222 17949 1100 1 9 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.807 -0.172 17949 1101 1 9 . 1 1 78 78 ASN H H 78 8.235 8.235 8.219 0.016 17949 1102 1 9 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.500 0.092 17949 1103 1 9 . 1 1 79 79 LYS H H 79 7.039 7.039 7.694 -0.655 17949 1104 1 9 . 1 1 80 80 THR HA H 80 4.427 4.427 4.312 0.115 17949 1105 1 9 . 1 1 80 80 THR H H 80 8.483 8.483 8.081 0.402 17949 1106 1 9 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.142 0.493 17949 1107 1 9 . 1 1 81 81 CYS H H 81 8.835 8.835 8.664 0.171 17949 1108 1 10 . 1 1 12 12 SER HA H 12 4.680 4.680 4.649 0.031 17949 1109 1 10 . 1 1 12 12 SER H H 12 8.268 8.268 8.377 -0.109 17949 1110 1 10 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.287 -0.065 17949 1111 1 10 . 1 1 13 13 ILE H H 13 8.220 8.220 8.706 -0.486 17949 1112 1 10 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.467 -0.115 17949 1113 1 10 . 1 1 14 14 GLU H H 14 8.365 8.365 7.770 0.595 17949 1114 1 10 . 1 1 15 15 GLY H H 15 8.300 8.300 8.579 -0.279 17949 1115 1 10 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.384 0.172 17949 1116 1 10 . 1 1 16 16 ARG H H 16 8.200 8.200 8.262 -0.062 17949 1117 1 10 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.463 -0.126 17949 1118 1 10 . 1 1 17 17 LYS H H 17 8.446 8.446 7.732 0.714 17949 1119 1 10 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.021 0.623 17949 1120 1 10 . 1 1 18 18 GLU H H 18 7.534 7.534 8.459 -0.925 17949 1121 1 10 . 1 1 19 19 GLY H H 19 7.245 7.245 7.676 -0.431 17949 1122 1 10 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.857 0.069 17949 1123 1 10 . 1 1 20 20 TYR H H 20 9.101 9.101 8.384 0.717 17949 1124 1 10 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.761 -0.140 17949 1125 1 10 . 1 1 21 21 LEU H H 21 7.703 7.703 8.931 -1.228 17949 1126 1 10 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.999 1.229 17949 1127 1 10 . 1 1 22 22 VAL H H 22 7.049 7.049 7.659 -0.610 17949 1128 1 10 . 1 1 23 23 SER HA H 23 4.870 4.870 4.604 0.266 17949 1129 1 10 . 1 1 23 23 SER H H 23 8.356 8.356 8.614 -0.258 17949 1130 1 10 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.361 -0.278 17949 1131 1 10 . 1 1 24 24 LYS H H 24 9.212 9.212 8.585 0.627 17949 1132 1 10 . 1 1 25 25 SER HA H 25 4.440 4.440 4.175 0.265 17949 1133 1 10 . 1 1 25 25 SER H H 25 8.024 8.024 8.076 -0.052 17949 1134 1 10 . 1 1 26 26 THR HA H 26 4.513 4.513 4.423 0.090 17949 1135 1 10 . 1 1 26 26 THR H H 26 7.595 7.595 7.827 -0.232 17949 1136 1 10 . 1 1 27 27 GLY H H 27 8.388 8.388 8.319 0.069 17949 1137 1 10 . 1 1 28 28 CYS HA H 28 4.951 4.951 5.162 -0.211 17949 1138 1 10 . 1 1 28 28 CYS H H 28 8.131 8.131 8.093 0.038 17949 1139 1 10 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.828 -0.245 17949 1140 1 10 . 1 1 29 29 LYS H H 29 8.302 8.302 8.595 -0.293 17949 1141 1 10 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.224 0.433 17949 1142 1 10 . 1 1 31 31 GLU H H 31 8.299 8.299 7.646 0.653 17949 1143 1 10 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.336 0.495 17949 1144 1 10 . 1 1 32 32 CYS H H 32 8.157 8.157 8.636 -0.479 17949 1145 1 10 . 1 1 33 33 LEU H H 33 8.495 8.495 8.467 0.028 17949 1146 1 10 . 1 1 34 34 LYS H H 34 8.445 8.445 8.102 0.343 17949 1147 1 10 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.231 -0.604 17949 1148 1 10 . 1 1 35 35 LEU H H 35 8.229 8.229 8.664 -0.435 17949 1149 1 10 . 1 1 36 36 GLY H H 36 9.039 9.039 8.190 0.849 17949 1150 1 10 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.217 0.403 17949 1151 1 10 . 1 1 37 37 ASP H H 37 8.511 8.511 8.462 0.049 17949 1152 1 10 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.886 -0.055 17949 1153 1 10 . 1 1 38 38 ASN H H 38 9.114 9.114 8.174 0.940 17949 1154 1 10 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.785 -0.259 17949 1155 1 10 . 1 1 39 39 ASP H H 39 9.019 9.019 8.744 0.275 17949 1156 1 10 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.195 0.141 17949 1157 1 10 . 1 1 40 40 TYR H H 40 8.036 8.036 7.951 0.085 17949 1158 1 10 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.333 -0.120 17949 1159 1 10 . 1 1 41 41 CYS H H 41 8.164 8.164 8.489 -0.325 17949 1160 1 10 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.093 -0.379 17949 1161 1 10 . 1 1 42 42 LEU H H 42 8.236 8.236 8.265 -0.029 17949 1162 1 10 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.283 -0.419 17949 1163 1 10 . 1 1 43 43 ARG H H 43 8.018 8.018 6.963 1.055 17949 1164 1 10 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.029 -0.160 17949 1165 1 10 . 1 1 44 44 GLU H H 44 8.325 8.325 7.769 0.556 17949 1166 1 10 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.072 0.266 17949 1167 1 10 . 1 1 45 45 CYS H H 45 8.666 8.666 7.600 1.066 17949 1168 1 10 . 1 1 46 46 LYS H H 46 7.959 7.959 7.877 0.082 17949 1169 1 10 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.002 -0.098 17949 1170 1 10 . 1 1 47 47 GLN H H 47 8.230 8.230 7.605 0.625 17949 1171 1 10 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.070 0.038 17949 1172 1 10 . 1 1 48 48 GLN H H 48 7.614 7.614 7.674 -0.060 17949 1173 1 10 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.533 0.422 17949 1174 1 10 . 1 1 49 49 TYR H H 49 8.260 8.260 7.743 0.517 17949 1175 1 10 . 1 1 50 50 GLY H H 50 7.705 7.705 7.968 -0.263 17949 1176 1 10 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.321 -0.438 17949 1177 1 10 . 1 1 51 51 LYS H H 51 8.621 8.621 7.806 0.815 17949 1178 1 10 . 1 1 52 52 SER HA H 52 4.510 4.510 4.216 0.294 17949 1179 1 10 . 1 1 52 52 SER H H 52 8.436 8.436 8.349 0.087 17949 1180 1 10 . 1 1 53 53 SER HA H 53 4.637 4.637 4.822 -0.185 17949 1181 1 10 . 1 1 53 53 SER H H 53 7.884 7.884 7.610 0.274 17949 1182 1 10 . 1 1 54 54 GLY H H 54 7.890 7.890 8.192 -0.302 17949 1183 1 10 . 1 1 55 55 GLY H H 55 7.893 7.893 7.924 -0.031 17949 1184 1 10 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.918 -0.100 17949 1185 1 10 . 1 1 56 56 TYR H H 56 8.939 8.939 7.885 1.054 17949 1186 1 10 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.717 0.485 17949 1187 1 10 . 1 1 57 57 CYS H H 57 9.281 9.281 9.178 0.103 17949 1188 1 10 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.308 0.622 17949 1189 1 10 . 1 1 58 58 TYR H H 58 9.406 9.406 8.207 1.199 17949 1190 1 10 . 1 1 59 59 ALA HA H 59 3.434 3.434 4.050 -0.616 17949 1191 1 10 . 1 1 59 59 ALA H H 59 8.977 8.977 8.434 0.543 17949 1192 1 10 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.202 -0.093 17949 1193 1 10 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.468 0.992 17949 1194 1 10 . 1 1 61 61 ALA H H 61 8.089 8.089 7.813 0.276 17949 1195 1 10 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.366 0.904 17949 1196 1 10 . 1 1 62 62 CYS H H 62 8.706 8.706 8.742 -0.036 17949 1197 1 10 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.336 0.287 17949 1198 1 10 . 1 1 63 63 TRP H H 63 9.739 9.739 8.012 1.727 17949 1199 1 10 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.527 1.081 17949 1200 1 10 . 1 1 64 64 CYS H H 64 8.649 8.649 8.173 0.476 17949 1201 1 10 . 1 1 65 65 THR HA H 65 4.591 4.591 4.429 0.162 17949 1202 1 10 . 1 1 65 65 THR H H 65 7.937 7.937 8.259 -0.322 17949 1203 1 10 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.139 -0.129 17949 1204 1 10 . 1 1 66 66 HIS H H 66 8.755 8.755 8.714 0.041 17949 1205 1 10 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.179 -0.003 17949 1206 1 10 . 1 1 67 67 LEU H H 67 8.492 8.492 7.594 0.898 17949 1207 1 10 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.108 0.440 17949 1208 1 10 . 1 1 68 68 TYR H H 68 7.880 7.880 8.164 -0.284 17949 1209 1 10 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.267 -0.501 17949 1210 1 10 . 1 1 69 69 GLU H H 69 8.787 8.787 8.281 0.506 17949 1211 1 10 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.399 -0.143 17949 1212 1 10 . 1 1 70 70 GLN H H 70 7.925 7.925 8.217 -0.292 17949 1213 1 10 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.658 -0.613 17949 1214 1 10 . 1 1 71 71 ALA H H 71 7.490 7.490 7.701 -0.211 17949 1215 1 10 . 1 1 72 72 VAL HA H 72 4.148 4.148 3.942 0.206 17949 1216 1 10 . 1 1 72 72 VAL H H 72 8.532 8.532 8.400 0.132 17949 1217 1 10 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.440 0.176 17949 1218 1 10 . 1 1 73 73 VAL H H 73 8.092 8.092 7.999 0.093 17949 1219 1 10 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.955 -0.858 17949 1220 1 10 . 1 1 74 74 TRP H H 74 8.500 8.500 8.427 0.073 17949 1221 1 10 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.235 -2.406 17949 1222 1 10 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.459 -0.260 17949 1223 1 10 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.395 0.240 17949 1224 1 10 . 1 1 78 78 ASN H H 78 8.235 8.235 8.499 -0.264 17949 1225 1 10 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.532 0.060 17949 1226 1 10 . 1 1 79 79 LYS H H 79 7.039 7.039 7.562 -0.523 17949 1227 1 10 . 1 1 80 80 THR HA H 80 4.427 4.427 4.206 0.221 17949 1228 1 10 . 1 1 80 80 THR H H 80 8.483 8.483 7.798 0.685 17949 1229 1 10 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.283 0.352 17949 1230 1 10 . 1 1 81 81 CYS H H 81 8.835 8.835 8.608 0.227 17949 1231 1 11 . 1 1 12 12 SER HA H 12 4.680 4.680 4.508 0.172 17949 1232 1 11 . 1 1 12 12 SER H H 12 8.268 8.268 8.235 0.033 17949 1233 1 11 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.196 0.026 17949 1234 1 11 . 1 1 13 13 ILE H H 13 8.220 8.220 7.743 0.477 17949 1235 1 11 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.520 -0.168 17949 1236 1 11 . 1 1 14 14 GLU H H 14 8.365 8.365 8.822 -0.457 17949 1237 1 11 . 1 1 15 15 GLY H H 15 8.300 8.300 8.267 0.033 17949 1238 1 11 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.446 0.110 17949 1239 1 11 . 1 1 16 16 ARG H H 16 8.200 8.200 8.339 -0.139 17949 1240 1 11 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.084 0.253 17949 1241 1 11 . 1 1 17 17 LYS H H 17 8.446 8.446 7.829 0.617 17949 1242 1 11 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.187 0.457 17949 1243 1 11 . 1 1 18 18 GLU H H 18 7.534 7.534 8.463 -0.929 17949 1244 1 11 . 1 1 19 19 GLY H H 19 7.245 7.245 7.092 0.153 17949 1245 1 11 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.302 0.624 17949 1246 1 11 . 1 1 20 20 TYR H H 20 9.101 9.101 8.489 0.612 17949 1247 1 11 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.499 0.122 17949 1248 1 11 . 1 1 21 21 LEU H H 21 7.703 7.703 8.746 -1.043 17949 1249 1 11 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.043 1.185 17949 1250 1 11 . 1 1 22 22 VAL H H 22 7.049 7.049 7.668 -0.619 17949 1251 1 11 . 1 1 23 23 SER HA H 23 4.870 4.870 4.559 0.311 17949 1252 1 11 . 1 1 23 23 SER H H 23 8.356 8.356 8.242 0.114 17949 1253 1 11 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.396 -0.313 17949 1254 1 11 . 1 1 24 24 LYS H H 24 9.212 9.212 8.890 0.322 17949 1255 1 11 . 1 1 25 25 SER HA H 25 4.440 4.440 4.404 0.036 17949 1256 1 11 . 1 1 25 25 SER H H 25 8.024 8.024 7.860 0.164 17949 1257 1 11 . 1 1 26 26 THR HA H 26 4.513 4.513 4.466 0.047 17949 1258 1 11 . 1 1 26 26 THR H H 26 7.595 7.595 8.007 -0.412 17949 1259 1 11 . 1 1 27 27 GLY H H 27 8.388 8.388 8.345 0.043 17949 1260 1 11 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.571 0.380 17949 1261 1 11 . 1 1 28 28 CYS H H 28 8.131 8.131 8.132 -0.001 17949 1262 1 11 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.415 0.168 17949 1263 1 11 . 1 1 29 29 LYS H H 29 8.302 8.302 7.947 0.355 17949 1264 1 11 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.380 0.277 17949 1265 1 11 . 1 1 31 31 GLU H H 31 8.299 8.299 7.807 0.492 17949 1266 1 11 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.840 -0.009 17949 1267 1 11 . 1 1 32 32 CYS H H 32 8.157 8.157 8.656 -0.499 17949 1268 1 11 . 1 1 33 33 LEU H H 33 8.495 8.495 8.339 0.156 17949 1269 1 11 . 1 1 34 34 LYS H H 34 8.445 8.445 7.801 0.644 17949 1270 1 11 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.459 -0.832 17949 1271 1 11 . 1 1 35 35 LEU H H 35 8.229 8.229 8.253 -0.024 17949 1272 1 11 . 1 1 36 36 GLY H H 36 9.039 9.039 7.740 1.299 17949 1273 1 11 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.584 0.036 17949 1274 1 11 . 1 1 37 37 ASP H H 37 8.511 8.511 8.428 0.083 17949 1275 1 11 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.934 -0.103 17949 1276 1 11 . 1 1 38 38 ASN H H 38 9.114 9.114 8.383 0.732 17949 1277 1 11 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.667 -0.141 17949 1278 1 11 . 1 1 39 39 ASP H H 39 9.019 9.019 8.554 0.465 17949 1279 1 11 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.079 0.257 17949 1280 1 11 . 1 1 40 40 TYR H H 40 8.036 8.036 8.212 -0.176 17949 1281 1 11 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.301 -0.088 17949 1282 1 11 . 1 1 41 41 CYS H H 41 8.164 8.164 8.796 -0.632 17949 1283 1 11 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.127 -0.413 17949 1284 1 11 . 1 1 42 42 LEU H H 42 8.236 8.236 7.998 0.238 17949 1285 1 11 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.330 -0.466 17949 1286 1 11 . 1 1 43 43 ARG H H 43 8.018 8.018 7.989 0.029 17949 1287 1 11 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.317 -0.448 17949 1288 1 11 . 1 1 44 44 GLU H H 44 8.325 8.325 8.220 0.105 17949 1289 1 11 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.310 0.028 17949 1290 1 11 . 1 1 45 45 CYS H H 45 8.666 8.666 7.494 1.172 17949 1291 1 11 . 1 1 46 46 LYS H H 46 7.959 7.959 7.892 0.067 17949 1292 1 11 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.408 -0.504 17949 1293 1 11 . 1 1 47 47 GLN H H 47 8.230 8.230 7.777 0.453 17949 1294 1 11 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.027 0.081 17949 1295 1 11 . 1 1 48 48 GLN H H 48 7.614 7.614 8.223 -0.609 17949 1296 1 11 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.508 0.447 17949 1297 1 11 . 1 1 49 49 TYR H H 49 8.260 8.260 8.467 -0.207 17949 1298 1 11 . 1 1 50 50 GLY H H 50 7.705 7.705 7.802 -0.097 17949 1299 1 11 . 1 1 51 51 LYS HA H 51 3.883 3.883 3.975 -0.092 17949 1300 1 11 . 1 1 51 51 LYS H H 51 8.621 8.621 8.906 -0.285 17949 1301 1 11 . 1 1 52 52 SER HA H 52 4.510 4.510 4.472 0.038 17949 1302 1 11 . 1 1 52 52 SER H H 52 8.436 8.436 8.194 0.242 17949 1303 1 11 . 1 1 53 53 SER HA H 53 4.637 4.637 4.557 0.080 17949 1304 1 11 . 1 1 53 53 SER H H 53 7.884 7.884 7.425 0.459 17949 1305 1 11 . 1 1 54 54 GLY H H 54 7.890 7.890 7.912 -0.022 17949 1306 1 11 . 1 1 55 55 GLY H H 55 7.893 7.893 7.824 0.069 17949 1307 1 11 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.840 -0.022 17949 1308 1 11 . 1 1 56 56 TYR H H 56 8.939 8.939 7.883 1.056 17949 1309 1 11 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.686 0.516 17949 1310 1 11 . 1 1 57 57 CYS H H 57 9.281 9.281 8.952 0.329 17949 1311 1 11 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.250 0.680 17949 1312 1 11 . 1 1 58 58 TYR H H 58 9.406 9.406 8.043 1.363 17949 1313 1 11 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.949 -0.515 17949 1314 1 11 . 1 1 59 59 ALA H H 59 8.977 8.977 8.337 0.640 17949 1315 1 11 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.299 -0.190 17949 1316 1 11 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.474 0.986 17949 1317 1 11 . 1 1 61 61 ALA H H 61 8.089 8.089 7.670 0.419 17949 1318 1 11 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.272 0.998 17949 1319 1 11 . 1 1 62 62 CYS H H 62 8.706 8.706 8.277 0.429 17949 1320 1 11 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.477 0.146 17949 1321 1 11 . 1 1 63 63 TRP H H 63 9.739 9.739 8.289 1.450 17949 1322 1 11 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.485 1.123 17949 1323 1 11 . 1 1 64 64 CYS H H 64 8.649 8.649 7.778 0.871 17949 1324 1 11 . 1 1 65 65 THR HA H 65 4.591 4.591 4.382 0.209 17949 1325 1 11 . 1 1 65 65 THR H H 65 7.937 7.937 8.137 -0.200 17949 1326 1 11 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.221 -0.211 17949 1327 1 11 . 1 1 66 66 HIS H H 66 8.755 8.755 8.725 0.030 17949 1328 1 11 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.450 -0.274 17949 1329 1 11 . 1 1 67 67 LEU H H 67 8.492 8.492 7.730 0.762 17949 1330 1 11 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.499 0.049 17949 1331 1 11 . 1 1 68 68 TYR H H 68 7.880 7.880 8.673 -0.793 17949 1332 1 11 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.107 -0.341 17949 1333 1 11 . 1 1 69 69 GLU H H 69 8.787 8.787 8.913 -0.126 17949 1334 1 11 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.140 0.116 17949 1335 1 11 . 1 1 70 70 GLN H H 70 7.925 7.925 8.316 -0.391 17949 1336 1 11 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.283 -0.238 17949 1337 1 11 . 1 1 71 71 ALA H H 71 7.490 7.490 7.768 -0.278 17949 1338 1 11 . 1 1 72 72 VAL HA H 72 4.148 4.148 3.881 0.267 17949 1339 1 11 . 1 1 72 72 VAL H H 72 8.532 8.532 7.931 0.601 17949 1340 1 11 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.557 0.059 17949 1341 1 11 . 1 1 73 73 VAL H H 73 8.092 8.092 7.830 0.262 17949 1342 1 11 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.913 -0.816 17949 1343 1 11 . 1 1 74 74 TRP H H 74 8.500 8.500 8.450 0.050 17949 1344 1 11 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.790 -2.961 17949 1345 1 11 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.095 0.104 17949 1346 1 11 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.714 -0.079 17949 1347 1 11 . 1 1 78 78 ASN H H 78 8.235 8.235 7.935 0.300 17949 1348 1 11 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.387 0.205 17949 1349 1 11 . 1 1 79 79 LYS H H 79 7.039 7.039 8.003 -0.964 17949 1350 1 11 . 1 1 80 80 THR HA H 80 4.427 4.427 3.906 0.521 17949 1351 1 11 . 1 1 80 80 THR H H 80 8.483 8.483 7.654 0.829 17949 1352 1 11 . 1 1 81 81 CYS HA H 81 4.635 4.635 3.765 0.870 17949 1353 1 11 . 1 1 81 81 CYS H H 81 8.835 8.835 8.502 0.333 17949 1354 1 12 . 1 1 12 12 SER HA H 12 4.680 4.680 4.773 -0.093 17949 1355 1 12 . 1 1 12 12 SER H H 12 8.268 8.268 8.313 -0.045 17949 1356 1 12 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.406 -0.184 17949 1357 1 12 . 1 1 13 13 ILE H H 13 8.220 8.220 8.082 0.138 17949 1358 1 12 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.572 -0.220 17949 1359 1 12 . 1 1 14 14 GLU H H 14 8.365 8.365 8.445 -0.080 17949 1360 1 12 . 1 1 15 15 GLY H H 15 8.300 8.300 8.219 0.081 17949 1361 1 12 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.385 0.171 17949 1362 1 12 . 1 1 16 16 ARG H H 16 8.200 8.200 8.454 -0.254 17949 1363 1 12 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.379 -0.042 17949 1364 1 12 . 1 1 17 17 LYS H H 17 8.446 8.446 7.511 0.935 17949 1365 1 12 . 1 1 18 18 GLU HA H 18 4.644 4.644 3.795 0.849 17949 1366 1 12 . 1 1 18 18 GLU H H 18 7.534 7.534 8.608 -1.074 17949 1367 1 12 . 1 1 19 19 GLY H H 19 7.245 7.245 7.098 0.147 17949 1368 1 12 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.911 0.015 17949 1369 1 12 . 1 1 20 20 TYR H H 20 9.101 9.101 8.186 0.915 17949 1370 1 12 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.299 0.322 17949 1371 1 12 . 1 1 21 21 LEU H H 21 7.703 7.703 8.740 -1.037 17949 1372 1 12 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.967 1.261 17949 1373 1 12 . 1 1 22 22 VAL H H 22 7.049 7.049 7.663 -0.614 17949 1374 1 12 . 1 1 23 23 SER HA H 23 4.870 4.870 4.948 -0.078 17949 1375 1 12 . 1 1 23 23 SER H H 23 8.356 8.356 8.758 -0.402 17949 1376 1 12 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.367 -0.284 17949 1377 1 12 . 1 1 24 24 LYS H H 24 9.212 9.212 8.710 0.502 17949 1378 1 12 . 1 1 25 25 SER HA H 25 4.440 4.440 4.229 0.211 17949 1379 1 12 . 1 1 25 25 SER H H 25 8.024 8.024 8.456 -0.432 17949 1380 1 12 . 1 1 26 26 THR HA H 26 4.513 4.513 4.372 0.141 17949 1381 1 12 . 1 1 26 26 THR H H 26 7.595 7.595 8.131 -0.536 17949 1382 1 12 . 1 1 27 27 GLY H H 27 8.388 8.388 8.222 0.166 17949 1383 1 12 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.675 0.276 17949 1384 1 12 . 1 1 28 28 CYS H H 28 8.131 8.131 7.963 0.168 17949 1385 1 12 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.532 0.051 17949 1386 1 12 . 1 1 29 29 LYS H H 29 8.302 8.302 8.307 -0.005 17949 1387 1 12 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.134 0.523 17949 1388 1 12 . 1 1 31 31 GLU H H 31 8.299 8.299 8.381 -0.082 17949 1389 1 12 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.517 0.314 17949 1390 1 12 . 1 1 32 32 CYS H H 32 8.157 8.157 8.830 -0.673 17949 1391 1 12 . 1 1 33 33 LEU H H 33 8.495 8.495 8.235 0.260 17949 1392 1 12 . 1 1 34 34 LYS H H 34 8.445 8.445 7.287 1.158 17949 1393 1 12 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.586 -0.959 17949 1394 1 12 . 1 1 35 35 LEU H H 35 8.229 8.229 8.491 -0.262 17949 1395 1 12 . 1 1 36 36 GLY H H 36 9.039 9.039 8.299 0.740 17949 1396 1 12 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.795 -0.175 17949 1397 1 12 . 1 1 37 37 ASP H H 37 8.511 8.511 8.272 0.239 17949 1398 1 12 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.944 -0.113 17949 1399 1 12 . 1 1 38 38 ASN H H 38 9.114 9.114 8.002 1.112 17949 1400 1 12 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.767 -0.241 17949 1401 1 12 . 1 1 39 39 ASP H H 39 9.019 9.019 8.778 0.241 17949 1402 1 12 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.195 0.141 17949 1403 1 12 . 1 1 40 40 TYR H H 40 8.036 8.036 8.095 -0.059 17949 1404 1 12 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.278 -0.065 17949 1405 1 12 . 1 1 41 41 CYS H H 41 8.164 8.164 8.369 -0.205 17949 1406 1 12 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.428 -0.714 17949 1407 1 12 . 1 1 42 42 LEU H H 42 8.236 8.236 7.889 0.347 17949 1408 1 12 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.408 -0.544 17949 1409 1 12 . 1 1 43 43 ARG H H 43 8.018 8.018 7.148 0.870 17949 1410 1 12 . 1 1 44 44 GLU HA H 44 3.869 3.869 3.980 -0.111 17949 1411 1 12 . 1 1 44 44 GLU H H 44 8.325 8.325 7.864 0.461 17949 1412 1 12 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.315 0.023 17949 1413 1 12 . 1 1 45 45 CYS H H 45 8.666 8.666 8.183 0.483 17949 1414 1 12 . 1 1 46 46 LYS H H 46 7.959 7.959 7.695 0.264 17949 1415 1 12 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.317 -0.413 17949 1416 1 12 . 1 1 47 47 GLN H H 47 8.230 8.230 8.245 -0.015 17949 1417 1 12 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.385 -0.277 17949 1418 1 12 . 1 1 48 48 GLN H H 48 7.614 7.614 8.454 -0.840 17949 1419 1 12 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.320 0.635 17949 1420 1 12 . 1 1 49 49 TYR H H 49 8.260 8.260 8.391 -0.131 17949 1421 1 12 . 1 1 50 50 GLY H H 50 7.705 7.705 7.917 -0.212 17949 1422 1 12 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.311 -0.428 17949 1423 1 12 . 1 1 51 51 LYS H H 51 8.621 8.621 7.744 0.877 17949 1424 1 12 . 1 1 52 52 SER HA H 52 4.510 4.510 4.579 -0.069 17949 1425 1 12 . 1 1 52 52 SER H H 52 8.436 8.436 8.539 -0.103 17949 1426 1 12 . 1 1 53 53 SER HA H 53 4.637 4.637 4.468 0.169 17949 1427 1 12 . 1 1 53 53 SER H H 53 7.884 7.884 7.562 0.322 17949 1428 1 12 . 1 1 54 54 GLY H H 54 7.890 7.890 8.641 -0.751 17949 1429 1 12 . 1 1 55 55 GLY H H 55 7.893 7.893 7.720 0.173 17949 1430 1 12 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.807 0.011 17949 1431 1 12 . 1 1 56 56 TYR H H 56 8.939 8.939 7.754 1.185 17949 1432 1 12 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.777 0.425 17949 1433 1 12 . 1 1 57 57 CYS H H 57 9.281 9.281 8.745 0.536 17949 1434 1 12 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.523 0.407 17949 1435 1 12 . 1 1 58 58 TYR H H 58 9.406 9.406 8.719 0.687 17949 1436 1 12 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.757 -0.323 17949 1437 1 12 . 1 1 59 59 ALA H H 59 8.977 8.977 8.464 0.513 17949 1438 1 12 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.675 -0.566 17949 1439 1 12 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.480 0.980 17949 1440 1 12 . 1 1 61 61 ALA H H 61 8.089 8.089 7.746 0.343 17949 1441 1 12 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.444 0.826 17949 1442 1 12 . 1 1 62 62 CYS H H 62 8.706 8.706 8.727 -0.021 17949 1443 1 12 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.486 0.137 17949 1444 1 12 . 1 1 63 63 TRP H H 63 9.739 9.739 8.057 1.682 17949 1445 1 12 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.120 1.488 17949 1446 1 12 . 1 1 64 64 CYS H H 64 8.649 8.649 7.790 0.859 17949 1447 1 12 . 1 1 65 65 THR HA H 65 4.591 4.591 4.057 0.534 17949 1448 1 12 . 1 1 65 65 THR H H 65 7.937 7.937 8.131 -0.194 17949 1449 1 12 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.182 -0.172 17949 1450 1 12 . 1 1 66 66 HIS H H 66 8.755 8.755 8.471 0.284 17949 1451 1 12 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.543 -0.367 17949 1452 1 12 . 1 1 67 67 LEU H H 67 8.492 8.492 7.578 0.914 17949 1453 1 12 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.753 -0.205 17949 1454 1 12 . 1 1 68 68 TYR H H 68 7.880 7.880 8.140 -0.260 17949 1455 1 12 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.137 -0.371 17949 1456 1 12 . 1 1 69 69 GLU H H 69 8.787 8.787 8.905 -0.117 17949 1457 1 12 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.136 0.120 17949 1458 1 12 . 1 1 70 70 GLN H H 70 7.925 7.925 8.341 -0.416 17949 1459 1 12 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.577 -0.532 17949 1460 1 12 . 1 1 71 71 ALA H H 71 7.490 7.490 7.513 -0.023 17949 1461 1 12 . 1 1 72 72 VAL HA H 72 4.148 4.148 3.972 0.176 17949 1462 1 12 . 1 1 72 72 VAL H H 72 8.532 8.532 8.385 0.147 17949 1463 1 12 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.382 0.234 17949 1464 1 12 . 1 1 73 73 VAL H H 73 8.092 8.092 8.111 -0.019 17949 1465 1 12 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.011 -0.914 17949 1466 1 12 . 1 1 74 74 TRP H H 74 8.500 8.500 8.486 0.014 17949 1467 1 12 . 1 1 76 76 LEU HA H 76 1.829 1.829 3.926 -2.097 17949 1468 1 12 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.318 -0.119 17949 1469 1 12 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.277 0.358 17949 1470 1 12 . 1 1 78 78 ASN H H 78 8.235 8.235 8.706 -0.471 17949 1471 1 12 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.369 0.223 17949 1472 1 12 . 1 1 79 79 LYS H H 79 7.039 7.039 7.725 -0.686 17949 1473 1 12 . 1 1 80 80 THR HA H 80 4.427 4.427 4.450 -0.023 17949 1474 1 12 . 1 1 80 80 THR H H 80 8.483 8.483 8.012 0.471 17949 1475 1 12 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.855 -0.220 17949 1476 1 12 . 1 1 81 81 CYS H H 81 8.835 8.835 8.689 0.146 17949 1477 1 13 . 1 1 12 12 SER HA H 12 4.680 4.680 4.493 0.187 17949 1478 1 13 . 1 1 12 12 SER H H 12 8.268 8.268 8.444 -0.176 17949 1479 1 13 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.084 0.138 17949 1480 1 13 . 1 1 13 13 ILE H H 13 8.220 8.220 7.556 0.664 17949 1481 1 13 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.429 -0.077 17949 1482 1 13 . 1 1 14 14 GLU H H 14 8.365 8.365 8.661 -0.295 17949 1483 1 13 . 1 1 15 15 GLY H H 15 8.300 8.300 8.279 0.021 17949 1484 1 13 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.252 0.304 17949 1485 1 13 . 1 1 16 16 ARG H H 16 8.200 8.200 8.404 -0.204 17949 1486 1 13 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.095 0.242 17949 1487 1 13 . 1 1 17 17 LYS H H 17 8.446 8.446 7.696 0.750 17949 1488 1 13 . 1 1 18 18 GLU HA H 18 4.644 4.644 3.991 0.653 17949 1489 1 13 . 1 1 18 18 GLU H H 18 7.534 7.534 8.697 -1.163 17949 1490 1 13 . 1 1 19 19 GLY H H 19 7.245 7.245 7.141 0.104 17949 1491 1 13 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.761 0.165 17949 1492 1 13 . 1 1 20 20 TYR H H 20 9.101 9.101 8.402 0.699 17949 1493 1 13 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.633 -0.012 17949 1494 1 13 . 1 1 21 21 LEU H H 21 7.703 7.703 8.796 -1.093 17949 1495 1 13 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.104 1.124 17949 1496 1 13 . 1 1 22 22 VAL H H 22 7.049 7.049 7.692 -0.643 17949 1497 1 13 . 1 1 23 23 SER HA H 23 4.870 4.870 4.534 0.336 17949 1498 1 13 . 1 1 23 23 SER H H 23 8.356 8.356 8.553 -0.197 17949 1499 1 13 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.346 -0.263 17949 1500 1 13 . 1 1 24 24 LYS H H 24 9.212 9.212 8.691 0.521 17949 1501 1 13 . 1 1 25 25 SER HA H 25 4.440 4.440 4.167 0.273 17949 1502 1 13 . 1 1 25 25 SER H H 25 8.024 8.024 8.036 -0.012 17949 1503 1 13 . 1 1 26 26 THR HA H 26 4.513 4.513 4.426 0.087 17949 1504 1 13 . 1 1 26 26 THR H H 26 7.595 7.595 7.943 -0.348 17949 1505 1 13 . 1 1 27 27 GLY H H 27 8.388 8.388 8.386 0.002 17949 1506 1 13 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.836 0.115 17949 1507 1 13 . 1 1 28 28 CYS H H 28 8.131 8.131 8.599 -0.468 17949 1508 1 13 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.878 -0.295 17949 1509 1 13 . 1 1 29 29 LYS H H 29 8.302 8.302 7.960 0.342 17949 1510 1 13 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.364 0.293 17949 1511 1 13 . 1 1 31 31 GLU H H 31 8.299 8.299 7.831 0.468 17949 1512 1 13 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.946 -0.115 17949 1513 1 13 . 1 1 32 32 CYS H H 32 8.157 8.157 8.796 -0.639 17949 1514 1 13 . 1 1 33 33 LEU H H 33 8.495 8.495 8.467 0.028 17949 1515 1 13 . 1 1 34 34 LYS H H 34 8.445 8.445 7.985 0.460 17949 1516 1 13 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.346 -0.719 17949 1517 1 13 . 1 1 35 35 LEU H H 35 8.229 8.229 8.110 0.119 17949 1518 1 13 . 1 1 36 36 GLY H H 36 9.039 9.039 8.610 0.429 17949 1519 1 13 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.719 -0.099 17949 1520 1 13 . 1 1 37 37 ASP H H 37 8.511 8.511 8.080 0.431 17949 1521 1 13 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.877 -0.046 17949 1522 1 13 . 1 1 38 38 ASN H H 38 9.114 9.114 7.974 1.140 17949 1523 1 13 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.673 -0.147 17949 1524 1 13 . 1 1 39 39 ASP H H 39 9.019 9.019 8.702 0.317 17949 1525 1 13 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.096 0.240 17949 1526 1 13 . 1 1 40 40 TYR H H 40 8.036 8.036 8.014 0.022 17949 1527 1 13 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.075 0.138 17949 1528 1 13 . 1 1 41 41 CYS H H 41 8.164 8.164 8.267 -0.103 17949 1529 1 13 . 1 1 42 42 LEU HA H 42 3.714 3.714 3.994 -0.280 17949 1530 1 13 . 1 1 42 42 LEU H H 42 8.236 8.236 7.744 0.492 17949 1531 1 13 . 1 1 43 43 ARG HA H 43 3.864 3.864 3.916 -0.052 17949 1532 1 13 . 1 1 43 43 ARG H H 43 8.018 8.018 8.537 -0.519 17949 1533 1 13 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.248 -0.379 17949 1534 1 13 . 1 1 44 44 GLU H H 44 8.325 8.325 7.813 0.512 17949 1535 1 13 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.611 -0.273 17949 1536 1 13 . 1 1 45 45 CYS H H 45 8.666 8.666 7.726 0.940 17949 1537 1 13 . 1 1 46 46 LYS H H 46 7.959 7.959 7.715 0.244 17949 1538 1 13 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.118 -0.214 17949 1539 1 13 . 1 1 47 47 GLN H H 47 8.230 8.230 7.861 0.369 17949 1540 1 13 . 1 1 48 48 GLN HA H 48 4.108 4.108 3.890 0.218 17949 1541 1 13 . 1 1 48 48 GLN H H 48 7.614 7.614 8.227 -0.613 17949 1542 1 13 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.411 0.544 17949 1543 1 13 . 1 1 49 49 TYR H H 49 8.260 8.260 7.923 0.337 17949 1544 1 13 . 1 1 50 50 GLY H H 50 7.705 7.705 7.826 -0.121 17949 1545 1 13 . 1 1 51 51 LYS HA H 51 3.883 3.883 3.924 -0.041 17949 1546 1 13 . 1 1 51 51 LYS H H 51 8.621 8.621 8.553 0.068 17949 1547 1 13 . 1 1 52 52 SER HA H 52 4.510 4.510 4.121 0.389 17949 1548 1 13 . 1 1 52 52 SER H H 52 8.436 8.436 8.461 -0.025 17949 1549 1 13 . 1 1 53 53 SER HA H 53 4.637 4.637 4.420 0.217 17949 1550 1 13 . 1 1 53 53 SER H H 53 7.884 7.884 7.624 0.260 17949 1551 1 13 . 1 1 54 54 GLY H H 54 7.890 7.890 8.163 -0.273 17949 1552 1 13 . 1 1 55 55 GLY H H 55 7.893 7.893 7.552 0.341 17949 1553 1 13 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.894 -0.076 17949 1554 1 13 . 1 1 56 56 TYR H H 56 8.939 8.939 8.011 0.928 17949 1555 1 13 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.874 0.328 17949 1556 1 13 . 1 1 57 57 CYS H H 57 9.281 9.281 9.084 0.197 17949 1557 1 13 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.249 0.681 17949 1558 1 13 . 1 1 58 58 TYR H H 58 9.406 9.406 7.992 1.414 17949 1559 1 13 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.916 -0.482 17949 1560 1 13 . 1 1 59 59 ALA H H 59 8.977 8.977 8.299 0.678 17949 1561 1 13 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.249 -0.140 17949 1562 1 13 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.608 0.852 17949 1563 1 13 . 1 1 61 61 ALA H H 61 8.089 8.089 8.005 0.084 17949 1564 1 13 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.478 0.792 17949 1565 1 13 . 1 1 62 62 CYS H H 62 8.706 8.706 8.688 0.018 17949 1566 1 13 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.447 0.176 17949 1567 1 13 . 1 1 63 63 TRP H H 63 9.739 9.739 8.602 1.137 17949 1568 1 13 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.401 1.207 17949 1569 1 13 . 1 1 64 64 CYS H H 64 8.649 8.649 8.215 0.434 17949 1570 1 13 . 1 1 65 65 THR HA H 65 4.591 4.591 4.329 0.262 17949 1571 1 13 . 1 1 65 65 THR H H 65 7.937 7.937 8.568 -0.631 17949 1572 1 13 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.264 -0.254 17949 1573 1 13 . 1 1 66 66 HIS H H 66 8.755 8.755 8.521 0.234 17949 1574 1 13 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.252 -0.076 17949 1575 1 13 . 1 1 67 67 LEU H H 67 8.492 8.492 7.714 0.778 17949 1576 1 13 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.287 0.261 17949 1577 1 13 . 1 1 68 68 TYR H H 68 7.880 7.880 8.129 -0.249 17949 1578 1 13 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.252 -0.486 17949 1579 1 13 . 1 1 69 69 GLU H H 69 8.787 8.787 8.070 0.717 17949 1580 1 13 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.233 0.023 17949 1581 1 13 . 1 1 70 70 GLN H H 70 7.925 7.925 8.047 -0.122 17949 1582 1 13 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.322 -0.277 17949 1583 1 13 . 1 1 71 71 ALA H H 71 7.490 7.490 7.809 -0.319 17949 1584 1 13 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.039 0.109 17949 1585 1 13 . 1 1 72 72 VAL H H 72 8.532 8.532 8.247 0.285 17949 1586 1 13 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.438 0.178 17949 1587 1 13 . 1 1 73 73 VAL H H 73 8.092 8.092 7.985 0.107 17949 1588 1 13 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.990 -0.893 17949 1589 1 13 . 1 1 74 74 TRP H H 74 8.500 8.500 8.317 0.183 17949 1590 1 13 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.203 -2.374 17949 1591 1 13 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.460 -0.261 17949 1592 1 13 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.891 -0.256 17949 1593 1 13 . 1 1 78 78 ASN H H 78 8.235 8.235 7.997 0.238 17949 1594 1 13 . 1 1 79 79 LYS HA H 79 4.592 4.592 3.945 0.647 17949 1595 1 13 . 1 1 79 79 LYS H H 79 7.039 7.039 7.486 -0.447 17949 1596 1 13 . 1 1 80 80 THR HA H 80 4.427 4.427 4.374 0.053 17949 1597 1 13 . 1 1 80 80 THR H H 80 8.483 8.483 7.463 1.020 17949 1598 1 13 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.694 -0.059 17949 1599 1 13 . 1 1 81 81 CYS H H 81 8.835 8.835 8.701 0.134 17949 1600 1 14 . 1 1 12 12 SER HA H 12 4.680 4.680 4.715 -0.035 17949 1601 1 14 . 1 1 12 12 SER H H 12 8.268 8.268 7.914 0.354 17949 1602 1 14 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.306 -0.084 17949 1603 1 14 . 1 1 13 13 ILE H H 13 8.220 8.220 8.329 -0.109 17949 1604 1 14 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.224 0.128 17949 1605 1 14 . 1 1 14 14 GLU H H 14 8.365 8.365 8.395 -0.030 17949 1606 1 14 . 1 1 15 15 GLY H H 15 8.300 8.300 8.208 0.092 17949 1607 1 14 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.208 0.348 17949 1608 1 14 . 1 1 16 16 ARG H H 16 8.200 8.200 8.485 -0.285 17949 1609 1 14 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.547 -0.210 17949 1610 1 14 . 1 1 17 17 LYS H H 17 8.446 8.446 7.680 0.766 17949 1611 1 14 . 1 1 18 18 GLU HA H 18 4.644 4.644 3.931 0.713 17949 1612 1 14 . 1 1 18 18 GLU H H 18 7.534 7.534 8.502 -0.968 17949 1613 1 14 . 1 1 19 19 GLY H H 19 7.245 7.245 7.225 0.020 17949 1614 1 14 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.330 0.596 17949 1615 1 14 . 1 1 20 20 TYR H H 20 9.101 9.101 8.369 0.732 17949 1616 1 14 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.430 0.191 17949 1617 1 14 . 1 1 21 21 LEU H H 21 7.703 7.703 8.791 -1.088 17949 1618 1 14 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.305 0.923 17949 1619 1 14 . 1 1 22 22 VAL H H 22 7.049 7.049 7.608 -0.559 17949 1620 1 14 . 1 1 23 23 SER HA H 23 4.870 4.870 4.755 0.115 17949 1621 1 14 . 1 1 23 23 SER H H 23 8.356 8.356 8.130 0.226 17949 1622 1 14 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.496 -0.413 17949 1623 1 14 . 1 1 24 24 LYS H H 24 9.212 9.212 8.800 0.412 17949 1624 1 14 . 1 1 25 25 SER HA H 25 4.440 4.440 4.715 -0.275 17949 1625 1 14 . 1 1 25 25 SER H H 25 8.024 8.024 8.063 -0.039 17949 1626 1 14 . 1 1 26 26 THR HA H 26 4.513 4.513 4.633 -0.120 17949 1627 1 14 . 1 1 26 26 THR H H 26 7.595 7.595 7.778 -0.183 17949 1628 1 14 . 1 1 27 27 GLY H H 27 8.388 8.388 8.313 0.075 17949 1629 1 14 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.295 0.656 17949 1630 1 14 . 1 1 28 28 CYS H H 28 8.131 8.131 8.044 0.087 17949 1631 1 14 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.475 0.108 17949 1632 1 14 . 1 1 29 29 LYS H H 29 8.302 8.302 7.853 0.449 17949 1633 1 14 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.295 0.362 17949 1634 1 14 . 1 1 31 31 GLU H H 31 8.299 8.299 7.705 0.594 17949 1635 1 14 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.924 -0.093 17949 1636 1 14 . 1 1 32 32 CYS H H 32 8.157 8.157 8.588 -0.431 17949 1637 1 14 . 1 1 33 33 LEU H H 33 8.495 8.495 8.494 0.001 17949 1638 1 14 . 1 1 34 34 LYS H H 34 8.445 8.445 8.138 0.307 17949 1639 1 14 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.350 -0.723 17949 1640 1 14 . 1 1 35 35 LEU H H 35 8.229 8.229 8.590 -0.361 17949 1641 1 14 . 1 1 36 36 GLY H H 36 9.039 9.039 7.823 1.216 17949 1642 1 14 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.397 0.223 17949 1643 1 14 . 1 1 37 37 ASP H H 37 8.511 8.511 8.656 -0.145 17949 1644 1 14 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.645 0.186 17949 1645 1 14 . 1 1 38 38 ASN H H 38 9.114 9.114 8.454 0.660 17949 1646 1 14 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.566 -0.040 17949 1647 1 14 . 1 1 39 39 ASP H H 39 9.019 9.019 8.423 0.596 17949 1648 1 14 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.089 0.247 17949 1649 1 14 . 1 1 40 40 TYR H H 40 8.036 8.036 7.948 0.088 17949 1650 1 14 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.380 -0.167 17949 1651 1 14 . 1 1 41 41 CYS H H 41 8.164 8.164 8.589 -0.425 17949 1652 1 14 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.313 -0.599 17949 1653 1 14 . 1 1 42 42 LEU H H 42 8.236 8.236 7.788 0.448 17949 1654 1 14 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.314 -0.450 17949 1655 1 14 . 1 1 43 43 ARG H H 43 8.018 8.018 7.648 0.370 17949 1656 1 14 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.343 -0.474 17949 1657 1 14 . 1 1 44 44 GLU H H 44 8.325 8.325 7.956 0.369 17949 1658 1 14 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.329 0.009 17949 1659 1 14 . 1 1 45 45 CYS H H 45 8.666 8.666 7.237 1.429 17949 1660 1 14 . 1 1 46 46 LYS H H 46 7.959 7.959 7.874 0.085 17949 1661 1 14 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.392 -0.488 17949 1662 1 14 . 1 1 47 47 GLN H H 47 8.230 8.230 8.415 -0.185 17949 1663 1 14 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.541 -0.433 17949 1664 1 14 . 1 1 48 48 GLN H H 48 7.614 7.614 8.581 -0.967 17949 1665 1 14 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.654 0.301 17949 1666 1 14 . 1 1 49 49 TYR H H 49 8.260 8.260 8.439 -0.179 17949 1667 1 14 . 1 1 50 50 GLY H H 50 7.705 7.705 7.610 0.095 17949 1668 1 14 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.351 -0.468 17949 1669 1 14 . 1 1 51 51 LYS H H 51 8.621 8.621 8.707 -0.086 17949 1670 1 14 . 1 1 52 52 SER HA H 52 4.510 4.510 4.295 0.215 17949 1671 1 14 . 1 1 52 52 SER H H 52 8.436 8.436 8.343 0.093 17949 1672 1 14 . 1 1 53 53 SER HA H 53 4.637 4.637 3.995 0.642 17949 1673 1 14 . 1 1 53 53 SER H H 53 7.884 7.884 7.682 0.202 17949 1674 1 14 . 1 1 54 54 GLY H H 54 7.890 7.890 7.688 0.202 17949 1675 1 14 . 1 1 55 55 GLY H H 55 7.893 7.893 7.908 -0.015 17949 1676 1 14 . 1 1 56 56 TYR HA H 56 4.818 4.818 5.139 -0.321 17949 1677 1 14 . 1 1 56 56 TYR H H 56 8.939 8.939 8.822 0.117 17949 1678 1 14 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.711 0.491 17949 1679 1 14 . 1 1 57 57 CYS H H 57 9.281 9.281 9.233 0.048 17949 1680 1 14 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.233 0.697 17949 1681 1 14 . 1 1 58 58 TYR H H 58 9.406 9.406 8.136 1.270 17949 1682 1 14 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.934 -0.500 17949 1683 1 14 . 1 1 59 59 ALA H H 59 8.977 8.977 8.347 0.630 17949 1684 1 14 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.297 -0.188 17949 1685 1 14 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.562 0.898 17949 1686 1 14 . 1 1 61 61 ALA H H 61 8.089 8.089 7.922 0.167 17949 1687 1 14 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.280 0.990 17949 1688 1 14 . 1 1 62 62 CYS H H 62 8.706 8.706 8.512 0.194 17949 1689 1 14 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.340 0.283 17949 1690 1 14 . 1 1 63 63 TRP H H 63 9.739 9.739 8.679 1.060 17949 1691 1 14 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.355 1.253 17949 1692 1 14 . 1 1 64 64 CYS H H 64 8.649 8.649 7.908 0.741 17949 1693 1 14 . 1 1 65 65 THR HA H 65 4.591 4.591 4.500 0.091 17949 1694 1 14 . 1 1 65 65 THR H H 65 7.937 7.937 8.716 -0.779 17949 1695 1 14 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.165 -0.155 17949 1696 1 14 . 1 1 66 66 HIS H H 66 8.755 8.755 8.481 0.274 17949 1697 1 14 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.114 0.062 17949 1698 1 14 . 1 1 67 67 LEU H H 67 8.492 8.492 7.582 0.910 17949 1699 1 14 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.674 -0.126 17949 1700 1 14 . 1 1 68 68 TYR H H 68 7.880 7.880 7.964 -0.084 17949 1701 1 14 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.063 -0.297 17949 1702 1 14 . 1 1 69 69 GLU H H 69 8.787 8.787 8.838 -0.051 17949 1703 1 14 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.077 0.179 17949 1704 1 14 . 1 1 70 70 GLN H H 70 7.925 7.925 8.245 -0.320 17949 1705 1 14 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.290 -0.245 17949 1706 1 14 . 1 1 71 71 ALA H H 71 7.490 7.490 7.255 0.235 17949 1707 1 14 . 1 1 72 72 VAL HA H 72 4.148 4.148 3.911 0.237 17949 1708 1 14 . 1 1 72 72 VAL H H 72 8.532 8.532 7.887 0.645 17949 1709 1 14 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.411 0.205 17949 1710 1 14 . 1 1 73 73 VAL H H 73 8.092 8.092 8.049 0.043 17949 1711 1 14 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.017 -0.920 17949 1712 1 14 . 1 1 74 74 TRP H H 74 8.500 8.500 8.358 0.142 17949 1713 1 14 . 1 1 76 76 LEU HA H 76 1.829 1.829 3.839 -2.010 17949 1714 1 14 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.263 -0.064 17949 1715 1 14 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.702 -0.067 17949 1716 1 14 . 1 1 78 78 ASN H H 78 8.235 8.235 7.918 0.317 17949 1717 1 14 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.135 0.457 17949 1718 1 14 . 1 1 79 79 LYS H H 79 7.039 7.039 7.972 -0.933 17949 1719 1 14 . 1 1 80 80 THR HA H 80 4.427 4.427 4.669 -0.242 17949 1720 1 14 . 1 1 80 80 THR H H 80 8.483 8.483 8.262 0.221 17949 1721 1 14 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.835 -0.200 17949 1722 1 14 . 1 1 81 81 CYS H H 81 8.835 8.835 8.874 -0.039 17949 1723 1 15 . 1 1 12 12 SER HA H 12 4.680 4.680 4.541 0.139 17949 1724 1 15 . 1 1 12 12 SER H H 12 8.268 8.268 8.085 0.183 17949 1725 1 15 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.297 -0.075 17949 1726 1 15 . 1 1 13 13 ILE H H 13 8.220 8.220 7.959 0.261 17949 1727 1 15 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.635 -0.283 17949 1728 1 15 . 1 1 14 14 GLU H H 14 8.365 8.365 8.496 -0.131 17949 1729 1 15 . 1 1 15 15 GLY H H 15 8.300 8.300 8.259 0.041 17949 1730 1 15 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.439 0.117 17949 1731 1 15 . 1 1 16 16 ARG H H 16 8.200 8.200 8.374 -0.174 17949 1732 1 15 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.270 0.067 17949 1733 1 15 . 1 1 17 17 LYS H H 17 8.446 8.446 7.613 0.833 17949 1734 1 15 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.111 0.533 17949 1735 1 15 . 1 1 18 18 GLU H H 18 7.534 7.534 8.602 -1.068 17949 1736 1 15 . 1 1 19 19 GLY H H 19 7.245 7.245 7.236 0.009 17949 1737 1 15 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.557 0.369 17949 1738 1 15 . 1 1 20 20 TYR H H 20 9.101 9.101 8.467 0.634 17949 1739 1 15 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.692 -0.071 17949 1740 1 15 . 1 1 21 21 LEU H H 21 7.703 7.703 8.649 -0.946 17949 1741 1 15 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.717 1.511 17949 1742 1 15 . 1 1 22 22 VAL H H 22 7.049 7.049 7.666 -0.617 17949 1743 1 15 . 1 1 23 23 SER HA H 23 4.870 4.870 4.711 0.159 17949 1744 1 15 . 1 1 23 23 SER H H 23 8.356 8.356 7.922 0.434 17949 1745 1 15 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.298 -0.215 17949 1746 1 15 . 1 1 24 24 LYS H H 24 9.212 9.212 8.755 0.457 17949 1747 1 15 . 1 1 25 25 SER HA H 25 4.440 4.440 4.326 0.114 17949 1748 1 15 . 1 1 25 25 SER H H 25 8.024 8.024 8.588 -0.564 17949 1749 1 15 . 1 1 26 26 THR HA H 26 4.513 4.513 4.493 0.020 17949 1750 1 15 . 1 1 26 26 THR H H 26 7.595 7.595 7.494 0.101 17949 1751 1 15 . 1 1 27 27 GLY H H 27 8.388 8.388 8.367 0.021 17949 1752 1 15 . 1 1 28 28 CYS HA H 28 4.951 4.951 5.036 -0.085 17949 1753 1 15 . 1 1 28 28 CYS H H 28 8.131 8.131 7.422 0.709 17949 1754 1 15 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.252 0.331 17949 1755 1 15 . 1 1 29 29 LYS H H 29 8.302 8.302 7.654 0.648 17949 1756 1 15 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.683 -0.026 17949 1757 1 15 . 1 1 31 31 GLU H H 31 8.299 8.299 8.151 0.148 17949 1758 1 15 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.402 0.429 17949 1759 1 15 . 1 1 32 32 CYS H H 32 8.157 8.157 8.881 -0.724 17949 1760 1 15 . 1 1 33 33 LEU H H 33 8.495 8.495 8.571 -0.076 17949 1761 1 15 . 1 1 34 34 LYS H H 34 8.445 8.445 8.233 0.212 17949 1762 1 15 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.375 -0.748 17949 1763 1 15 . 1 1 35 35 LEU H H 35 8.229 8.229 8.518 -0.289 17949 1764 1 15 . 1 1 36 36 GLY H H 36 9.039 9.039 8.750 0.289 17949 1765 1 15 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.615 0.005 17949 1766 1 15 . 1 1 37 37 ASP H H 37 8.511 8.511 8.310 0.201 17949 1767 1 15 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.557 0.274 17949 1768 1 15 . 1 1 38 38 ASN H H 38 9.114 9.114 8.583 0.531 17949 1769 1 15 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.456 0.070 17949 1770 1 15 . 1 1 39 39 ASP H H 39 9.019 9.019 9.009 0.010 17949 1771 1 15 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.175 0.161 17949 1772 1 15 . 1 1 40 40 TYR H H 40 8.036 8.036 8.147 -0.111 17949 1773 1 15 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.156 0.057 17949 1774 1 15 . 1 1 41 41 CYS H H 41 8.164 8.164 7.735 0.429 17949 1775 1 15 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.185 -0.471 17949 1776 1 15 . 1 1 42 42 LEU H H 42 8.236 8.236 7.923 0.313 17949 1777 1 15 . 1 1 43 43 ARG HA H 43 3.864 3.864 3.961 -0.097 17949 1778 1 15 . 1 1 43 43 ARG H H 43 8.018 8.018 8.502 -0.484 17949 1779 1 15 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.132 -0.263 17949 1780 1 15 . 1 1 44 44 GLU H H 44 8.325 8.325 7.735 0.590 17949 1781 1 15 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.568 -0.230 17949 1782 1 15 . 1 1 45 45 CYS H H 45 8.666 8.666 7.144 1.522 17949 1783 1 15 . 1 1 46 46 LYS H H 46 7.959 7.959 7.419 0.540 17949 1784 1 15 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.345 -0.441 17949 1785 1 15 . 1 1 47 47 GLN H H 47 8.230 8.230 7.868 0.362 17949 1786 1 15 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.117 -0.009 17949 1787 1 15 . 1 1 48 48 GLN H H 48 7.614 7.614 8.045 -0.431 17949 1788 1 15 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.647 0.308 17949 1789 1 15 . 1 1 49 49 TYR H H 49 8.260 8.260 7.898 0.362 17949 1790 1 15 . 1 1 50 50 GLY H H 50 7.705 7.705 7.446 0.259 17949 1791 1 15 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.274 -0.391 17949 1792 1 15 . 1 1 51 51 LYS H H 51 8.621 8.621 8.442 0.179 17949 1793 1 15 . 1 1 52 52 SER HA H 52 4.510 4.510 4.261 0.249 17949 1794 1 15 . 1 1 52 52 SER H H 52 8.436 8.436 7.973 0.463 17949 1795 1 15 . 1 1 53 53 SER HA H 53 4.637 4.637 4.289 0.348 17949 1796 1 15 . 1 1 53 53 SER H H 53 7.884 7.884 7.501 0.383 17949 1797 1 15 . 1 1 54 54 GLY H H 54 7.890 7.890 7.926 -0.036 17949 1798 1 15 . 1 1 55 55 GLY H H 55 7.893 7.893 7.687 0.206 17949 1799 1 15 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.921 -0.103 17949 1800 1 15 . 1 1 56 56 TYR H H 56 8.939 8.939 7.963 0.976 17949 1801 1 15 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.631 0.571 17949 1802 1 15 . 1 1 57 57 CYS H H 57 9.281 9.281 9.322 -0.041 17949 1803 1 15 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.333 0.597 17949 1804 1 15 . 1 1 58 58 TYR H H 58 9.406 9.406 8.130 1.276 17949 1805 1 15 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.960 -0.526 17949 1806 1 15 . 1 1 59 59 ALA H H 59 8.977 8.977 8.352 0.625 17949 1807 1 15 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.368 -0.259 17949 1808 1 15 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.483 0.977 17949 1809 1 15 . 1 1 61 61 ALA H H 61 8.089 8.089 7.593 0.496 17949 1810 1 15 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.313 0.957 17949 1811 1 15 . 1 1 62 62 CYS H H 62 8.706 8.706 8.784 -0.078 17949 1812 1 15 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.408 0.215 17949 1813 1 15 . 1 1 63 63 TRP H H 63 9.739 9.739 7.980 1.759 17949 1814 1 15 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.739 0.869 17949 1815 1 15 . 1 1 64 64 CYS H H 64 8.649 8.649 7.105 1.544 17949 1816 1 15 . 1 1 65 65 THR HA H 65 4.591 4.591 4.576 0.015 17949 1817 1 15 . 1 1 65 65 THR H H 65 7.937 7.937 8.207 -0.270 17949 1818 1 15 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.201 -0.191 17949 1819 1 15 . 1 1 66 66 HIS H H 66 8.755 8.755 8.779 -0.024 17949 1820 1 15 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.317 -0.141 17949 1821 1 15 . 1 1 67 67 LEU H H 67 8.492 8.492 7.696 0.796 17949 1822 1 15 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.432 0.116 17949 1823 1 15 . 1 1 68 68 TYR H H 68 7.880 7.880 8.213 -0.333 17949 1824 1 15 . 1 1 69 69 GLU HA H 69 3.766 3.766 3.815 -0.049 17949 1825 1 15 . 1 1 69 69 GLU H H 69 8.787 8.787 8.784 0.003 17949 1826 1 15 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.118 0.138 17949 1827 1 15 . 1 1 70 70 GLN H H 70 7.925 7.925 8.259 -0.334 17949 1828 1 15 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.082 -0.036 17949 1829 1 15 . 1 1 71 71 ALA H H 71 7.490 7.490 7.370 0.120 17949 1830 1 15 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.007 0.141 17949 1831 1 15 . 1 1 72 72 VAL H H 72 8.532 8.532 8.052 0.480 17949 1832 1 15 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.420 0.196 17949 1833 1 15 . 1 1 73 73 VAL H H 73 8.092 8.092 8.058 0.034 17949 1834 1 15 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.143 -1.046 17949 1835 1 15 . 1 1 74 74 TRP H H 74 8.500 8.500 8.490 0.010 17949 1836 1 15 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.521 -2.692 17949 1837 1 15 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.388 -0.189 17949 1838 1 15 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.298 0.337 17949 1839 1 15 . 1 1 78 78 ASN H H 78 8.235 8.235 8.679 -0.444 17949 1840 1 15 . 1 1 79 79 LYS HA H 79 4.592 4.592 3.473 1.119 17949 1841 1 15 . 1 1 79 79 LYS H H 79 7.039 7.039 7.784 -0.745 17949 1842 1 15 . 1 1 80 80 THR HA H 80 4.427 4.427 5.009 -0.582 17949 1843 1 15 . 1 1 80 80 THR H H 80 8.483 8.483 7.269 1.214 17949 1844 1 15 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.659 -0.024 17949 1845 1 15 . 1 1 81 81 CYS H H 81 8.835 8.835 9.424 -0.589 17949 1846 1 16 . 1 1 12 12 SER HA H 12 4.680 4.680 4.290 0.390 17949 1847 1 16 . 1 1 12 12 SER H H 12 8.268 8.268 8.132 0.136 17949 1848 1 16 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.246 -0.024 17949 1849 1 16 . 1 1 13 13 ILE H H 13 8.220 8.220 7.519 0.701 17949 1850 1 16 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.286 0.066 17949 1851 1 16 . 1 1 14 14 GLU H H 14 8.365 8.365 8.562 -0.197 17949 1852 1 16 . 1 1 15 15 GLY H H 15 8.300 8.300 8.428 -0.128 17949 1853 1 16 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.760 -0.204 17949 1854 1 16 . 1 1 16 16 ARG H H 16 8.200 8.200 7.942 0.258 17949 1855 1 16 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.487 -0.150 17949 1856 1 16 . 1 1 17 17 LYS H H 17 8.446 8.446 7.747 0.699 17949 1857 1 16 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.091 0.553 17949 1858 1 16 . 1 1 18 18 GLU H H 18 7.534 7.534 8.498 -0.964 17949 1859 1 16 . 1 1 19 19 GLY H H 19 7.245 7.245 7.244 0.001 17949 1860 1 16 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.744 0.182 17949 1861 1 16 . 1 1 20 20 TYR H H 20 9.101 9.101 8.221 0.880 17949 1862 1 16 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.686 -0.065 17949 1863 1 16 . 1 1 21 21 LEU H H 21 7.703 7.703 8.773 -1.070 17949 1864 1 16 . 1 1 22 22 VAL HA H 22 5.228 5.228 4.123 1.105 17949 1865 1 16 . 1 1 22 22 VAL H H 22 7.049 7.049 7.683 -0.634 17949 1866 1 16 . 1 1 23 23 SER HA H 23 4.870 4.870 4.781 0.089 17949 1867 1 16 . 1 1 23 23 SER H H 23 8.356 8.356 8.091 0.265 17949 1868 1 16 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.324 -0.241 17949 1869 1 16 . 1 1 24 24 LYS H H 24 9.212 9.212 8.760 0.452 17949 1870 1 16 . 1 1 25 25 SER HA H 25 4.440 4.440 4.269 0.171 17949 1871 1 16 . 1 1 25 25 SER H H 25 8.024 8.024 8.326 -0.302 17949 1872 1 16 . 1 1 26 26 THR HA H 26 4.513 4.513 4.414 0.099 17949 1873 1 16 . 1 1 26 26 THR H H 26 7.595 7.595 7.766 -0.171 17949 1874 1 16 . 1 1 27 27 GLY H H 27 8.388 8.388 8.490 -0.102 17949 1875 1 16 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.191 0.760 17949 1876 1 16 . 1 1 28 28 CYS H H 28 8.131 8.131 7.889 0.242 17949 1877 1 16 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.524 0.059 17949 1878 1 16 . 1 1 29 29 LYS H H 29 8.302 8.302 7.706 0.596 17949 1879 1 16 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.369 0.288 17949 1880 1 16 . 1 1 31 31 GLU H H 31 8.299 8.299 7.696 0.603 17949 1881 1 16 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.871 -0.040 17949 1882 1 16 . 1 1 32 32 CYS H H 32 8.157 8.157 8.851 -0.694 17949 1883 1 16 . 1 1 33 33 LEU H H 33 8.495 8.495 8.310 0.185 17949 1884 1 16 . 1 1 34 34 LYS H H 34 8.445 8.445 7.896 0.549 17949 1885 1 16 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.035 -0.408 17949 1886 1 16 . 1 1 35 35 LEU H H 35 8.229 8.229 8.909 -0.680 17949 1887 1 16 . 1 1 36 36 GLY H H 36 9.039 9.039 8.569 0.470 17949 1888 1 16 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.824 -0.204 17949 1889 1 16 . 1 1 37 37 ASP H H 37 8.511 8.511 8.074 0.437 17949 1890 1 16 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.750 0.081 17949 1891 1 16 . 1 1 38 38 ASN H H 38 9.114 9.114 7.782 1.332 17949 1892 1 16 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.615 -0.089 17949 1893 1 16 . 1 1 39 39 ASP H H 39 9.019 9.019 8.754 0.265 17949 1894 1 16 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.126 0.210 17949 1895 1 16 . 1 1 40 40 TYR H H 40 8.036 8.036 7.871 0.165 17949 1896 1 16 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.290 -0.077 17949 1897 1 16 . 1 1 41 41 CYS H H 41 8.164 8.164 8.276 -0.112 17949 1898 1 16 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.203 -0.489 17949 1899 1 16 . 1 1 42 42 LEU H H 42 8.236 8.236 7.748 0.488 17949 1900 1 16 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.385 -0.521 17949 1901 1 16 . 1 1 43 43 ARG H H 43 8.018 8.018 7.215 0.803 17949 1902 1 16 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.250 -0.381 17949 1903 1 16 . 1 1 44 44 GLU H H 44 8.325 8.325 7.709 0.616 17949 1904 1 16 . 1 1 45 45 CYS HA H 45 4.338 4.338 3.969 0.369 17949 1905 1 16 . 1 1 45 45 CYS H H 45 8.666 8.666 7.501 1.165 17949 1906 1 16 . 1 1 46 46 LYS H H 46 7.959 7.959 7.535 0.424 17949 1907 1 16 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.068 -0.164 17949 1908 1 16 . 1 1 47 47 GLN H H 47 8.230 8.230 8.283 -0.053 17949 1909 1 16 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.580 -0.472 17949 1910 1 16 . 1 1 48 48 GLN H H 48 7.614 7.614 8.691 -1.077 17949 1911 1 16 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.519 0.436 17949 1912 1 16 . 1 1 49 49 TYR H H 49 8.260 8.260 7.783 0.477 17949 1913 1 16 . 1 1 50 50 GLY H H 50 7.705 7.705 7.410 0.295 17949 1914 1 16 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.095 -0.212 17949 1915 1 16 . 1 1 51 51 LYS H H 51 8.621 8.621 8.553 0.068 17949 1916 1 16 . 1 1 52 52 SER HA H 52 4.510 4.510 4.276 0.234 17949 1917 1 16 . 1 1 52 52 SER H H 52 8.436 8.436 8.017 0.419 17949 1918 1 16 . 1 1 53 53 SER HA H 53 4.637 4.637 4.229 0.408 17949 1919 1 16 . 1 1 53 53 SER H H 53 7.884 7.884 7.495 0.389 17949 1920 1 16 . 1 1 54 54 GLY H H 54 7.890 7.890 7.804 0.086 17949 1921 1 16 . 1 1 55 55 GLY H H 55 7.893 7.893 7.639 0.254 17949 1922 1 16 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.938 -0.120 17949 1923 1 16 . 1 1 56 56 TYR H H 56 8.939 8.939 8.009 0.930 17949 1924 1 16 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.594 0.608 17949 1925 1 16 . 1 1 57 57 CYS H H 57 9.281 9.281 9.009 0.272 17949 1926 1 16 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.303 0.627 17949 1927 1 16 . 1 1 58 58 TYR H H 58 9.406 9.406 8.197 1.209 17949 1928 1 16 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.928 -0.494 17949 1929 1 16 . 1 1 59 59 ALA H H 59 8.977 8.977 8.279 0.698 17949 1930 1 16 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.334 -0.225 17949 1931 1 16 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.597 0.863 17949 1932 1 16 . 1 1 61 61 ALA H H 61 8.089 8.089 7.898 0.191 17949 1933 1 16 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.335 0.935 17949 1934 1 16 . 1 1 62 62 CYS H H 62 8.706 8.706 8.633 0.073 17949 1935 1 16 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.455 0.168 17949 1936 1 16 . 1 1 63 63 TRP H H 63 9.739 9.739 8.712 1.027 17949 1937 1 16 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.192 1.416 17949 1938 1 16 . 1 1 64 64 CYS H H 64 8.649 8.649 8.530 0.119 17949 1939 1 16 . 1 1 65 65 THR HA H 65 4.591 4.591 4.440 0.151 17949 1940 1 16 . 1 1 65 65 THR H H 65 7.937 7.937 8.175 -0.238 17949 1941 1 16 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.129 -0.119 17949 1942 1 16 . 1 1 66 66 HIS H H 66 8.755 8.755 8.760 -0.005 17949 1943 1 16 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.251 -0.075 17949 1944 1 16 . 1 1 67 67 LEU H H 67 8.492 8.492 7.724 0.768 17949 1945 1 16 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.865 -0.317 17949 1946 1 16 . 1 1 68 68 TYR H H 68 7.880 7.880 7.915 -0.035 17949 1947 1 16 . 1 1 69 69 GLU HA H 69 3.766 3.766 3.949 -0.183 17949 1948 1 16 . 1 1 69 69 GLU H H 69 8.787 8.787 9.022 -0.235 17949 1949 1 16 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.122 0.134 17949 1950 1 16 . 1 1 70 70 GLN H H 70 7.925 7.925 8.253 -0.328 17949 1951 1 16 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.052 -0.007 17949 1952 1 16 . 1 1 71 71 ALA H H 71 7.490 7.490 7.221 0.269 17949 1953 1 16 . 1 1 72 72 VAL HA H 72 4.148 4.148 3.937 0.211 17949 1954 1 16 . 1 1 72 72 VAL H H 72 8.532 8.532 8.224 0.308 17949 1955 1 16 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.555 0.061 17949 1956 1 16 . 1 1 73 73 VAL H H 73 8.092 8.092 8.087 0.005 17949 1957 1 16 . 1 1 74 74 TRP HA H 74 4.097 4.097 5.105 -1.008 17949 1958 1 16 . 1 1 74 74 TRP H H 74 8.500 8.500 8.709 -0.209 17949 1959 1 16 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.397 -2.568 17949 1960 1 16 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.205 -0.006 17949 1961 1 16 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.794 -0.159 17949 1962 1 16 . 1 1 78 78 ASN H H 78 8.235 8.235 8.037 0.198 17949 1963 1 16 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.183 0.409 17949 1964 1 16 . 1 1 79 79 LYS H H 79 7.039 7.039 8.209 -1.170 17949 1965 1 16 . 1 1 80 80 THR HA H 80 4.427 4.427 4.439 -0.012 17949 1966 1 16 . 1 1 80 80 THR H H 80 8.483 8.483 8.462 0.021 17949 1967 1 16 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.854 -0.219 17949 1968 1 16 . 1 1 81 81 CYS H H 81 8.835 8.835 8.614 0.221 17949 1969 1 17 . 1 1 12 12 SER HA H 12 4.680 4.680 4.176 0.504 17949 1970 1 17 . 1 1 12 12 SER H H 12 8.268 8.268 8.459 -0.191 17949 1971 1 17 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.014 0.208 17949 1972 1 17 . 1 1 13 13 ILE H H 13 8.220 8.220 8.027 0.193 17949 1973 1 17 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.403 -0.051 17949 1974 1 17 . 1 1 14 14 GLU H H 14 8.365 8.365 8.593 -0.228 17949 1975 1 17 . 1 1 15 15 GLY H H 15 8.300 8.300 7.935 0.365 17949 1976 1 17 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.497 0.059 17949 1977 1 17 . 1 1 16 16 ARG H H 16 8.200 8.200 8.404 -0.204 17949 1978 1 17 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.428 -0.091 17949 1979 1 17 . 1 1 17 17 LYS H H 17 8.446 8.446 7.630 0.816 17949 1980 1 17 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.158 0.486 17949 1981 1 17 . 1 1 18 18 GLU H H 18 7.534 7.534 8.570 -1.036 17949 1982 1 17 . 1 1 19 19 GLY H H 19 7.245 7.245 7.176 0.069 17949 1983 1 17 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.388 0.538 17949 1984 1 17 . 1 1 20 20 TYR H H 20 9.101 9.101 8.299 0.802 17949 1985 1 17 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.706 -0.085 17949 1986 1 17 . 1 1 21 21 LEU H H 21 7.703 7.703 8.575 -0.872 17949 1987 1 17 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.928 1.300 17949 1988 1 17 . 1 1 22 22 VAL H H 22 7.049 7.049 7.550 -0.501 17949 1989 1 17 . 1 1 23 23 SER HA H 23 4.870 4.870 4.761 0.109 17949 1990 1 17 . 1 1 23 23 SER H H 23 8.356 8.356 8.496 -0.140 17949 1991 1 17 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.312 -0.229 17949 1992 1 17 . 1 1 24 24 LYS H H 24 9.212 9.212 8.754 0.458 17949 1993 1 17 . 1 1 25 25 SER HA H 25 4.440 4.440 4.269 0.171 17949 1994 1 17 . 1 1 25 25 SER H H 25 8.024 8.024 8.175 -0.151 17949 1995 1 17 . 1 1 26 26 THR HA H 26 4.513 4.513 4.433 0.080 17949 1996 1 17 . 1 1 26 26 THR H H 26 7.595 7.595 7.783 -0.188 17949 1997 1 17 . 1 1 27 27 GLY H H 27 8.388 8.388 8.246 0.142 17949 1998 1 17 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.901 0.050 17949 1999 1 17 . 1 1 28 28 CYS H H 28 8.131 8.131 8.522 -0.391 17949 2000 1 17 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.582 0.001 17949 2001 1 17 . 1 1 29 29 LYS H H 29 8.302 8.302 8.301 0.001 17949 2002 1 17 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.201 0.456 17949 2003 1 17 . 1 1 31 31 GLU H H 31 8.299 8.299 7.986 0.313 17949 2004 1 17 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.541 0.290 17949 2005 1 17 . 1 1 32 32 CYS H H 32 8.157 8.157 8.480 -0.323 17949 2006 1 17 . 1 1 33 33 LEU H H 33 8.495 8.495 8.466 0.029 17949 2007 1 17 . 1 1 34 34 LYS H H 34 8.445 8.445 7.723 0.722 17949 2008 1 17 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.084 -0.457 17949 2009 1 17 . 1 1 35 35 LEU H H 35 8.229 8.229 8.537 -0.308 17949 2010 1 17 . 1 1 36 36 GLY H H 36 9.039 9.039 8.696 0.343 17949 2011 1 17 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.593 0.027 17949 2012 1 17 . 1 1 37 37 ASP H H 37 8.511 8.511 8.248 0.263 17949 2013 1 17 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.834 -0.003 17949 2014 1 17 . 1 1 38 38 ASN H H 38 9.114 9.114 7.983 1.131 17949 2015 1 17 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.876 -0.350 17949 2016 1 17 . 1 1 39 39 ASP H H 39 9.019 9.019 8.826 0.193 17949 2017 1 17 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.213 0.123 17949 2018 1 17 . 1 1 40 40 TYR H H 40 8.036 8.036 7.652 0.384 17949 2019 1 17 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.022 0.191 17949 2020 1 17 . 1 1 41 41 CYS H H 41 8.164 8.164 8.668 -0.504 17949 2021 1 17 . 1 1 42 42 LEU HA H 42 3.714 3.714 3.903 -0.189 17949 2022 1 17 . 1 1 42 42 LEU H H 42 8.236 8.236 8.424 -0.188 17949 2023 1 17 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.188 -0.324 17949 2024 1 17 . 1 1 43 43 ARG H H 43 8.018 8.018 7.011 1.007 17949 2025 1 17 . 1 1 44 44 GLU HA H 44 3.869 3.869 3.931 -0.062 17949 2026 1 17 . 1 1 44 44 GLU H H 44 8.325 8.325 8.187 0.138 17949 2027 1 17 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.227 0.111 17949 2028 1 17 . 1 1 45 45 CYS H H 45 8.666 8.666 7.709 0.957 17949 2029 1 17 . 1 1 46 46 LYS H H 46 7.959 7.959 7.978 -0.019 17949 2030 1 17 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.265 -0.361 17949 2031 1 17 . 1 1 47 47 GLN H H 47 8.230 8.230 7.645 0.585 17949 2032 1 17 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.220 -0.112 17949 2033 1 17 . 1 1 48 48 GLN H H 48 7.614 7.614 8.183 -0.569 17949 2034 1 17 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.761 0.194 17949 2035 1 17 . 1 1 49 49 TYR H H 49 8.260 8.260 7.801 0.459 17949 2036 1 17 . 1 1 50 50 GLY H H 50 7.705 7.705 8.138 -0.433 17949 2037 1 17 . 1 1 51 51 LYS HA H 51 3.883 3.883 3.957 -0.074 17949 2038 1 17 . 1 1 51 51 LYS H H 51 8.621 8.621 8.205 0.416 17949 2039 1 17 . 1 1 52 52 SER HA H 52 4.510 4.510 4.073 0.437 17949 2040 1 17 . 1 1 52 52 SER H H 52 8.436 8.436 8.517 -0.081 17949 2041 1 17 . 1 1 53 53 SER HA H 53 4.637 4.637 4.317 0.320 17949 2042 1 17 . 1 1 53 53 SER H H 53 7.884 7.884 7.640 0.244 17949 2043 1 17 . 1 1 54 54 GLY H H 54 7.890 7.890 8.277 -0.387 17949 2044 1 17 . 1 1 55 55 GLY H H 55 7.893 7.893 7.952 -0.059 17949 2045 1 17 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.879 -0.061 17949 2046 1 17 . 1 1 56 56 TYR H H 56 8.939 8.939 8.496 0.443 17949 2047 1 17 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.755 0.447 17949 2048 1 17 . 1 1 57 57 CYS H H 57 9.281 9.281 9.181 0.100 17949 2049 1 17 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.271 0.659 17949 2050 1 17 . 1 1 58 58 TYR H H 58 9.406 9.406 8.047 1.359 17949 2051 1 17 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.998 -0.564 17949 2052 1 17 . 1 1 59 59 ALA H H 59 8.977 8.977 8.418 0.559 17949 2053 1 17 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.313 -0.204 17949 2054 1 17 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.458 1.002 17949 2055 1 17 . 1 1 61 61 ALA H H 61 8.089 8.089 7.786 0.303 17949 2056 1 17 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.306 0.964 17949 2057 1 17 . 1 1 62 62 CYS H H 62 8.706 8.706 8.661 0.045 17949 2058 1 17 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.512 0.111 17949 2059 1 17 . 1 1 63 63 TRP H H 63 9.739 9.739 8.926 0.813 17949 2060 1 17 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.620 0.988 17949 2061 1 17 . 1 1 64 64 CYS H H 64 8.649 8.649 7.347 1.302 17949 2062 1 17 . 1 1 65 65 THR HA H 65 4.591 4.591 4.622 -0.031 17949 2063 1 17 . 1 1 65 65 THR H H 65 7.937 7.937 8.977 -1.040 17949 2064 1 17 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.798 -0.788 17949 2065 1 17 . 1 1 66 66 HIS H H 66 8.755 8.755 8.158 0.597 17949 2066 1 17 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.529 -0.353 17949 2067 1 17 . 1 1 67 67 LEU H H 67 8.492 8.492 7.797 0.695 17949 2068 1 17 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.543 0.005 17949 2069 1 17 . 1 1 68 68 TYR H H 68 7.880 7.880 8.202 -0.322 17949 2070 1 17 . 1 1 69 69 GLU HA H 69 3.766 3.766 3.944 -0.178 17949 2071 1 17 . 1 1 69 69 GLU H H 69 8.787 8.787 8.637 0.150 17949 2072 1 17 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.103 0.153 17949 2073 1 17 . 1 1 70 70 GLN H H 70 7.925 7.925 8.113 -0.188 17949 2074 1 17 . 1 1 71 71 ALA HA H 71 4.045 4.045 2.666 1.379 17949 2075 1 17 . 1 1 71 71 ALA H H 71 7.490 7.490 7.165 0.325 17949 2076 1 17 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.149 -0.001 17949 2077 1 17 . 1 1 72 72 VAL H H 72 8.532 8.532 8.053 0.479 17949 2078 1 17 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.455 0.161 17949 2079 1 17 . 1 1 73 73 VAL H H 73 8.092 8.092 7.841 0.251 17949 2080 1 17 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.947 -0.850 17949 2081 1 17 . 1 1 74 74 TRP H H 74 8.500 8.500 8.340 0.160 17949 2082 1 17 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.355 -2.526 17949 2083 1 17 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.289 -0.090 17949 2084 1 17 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.850 -0.215 17949 2085 1 17 . 1 1 78 78 ASN H H 78 8.235 8.235 8.533 -0.298 17949 2086 1 17 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.233 0.359 17949 2087 1 17 . 1 1 79 79 LYS H H 79 7.039 7.039 7.988 -0.949 17949 2088 1 17 . 1 1 80 80 THR HA H 80 4.427 4.427 4.612 -0.185 17949 2089 1 17 . 1 1 80 80 THR H H 80 8.483 8.483 8.111 0.372 17949 2090 1 17 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.407 0.228 17949 2091 1 17 . 1 1 81 81 CYS H H 81 8.835 8.835 9.006 -0.171 17949 2092 1 18 . 1 1 12 12 SER HA H 12 4.680 4.680 4.493 0.187 17949 2093 1 18 . 1 1 12 12 SER H H 12 8.268 8.268 8.279 -0.011 17949 2094 1 18 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.169 0.053 17949 2095 1 18 . 1 1 13 13 ILE H H 13 8.220 8.220 7.639 0.581 17949 2096 1 18 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.277 0.075 17949 2097 1 18 . 1 1 14 14 GLU H H 14 8.365 8.365 8.648 -0.283 17949 2098 1 18 . 1 1 15 15 GLY H H 15 8.300 8.300 8.589 -0.289 17949 2099 1 18 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.519 0.037 17949 2100 1 18 . 1 1 16 16 ARG H H 16 8.200 8.200 8.334 -0.134 17949 2101 1 18 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.522 -0.185 17949 2102 1 18 . 1 1 17 17 LYS H H 17 8.446 8.446 7.910 0.536 17949 2103 1 18 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.088 0.556 17949 2104 1 18 . 1 1 18 18 GLU H H 18 7.534 7.534 8.579 -1.045 17949 2105 1 18 . 1 1 19 19 GLY H H 19 7.245 7.245 6.962 0.283 17949 2106 1 18 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.483 0.443 17949 2107 1 18 . 1 1 20 20 TYR H H 20 9.101 9.101 8.159 0.942 17949 2108 1 18 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.257 0.364 17949 2109 1 18 . 1 1 21 21 LEU H H 21 7.703 7.703 8.465 -0.762 17949 2110 1 18 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.949 1.279 17949 2111 1 18 . 1 1 22 22 VAL H H 22 7.049 7.049 7.426 -0.377 17949 2112 1 18 . 1 1 23 23 SER HA H 23 4.870 4.870 4.804 0.066 17949 2113 1 18 . 1 1 23 23 SER H H 23 8.356 8.356 8.559 -0.203 17949 2114 1 18 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.328 -0.245 17949 2115 1 18 . 1 1 24 24 LYS H H 24 9.212 9.212 8.704 0.508 17949 2116 1 18 . 1 1 25 25 SER HA H 25 4.440 4.440 4.259 0.181 17949 2117 1 18 . 1 1 25 25 SER H H 25 8.024 8.024 8.108 -0.084 17949 2118 1 18 . 1 1 26 26 THR HA H 26 4.513 4.513 4.385 0.128 17949 2119 1 18 . 1 1 26 26 THR H H 26 7.595 7.595 7.945 -0.350 17949 2120 1 18 . 1 1 27 27 GLY H H 27 8.388 8.388 8.199 0.189 17949 2121 1 18 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.941 0.011 17949 2122 1 18 . 1 1 28 28 CYS H H 28 8.131 8.131 8.363 -0.232 17949 2123 1 18 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.604 -0.021 17949 2124 1 18 . 1 1 29 29 LYS H H 29 8.302 8.302 8.099 0.203 17949 2125 1 18 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.733 -0.076 17949 2126 1 18 . 1 1 31 31 GLU H H 31 8.299 8.299 8.568 -0.269 17949 2127 1 18 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.878 -0.047 17949 2128 1 18 . 1 1 32 32 CYS H H 32 8.157 8.157 8.784 -0.627 17949 2129 1 18 . 1 1 33 33 LEU H H 33 8.495 8.495 8.713 -0.218 17949 2130 1 18 . 1 1 34 34 LYS H H 34 8.445 8.445 7.960 0.485 17949 2131 1 18 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.412 -0.785 17949 2132 1 18 . 1 1 35 35 LEU H H 35 8.229 8.229 8.340 -0.111 17949 2133 1 18 . 1 1 36 36 GLY H H 36 9.039 9.039 7.784 1.255 17949 2134 1 18 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.648 -0.028 17949 2135 1 18 . 1 1 37 37 ASP H H 37 8.511 8.511 8.219 0.292 17949 2136 1 18 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.809 0.022 17949 2137 1 18 . 1 1 38 38 ASN H H 38 9.114 9.114 8.456 0.658 17949 2138 1 18 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.724 -0.198 17949 2139 1 18 . 1 1 39 39 ASP H H 39 9.019 9.019 8.742 0.277 17949 2140 1 18 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.194 0.142 17949 2141 1 18 . 1 1 40 40 TYR H H 40 8.036 8.036 8.071 -0.035 17949 2142 1 18 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.176 0.037 17949 2143 1 18 . 1 1 41 41 CYS H H 41 8.164 8.164 7.769 0.395 17949 2144 1 18 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.208 -0.494 17949 2145 1 18 . 1 1 42 42 LEU H H 42 8.236 8.236 7.318 0.918 17949 2146 1 18 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.406 -0.542 17949 2147 1 18 . 1 1 43 43 ARG H H 43 8.018 8.018 7.638 0.380 17949 2148 1 18 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.423 -0.554 17949 2149 1 18 . 1 1 44 44 GLU H H 44 8.325 8.325 7.809 0.516 17949 2150 1 18 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.608 -0.270 17949 2151 1 18 . 1 1 45 45 CYS H H 45 8.666 8.666 7.496 1.170 17949 2152 1 18 . 1 1 46 46 LYS H H 46 7.959 7.959 7.883 0.076 17949 2153 1 18 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.123 -0.219 17949 2154 1 18 . 1 1 47 47 GLN H H 47 8.230 8.230 7.970 0.260 17949 2155 1 18 . 1 1 48 48 GLN HA H 48 4.108 4.108 3.952 0.156 17949 2156 1 18 . 1 1 48 48 GLN H H 48 7.614 7.614 8.368 -0.754 17949 2157 1 18 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.613 0.342 17949 2158 1 18 . 1 1 49 49 TYR H H 49 8.260 8.260 7.770 0.490 17949 2159 1 18 . 1 1 50 50 GLY H H 50 7.705 7.705 7.351 0.354 17949 2160 1 18 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.015 -0.132 17949 2161 1 18 . 1 1 51 51 LYS H H 51 8.621 8.621 8.482 0.139 17949 2162 1 18 . 1 1 52 52 SER HA H 52 4.510 4.510 4.152 0.358 17949 2163 1 18 . 1 1 52 52 SER H H 52 8.436 8.436 8.530 -0.094 17949 2164 1 18 . 1 1 53 53 SER HA H 53 4.637 4.637 4.237 0.400 17949 2165 1 18 . 1 1 53 53 SER H H 53 7.884 7.884 7.562 0.322 17949 2166 1 18 . 1 1 54 54 GLY H H 54 7.890 7.890 7.652 0.238 17949 2167 1 18 . 1 1 55 55 GLY H H 55 7.893 7.893 8.002 -0.109 17949 2168 1 18 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.840 -0.022 17949 2169 1 18 . 1 1 56 56 TYR H H 56 8.939 8.939 8.572 0.367 17949 2170 1 18 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.921 0.281 17949 2171 1 18 . 1 1 57 57 CYS H H 57 9.281 9.281 9.267 0.014 17949 2172 1 18 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.258 0.672 17949 2173 1 18 . 1 1 58 58 TYR H H 58 9.406 9.406 7.950 1.456 17949 2174 1 18 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.977 -0.543 17949 2175 1 18 . 1 1 59 59 ALA H H 59 8.977 8.977 8.374 0.603 17949 2176 1 18 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.464 -0.355 17949 2177 1 18 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.540 0.920 17949 2178 1 18 . 1 1 61 61 ALA H H 61 8.089 8.089 7.785 0.304 17949 2179 1 18 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.408 0.862 17949 2180 1 18 . 1 1 62 62 CYS H H 62 8.706 8.706 8.715 -0.009 17949 2181 1 18 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.537 0.086 17949 2182 1 18 . 1 1 63 63 TRP H H 63 9.739 9.739 8.934 0.805 17949 2183 1 18 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.566 1.042 17949 2184 1 18 . 1 1 64 64 CYS H H 64 8.649 8.649 7.405 1.244 17949 2185 1 18 . 1 1 65 65 THR HA H 65 4.591 4.591 4.413 0.178 17949 2186 1 18 . 1 1 65 65 THR H H 65 7.937 7.937 8.874 -0.937 17949 2187 1 18 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.741 -0.731 17949 2188 1 18 . 1 1 66 66 HIS H H 66 8.755 8.755 8.004 0.751 17949 2189 1 18 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.621 -0.445 17949 2190 1 18 . 1 1 67 67 LEU H H 67 8.492 8.492 7.901 0.591 17949 2191 1 18 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.520 0.028 17949 2192 1 18 . 1 1 68 68 TYR H H 68 7.880 7.880 8.521 -0.641 17949 2193 1 18 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.161 -0.395 17949 2194 1 18 . 1 1 69 69 GLU H H 69 8.787 8.787 8.605 0.182 17949 2195 1 18 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.448 -0.192 17949 2196 1 18 . 1 1 70 70 GLN H H 70 7.925 7.925 8.420 -0.495 17949 2197 1 18 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.704 -0.659 17949 2198 1 18 . 1 1 71 71 ALA H H 71 7.490 7.490 7.571 -0.081 17949 2199 1 18 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.199 -0.051 17949 2200 1 18 . 1 1 72 72 VAL H H 72 8.532 8.532 8.357 0.175 17949 2201 1 18 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.479 0.137 17949 2202 1 18 . 1 1 73 73 VAL H H 73 8.092 8.092 7.705 0.387 17949 2203 1 18 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.677 -0.580 17949 2204 1 18 . 1 1 74 74 TRP H H 74 8.500 8.500 8.286 0.214 17949 2205 1 18 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.574 -2.745 17949 2206 1 18 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.506 -0.307 17949 2207 1 18 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.570 0.065 17949 2208 1 18 . 1 1 78 78 ASN H H 78 8.235 8.235 8.784 -0.549 17949 2209 1 18 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.551 0.041 17949 2210 1 18 . 1 1 79 79 LYS H H 79 7.039 7.039 7.686 -0.647 17949 2211 1 18 . 1 1 80 80 THR HA H 80 4.427 4.427 4.678 -0.251 17949 2212 1 18 . 1 1 80 80 THR H H 80 8.483 8.483 8.079 0.404 17949 2213 1 18 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.574 0.061 17949 2214 1 18 . 1 1 81 81 CYS H H 81 8.835 8.835 8.993 -0.158 17949 2215 1 19 . 1 1 12 12 SER HA H 12 4.680 4.680 4.594 0.086 17949 2216 1 19 . 1 1 12 12 SER H H 12 8.268 8.268 8.300 -0.032 17949 2217 1 19 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.247 -0.025 17949 2218 1 19 . 1 1 13 13 ILE H H 13 8.220 8.220 7.862 0.358 17949 2219 1 19 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.350 0.002 17949 2220 1 19 . 1 1 14 14 GLU H H 14 8.365 8.365 8.551 -0.186 17949 2221 1 19 . 1 1 15 15 GLY H H 15 8.300 8.300 8.149 0.151 17949 2222 1 19 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.678 -0.122 17949 2223 1 19 . 1 1 16 16 ARG H H 16 8.200 8.200 8.128 0.072 17949 2224 1 19 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.482 -0.145 17949 2225 1 19 . 1 1 17 17 LYS H H 17 8.446 8.446 7.869 0.577 17949 2226 1 19 . 1 1 18 18 GLU HA H 18 4.644 4.644 3.838 0.806 17949 2227 1 19 . 1 1 18 18 GLU H H 18 7.534 7.534 8.692 -1.158 17949 2228 1 19 . 1 1 19 19 GLY H H 19 7.245 7.245 7.672 -0.427 17949 2229 1 19 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.658 0.268 17949 2230 1 19 . 1 1 20 20 TYR H H 20 9.101 9.101 8.393 0.708 17949 2231 1 19 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.811 -0.190 17949 2232 1 19 . 1 1 21 21 LEU H H 21 7.703 7.703 8.655 -0.952 17949 2233 1 19 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.864 1.364 17949 2234 1 19 . 1 1 22 22 VAL H H 22 7.049 7.049 7.912 -0.863 17949 2235 1 19 . 1 1 23 23 SER HA H 23 4.870 4.870 4.761 0.109 17949 2236 1 19 . 1 1 23 23 SER H H 23 8.356 8.356 7.913 0.443 17949 2237 1 19 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.226 -0.143 17949 2238 1 19 . 1 1 24 24 LYS H H 24 9.212 9.212 8.780 0.432 17949 2239 1 19 . 1 1 25 25 SER HA H 25 4.440 4.440 4.325 0.115 17949 2240 1 19 . 1 1 25 25 SER H H 25 8.024 8.024 8.575 -0.551 17949 2241 1 19 . 1 1 26 26 THR HA H 26 4.513 4.513 4.499 0.014 17949 2242 1 19 . 1 1 26 26 THR H H 26 7.595 7.595 7.702 -0.107 17949 2243 1 19 . 1 1 27 27 GLY H H 27 8.388 8.388 8.507 -0.119 17949 2244 1 19 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.837 0.114 17949 2245 1 19 . 1 1 28 28 CYS H H 28 8.131 8.131 7.791 0.340 17949 2246 1 19 . 1 1 29 29 LYS HA H 29 4.583 4.583 3.967 0.616 17949 2247 1 19 . 1 1 29 29 LYS H H 29 8.302 8.302 8.081 0.221 17949 2248 1 19 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.078 0.579 17949 2249 1 19 . 1 1 31 31 GLU H H 31 8.299 8.299 7.823 0.476 17949 2250 1 19 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.405 0.426 17949 2251 1 19 . 1 1 32 32 CYS H H 32 8.157 8.157 8.512 -0.355 17949 2252 1 19 . 1 1 33 33 LEU H H 33 8.495 8.495 8.561 -0.066 17949 2253 1 19 . 1 1 34 34 LYS H H 34 8.445 8.445 8.046 0.399 17949 2254 1 19 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.363 -0.736 17949 2255 1 19 . 1 1 35 35 LEU H H 35 8.229 8.229 8.362 -0.133 17949 2256 1 19 . 1 1 36 36 GLY H H 36 9.039 9.039 9.043 -0.004 17949 2257 1 19 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.643 -0.023 17949 2258 1 19 . 1 1 37 37 ASP H H 37 8.511 8.511 8.094 0.417 17949 2259 1 19 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.754 0.077 17949 2260 1 19 . 1 1 38 38 ASN H H 38 9.114 9.114 8.148 0.966 17949 2261 1 19 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.708 -0.182 17949 2262 1 19 . 1 1 39 39 ASP H H 39 9.019 9.019 8.665 0.354 17949 2263 1 19 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.343 -0.007 17949 2264 1 19 . 1 1 40 40 TYR H H 40 8.036 8.036 8.247 -0.211 17949 2265 1 19 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.188 0.025 17949 2266 1 19 . 1 1 41 41 CYS H H 41 8.164 8.164 8.579 -0.415 17949 2267 1 19 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.013 -0.299 17949 2268 1 19 . 1 1 42 42 LEU H H 42 8.236 8.236 7.588 0.648 17949 2269 1 19 . 1 1 43 43 ARG HA H 43 3.864 3.864 3.842 0.022 17949 2270 1 19 . 1 1 43 43 ARG H H 43 8.018 8.018 7.449 0.569 17949 2271 1 19 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.048 -0.179 17949 2272 1 19 . 1 1 44 44 GLU H H 44 8.325 8.325 7.727 0.598 17949 2273 1 19 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.691 -0.353 17949 2274 1 19 . 1 1 45 45 CYS H H 45 8.666 8.666 7.538 1.128 17949 2275 1 19 . 1 1 46 46 LYS H H 46 7.959 7.959 7.612 0.347 17949 2276 1 19 . 1 1 47 47 GLN HA H 47 3.904 3.904 3.961 -0.057 17949 2277 1 19 . 1 1 47 47 GLN H H 47 8.230 8.230 7.726 0.504 17949 2278 1 19 . 1 1 48 48 GLN HA H 48 4.108 4.108 3.929 0.179 17949 2279 1 19 . 1 1 48 48 GLN H H 48 7.614 7.614 8.081 -0.467 17949 2280 1 19 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.399 0.556 17949 2281 1 19 . 1 1 49 49 TYR H H 49 8.260 8.260 7.574 0.686 17949 2282 1 19 . 1 1 50 50 GLY H H 50 7.705 7.705 8.281 -0.576 17949 2283 1 19 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.514 -0.631 17949 2284 1 19 . 1 1 51 51 LYS H H 51 8.621 8.621 8.126 0.495 17949 2285 1 19 . 1 1 52 52 SER HA H 52 4.510 4.510 4.230 0.280 17949 2286 1 19 . 1 1 52 52 SER H H 52 8.436 8.436 8.621 -0.185 17949 2287 1 19 . 1 1 53 53 SER HA H 53 4.637 4.637 4.746 -0.109 17949 2288 1 19 . 1 1 53 53 SER H H 53 7.884 7.884 7.841 0.043 17949 2289 1 19 . 1 1 54 54 GLY H H 54 7.890 7.890 7.745 0.145 17949 2290 1 19 . 1 1 55 55 GLY H H 55 7.893 7.893 8.030 -0.137 17949 2291 1 19 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.836 -0.018 17949 2292 1 19 . 1 1 56 56 TYR H H 56 8.939 8.939 8.394 0.545 17949 2293 1 19 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.661 0.541 17949 2294 1 19 . 1 1 57 57 CYS H H 57 9.281 9.281 9.338 -0.057 17949 2295 1 19 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.382 0.548 17949 2296 1 19 . 1 1 58 58 TYR H H 58 9.406 9.406 8.113 1.293 17949 2297 1 19 . 1 1 59 59 ALA HA H 59 3.434 3.434 4.038 -0.604 17949 2298 1 19 . 1 1 59 59 ALA H H 59 8.977 8.977 8.436 0.541 17949 2299 1 19 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.364 -0.255 17949 2300 1 19 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.533 0.927 17949 2301 1 19 . 1 1 61 61 ALA H H 61 8.089 8.089 8.007 0.082 17949 2302 1 19 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.303 0.967 17949 2303 1 19 . 1 1 62 62 CYS H H 62 8.706 8.706 8.774 -0.068 17949 2304 1 19 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.435 0.188 17949 2305 1 19 . 1 1 63 63 TRP H H 63 9.739 9.739 8.346 1.393 17949 2306 1 19 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.696 0.912 17949 2307 1 19 . 1 1 64 64 CYS H H 64 8.649 8.649 7.547 1.102 17949 2308 1 19 . 1 1 65 65 THR HA H 65 4.591 4.591 4.529 0.062 17949 2309 1 19 . 1 1 65 65 THR H H 65 7.937 7.937 8.088 -0.151 17949 2310 1 19 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.174 -0.164 17949 2311 1 19 . 1 1 66 66 HIS H H 66 8.755 8.755 8.603 0.152 17949 2312 1 19 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.343 -0.167 17949 2313 1 19 . 1 1 67 67 LEU H H 67 8.492 8.492 7.237 1.255 17949 2314 1 19 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.103 0.445 17949 2315 1 19 . 1 1 68 68 TYR H H 68 7.880 7.880 8.500 -0.620 17949 2316 1 19 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.262 -0.496 17949 2317 1 19 . 1 1 69 69 GLU H H 69 8.787 8.787 7.974 0.813 17949 2318 1 19 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.301 -0.045 17949 2319 1 19 . 1 1 70 70 GLN H H 70 7.925 7.925 8.124 -0.199 17949 2320 1 19 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.325 -0.280 17949 2321 1 19 . 1 1 71 71 ALA H H 71 7.490 7.490 7.773 -0.283 17949 2322 1 19 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.183 -0.035 17949 2323 1 19 . 1 1 72 72 VAL H H 72 8.532 8.532 8.103 0.429 17949 2324 1 19 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.433 0.183 17949 2325 1 19 . 1 1 73 73 VAL H H 73 8.092 8.092 7.863 0.229 17949 2326 1 19 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.911 -0.814 17949 2327 1 19 . 1 1 74 74 TRP H H 74 8.500 8.500 8.294 0.206 17949 2328 1 19 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.014 -2.185 17949 2329 1 19 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.311 -0.112 17949 2330 1 19 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.802 -0.167 17949 2331 1 19 . 1 1 78 78 ASN H H 78 8.235 8.235 8.389 -0.154 17949 2332 1 19 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.427 0.165 17949 2333 1 19 . 1 1 79 79 LYS H H 79 7.039 7.039 8.102 -1.063 17949 2334 1 19 . 1 1 80 80 THR HA H 80 4.427 4.427 4.480 -0.053 17949 2335 1 19 . 1 1 80 80 THR H H 80 8.483 8.483 8.369 0.114 17949 2336 1 19 . 1 1 81 81 CYS HA H 81 4.635 4.635 5.070 -0.435 17949 2337 1 19 . 1 1 81 81 CYS H H 81 8.835 8.835 8.741 0.094 17949 2338 1 20 . 1 1 12 12 SER HA H 12 4.680 4.680 4.445 0.235 17949 2339 1 20 . 1 1 12 12 SER H H 12 8.268 8.268 8.235 0.033 17949 2340 1 20 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.021 0.201 17949 2341 1 20 . 1 1 13 13 ILE H H 13 8.220 8.220 7.761 0.459 17949 2342 1 20 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.455 -0.103 17949 2343 1 20 . 1 1 14 14 GLU H H 14 8.365 8.365 8.299 0.066 17949 2344 1 20 . 1 1 15 15 GLY H H 15 8.300 8.300 8.343 -0.043 17949 2345 1 20 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.061 0.495 17949 2346 1 20 . 1 1 16 16 ARG H H 16 8.200 8.200 7.596 0.604 17949 2347 1 20 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.173 0.164 17949 2348 1 20 . 1 1 17 17 LYS H H 17 8.446 8.446 8.128 0.318 17949 2349 1 20 . 1 1 18 18 GLU HA H 18 4.644 4.644 5.034 -0.390 17949 2350 1 20 . 1 1 18 18 GLU H H 18 7.534 7.534 8.428 -0.894 17949 2351 1 20 . 1 1 19 19 GLY H H 19 7.245 7.245 7.515 -0.270 17949 2352 1 20 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.975 -0.049 17949 2353 1 20 . 1 1 20 20 TYR H H 20 9.101 9.101 8.392 0.709 17949 2354 1 20 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.725 -0.104 17949 2355 1 20 . 1 1 21 21 LEU H H 21 7.703 7.703 8.759 -1.056 17949 2356 1 20 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.984 1.244 17949 2357 1 20 . 1 1 22 22 VAL H H 22 7.049 7.049 7.848 -0.799 17949 2358 1 20 . 1 1 23 23 SER HA H 23 4.870 4.870 4.887 -0.017 17949 2359 1 20 . 1 1 23 23 SER H H 23 8.356 8.356 7.645 0.711 17949 2360 1 20 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.277 -0.194 17949 2361 1 20 . 1 1 24 24 LYS H H 24 9.212 9.212 8.726 0.486 17949 2362 1 20 . 1 1 25 25 SER HA H 25 4.440 4.440 4.521 -0.081 17949 2363 1 20 . 1 1 25 25 SER H H 25 8.024 8.024 7.870 0.154 17949 2364 1 20 . 1 1 26 26 THR HA H 26 4.513 4.513 4.602 -0.089 17949 2365 1 20 . 1 1 26 26 THR H H 26 7.595 7.595 7.700 -0.105 17949 2366 1 20 . 1 1 27 27 GLY H H 27 8.388 8.388 8.449 -0.061 17949 2367 1 20 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.925 0.026 17949 2368 1 20 . 1 1 28 28 CYS H H 28 8.131 8.131 7.639 0.492 17949 2369 1 20 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.648 -0.065 17949 2370 1 20 . 1 1 29 29 LYS H H 29 8.302 8.302 8.349 -0.047 17949 2371 1 20 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.545 0.112 17949 2372 1 20 . 1 1 31 31 GLU H H 31 8.299 8.299 7.886 0.413 17949 2373 1 20 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.935 -0.104 17949 2374 1 20 . 1 1 32 32 CYS H H 32 8.157 8.157 8.569 -0.412 17949 2375 1 20 . 1 1 33 33 LEU H H 33 8.495 8.495 8.603 -0.108 17949 2376 1 20 . 1 1 34 34 LYS H H 34 8.445 8.445 7.800 0.645 17949 2377 1 20 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.469 -0.842 17949 2378 1 20 . 1 1 35 35 LEU H H 35 8.229 8.229 8.493 -0.264 17949 2379 1 20 . 1 1 36 36 GLY H H 36 9.039 9.039 8.323 0.716 17949 2380 1 20 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.745 -0.125 17949 2381 1 20 . 1 1 37 37 ASP H H 37 8.511 8.511 8.451 0.060 17949 2382 1 20 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.926 -0.095 17949 2383 1 20 . 1 1 38 38 ASN H H 38 9.114 9.114 7.969 1.145 17949 2384 1 20 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.603 -0.077 17949 2385 1 20 . 1 1 39 39 ASP H H 39 9.019 9.019 8.615 0.404 17949 2386 1 20 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.143 0.193 17949 2387 1 20 . 1 1 40 40 TYR H H 40 8.036 8.036 8.150 -0.114 17949 2388 1 20 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.366 -0.153 17949 2389 1 20 . 1 1 41 41 CYS H H 41 8.164 8.164 8.500 -0.336 17949 2390 1 20 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.172 -0.458 17949 2391 1 20 . 1 1 42 42 LEU H H 42 8.236 8.236 7.787 0.449 17949 2392 1 20 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.296 -0.432 17949 2393 1 20 . 1 1 43 43 ARG H H 43 8.018 8.018 7.364 0.654 17949 2394 1 20 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.127 -0.258 17949 2395 1 20 . 1 1 44 44 GLU H H 44 8.325 8.325 7.590 0.735 17949 2396 1 20 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.212 0.126 17949 2397 1 20 . 1 1 45 45 CYS H H 45 8.666 8.666 7.378 1.288 17949 2398 1 20 . 1 1 46 46 LYS H H 46 7.959 7.959 7.957 0.002 17949 2399 1 20 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.231 -0.327 17949 2400 1 20 . 1 1 47 47 GLN H H 47 8.230 8.230 7.904 0.326 17949 2401 1 20 . 1 1 48 48 GLN HA H 48 4.108 4.108 3.865 0.243 17949 2402 1 20 . 1 1 48 48 GLN H H 48 7.614 7.614 8.334 -0.720 17949 2403 1 20 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.372 0.583 17949 2404 1 20 . 1 1 49 49 TYR H H 49 8.260 8.260 7.295 0.965 17949 2405 1 20 . 1 1 50 50 GLY H H 50 7.705 7.705 8.170 -0.465 17949 2406 1 20 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.495 -0.612 17949 2407 1 20 . 1 1 51 51 LYS H H 51 8.621 8.621 8.242 0.379 17949 2408 1 20 . 1 1 52 52 SER HA H 52 4.510 4.510 4.542 -0.032 17949 2409 1 20 . 1 1 52 52 SER H H 52 8.436 8.436 8.212 0.224 17949 2410 1 20 . 1 1 53 53 SER HA H 53 4.637 4.637 4.601 0.036 17949 2411 1 20 . 1 1 53 53 SER H H 53 7.884 7.884 7.482 0.402 17949 2412 1 20 . 1 1 54 54 GLY H H 54 7.890 7.890 8.234 -0.344 17949 2413 1 20 . 1 1 55 55 GLY H H 55 7.893 7.893 8.015 -0.122 17949 2414 1 20 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.823 -0.005 17949 2415 1 20 . 1 1 56 56 TYR H H 56 8.939 8.939 8.048 0.891 17949 2416 1 20 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.792 0.410 17949 2417 1 20 . 1 1 57 57 CYS H H 57 9.281 9.281 9.137 0.144 17949 2418 1 20 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.369 0.561 17949 2419 1 20 . 1 1 58 58 TYR H H 58 9.406 9.406 8.028 1.378 17949 2420 1 20 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.999 -0.565 17949 2421 1 20 . 1 1 59 59 ALA H H 59 8.977 8.977 8.412 0.565 17949 2422 1 20 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.348 -0.239 17949 2423 1 20 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.511 0.949 17949 2424 1 20 . 1 1 61 61 ALA H H 61 8.089 8.089 7.670 0.419 17949 2425 1 20 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.529 0.741 17949 2426 1 20 . 1 1 62 62 CYS H H 62 8.706 8.706 8.354 0.352 17949 2427 1 20 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.890 -0.267 17949 2428 1 20 . 1 1 63 63 TRP H H 63 9.739 9.739 8.577 1.162 17949 2429 1 20 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.374 1.234 17949 2430 1 20 . 1 1 64 64 CYS H H 64 8.649 8.649 8.128 0.521 17949 2431 1 20 . 1 1 65 65 THR HA H 65 4.591 4.591 4.120 0.471 17949 2432 1 20 . 1 1 65 65 THR H H 65 7.937 7.937 8.664 -0.727 17949 2433 1 20 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.647 -0.637 17949 2434 1 20 . 1 1 66 66 HIS H H 66 8.755 8.755 7.588 1.167 17949 2435 1 20 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.393 -0.217 17949 2436 1 20 . 1 1 67 67 LEU H H 67 8.492 8.492 8.033 0.459 17949 2437 1 20 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.572 -0.024 17949 2438 1 20 . 1 1 68 68 TYR H H 68 7.880 7.880 7.976 -0.096 17949 2439 1 20 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.053 -0.287 17949 2440 1 20 . 1 1 69 69 GLU H H 69 8.787 8.787 8.766 0.021 17949 2441 1 20 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.521 -0.265 17949 2442 1 20 . 1 1 70 70 GLN H H 70 7.925 7.925 8.313 -0.388 17949 2443 1 20 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.784 -0.739 17949 2444 1 20 . 1 1 71 71 ALA H H 71 7.490 7.490 7.482 0.008 17949 2445 1 20 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.446 -0.298 17949 2446 1 20 . 1 1 72 72 VAL H H 72 8.532 8.532 8.376 0.156 17949 2447 1 20 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.561 0.055 17949 2448 1 20 . 1 1 73 73 VAL H H 73 8.092 8.092 7.908 0.184 17949 2449 1 20 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.993 -0.896 17949 2450 1 20 . 1 1 74 74 TRP H H 74 8.500 8.500 8.589 -0.089 17949 2451 1 20 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.697 -2.868 17949 2452 1 20 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.173 0.026 17949 2453 1 20 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.807 -0.172 17949 2454 1 20 . 1 1 78 78 ASN H H 78 8.235 8.235 8.325 -0.090 17949 2455 1 20 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.461 0.131 17949 2456 1 20 . 1 1 79 79 LYS H H 79 7.039 7.039 7.475 -0.436 17949 2457 1 20 . 1 1 80 80 THR HA H 80 4.427 4.427 4.416 0.011 17949 2458 1 20 . 1 1 80 80 THR H H 80 8.483 8.483 7.852 0.631 17949 2459 1 20 . 1 1 81 81 CYS HA H 81 4.635 4.635 3.936 0.699 17949 2460 1 20 . 1 1 81 81 CYS H H 81 8.835 8.835 8.623 0.212 17949 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 0 0.000 0.000 0.000 17949 2 1 1 "Average Difference" HA 72 0.591 -0.007 0.595 17949 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17949 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 17949 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17949 6 1 1 "Average Difference" HN 65 0.536 -0.133 0.524 17949 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 17949 8 1 2 "Average Difference" HA 72 0.589 0.017 0.593 17949 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17949 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 17949 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17949 12 1 2 "Average Difference" HN 65 0.589 -0.117 0.581 17949 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 17949 14 1 3 "Average Difference" HA 72 0.576 0.020 0.580 17949 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17949 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 17949 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17949 18 1 3 "Average Difference" HN 65 0.528 -0.102 0.522 17949 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 17949 20 1 4 "Average Difference" HA 72 0.610 0.012 0.615 17949 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17949 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 17949 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17949 24 1 4 "Average Difference" HN 65 0.535 -0.123 0.525 17949 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 17949 26 1 5 "Average Difference" HA 72 0.586 -0.019 0.590 17949 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17949 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 17949 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17949 30 1 5 "Average Difference" HN 65 0.536 -0.159 0.516 17949 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 17949 32 1 6 "Average Difference" HA 72 0.628 0.006 0.632 17949 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17949 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 17949 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17949 36 1 6 "Average Difference" HN 65 0.550 -0.113 0.542 17949 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 17949 38 1 7 "Average Difference" HA 72 0.584 0.024 0.588 17949 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17949 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 17949 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17949 42 1 7 "Average Difference" HN 65 0.560 -0.137 0.548 17949 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 17949 44 1 8 "Average Difference" HA 72 0.605 0.031 0.609 17949 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17949 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 17949 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17949 48 1 8 "Average Difference" HN 65 0.564 -0.143 0.550 17949 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 17949 50 1 9 "Average Difference" HA 72 0.576 0.033 0.579 17949 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17949 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 17949 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17949 54 1 9 "Average Difference" HN 65 0.554 -0.161 0.534 17949 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 17949 56 1 10 "Average Difference" HA 72 0.583 -0.028 0.586 17949 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17949 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 17949 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17949 60 1 10 "Average Difference" HN 65 0.562 -0.158 0.544 17949 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 17949 62 1 11 "Average Difference" HA 72 0.609 0.012 0.613 17949 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17949 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 17949 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17949 66 1 11 "Average Difference" HN 65 0.564 -0.161 0.545 17949 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 17949 68 1 12 "Average Difference" HA 72 0.594 -0.004 0.599 17949 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17949 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 17949 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17949 72 1 12 "Average Difference" HN 65 0.571 -0.129 0.560 17949 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 17949 74 1 13 "Average Difference" HA 72 0.564 -0.041 0.567 17949 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17949 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 17949 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17949 78 1 13 "Average Difference" HN 65 0.536 -0.154 0.518 17949 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 17949 80 1 14 "Average Difference" HA 72 0.559 0.024 0.563 17949 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17949 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 17949 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17949 84 1 14 "Average Difference" HN 65 0.527 -0.134 0.513 17949 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 17949 86 1 15 "Average Difference" HA 72 0.617 -0.020 0.621 17949 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17949 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 17949 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17949 90 1 15 "Average Difference" HN 65 0.599 -0.187 0.573 17949 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 17949 92 1 16 "Average Difference" HA 72 0.589 0.008 0.593 17949 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 17949 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 17949 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 17949 96 1 16 "Average Difference" HN 65 0.559 -0.179 0.533 17949 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 17949 98 1 17 "Average Difference" HA 72 0.586 -0.056 0.588 17949 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 17949 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 17949 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 17949 102 1 17 "Average Difference" HN 65 0.538 -0.127 0.527 17949 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 17949 104 1 18 "Average Difference" HA 72 0.580 0.031 0.583 17949 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 17949 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 17949 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 17949 108 1 18 "Average Difference" HN 65 0.549 -0.146 0.534 17949 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 17949 110 1 19 "Average Difference" HA 72 0.566 0.002 0.570 17949 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 17949 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 17949 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 17949 114 1 19 "Average Difference" HN 65 0.566 -0.151 0.550 17949 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 17949 116 1 20 "Average Difference" HA 72 0.618 0.055 0.620 17949 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 17949 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 17949 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 17949 120 1 20 "Average Difference" HN 65 0.566 -0.202 0.533 17949 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 17949 _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 12 12 SER HA H 12 4.680 4.680 4.552 0.128 17949 2 1 . 1 1 12 12 SER H H 12 8.268 8.268 8.266 0.002 17949 3 1 . 1 1 13 13 ILE HA H 13 4.222 4.222 4.202 0.020 17949 4 1 . 1 1 13 13 ILE H H 13 8.220 8.220 8.013 0.207 17949 5 1 . 1 1 14 14 GLU HA H 14 4.352 4.352 4.443 -0.091 17949 6 1 . 1 1 14 14 GLU H H 14 8.365 8.365 8.406 -0.041 17949 7 1 . 1 1 15 15 GLY H H 15 8.300 8.300 8.368 -0.068 17949 8 1 . 1 1 16 16 ARG HA H 16 4.556 4.556 4.336 0.221 17949 9 1 . 1 1 16 16 ARG H H 16 8.200 8.200 8.299 -0.099 17949 10 1 . 1 1 17 17 LYS HA H 17 4.337 4.337 4.430 -0.093 17949 11 1 . 1 1 17 17 LYS H H 17 8.446 8.446 7.759 0.687 17949 12 1 . 1 1 18 18 GLU HA H 18 4.644 4.644 4.174 0.470 17949 13 1 . 1 1 18 18 GLU H H 18 7.534 7.534 8.528 -0.994 17949 14 1 . 1 1 19 19 GLY H H 19 7.245 7.245 7.385 -0.140 17949 15 1 . 1 1 20 20 TYR HA H 20 4.926 4.926 4.613 0.313 17949 16 1 . 1 1 20 20 TYR H H 20 9.101 9.101 8.329 0.771 17949 17 1 . 1 1 21 21 LEU HA H 21 4.621 4.621 4.536 0.085 17949 18 1 . 1 1 21 21 LEU H H 21 7.703 7.703 8.694 -0.991 17949 19 1 . 1 1 22 22 VAL HA H 22 5.228 5.228 3.994 1.234 17949 20 1 . 1 1 22 22 VAL H H 22 7.049 7.049 7.703 -0.654 17949 21 1 . 1 1 23 23 SER HA H 23 4.870 4.870 4.703 0.167 17949 22 1 . 1 1 23 23 SER H H 23 8.356 8.356 8.333 0.023 17949 23 1 . 1 1 24 24 LYS HA H 24 4.083 4.083 4.299 -0.216 17949 24 1 . 1 1 24 24 LYS H H 24 9.212 9.212 8.724 0.488 17949 25 1 . 1 1 25 25 SER HA H 25 4.440 4.440 4.320 0.120 17949 26 1 . 1 1 25 25 SER H H 25 8.024 8.024 8.160 -0.136 17949 27 1 . 1 1 26 26 THR HA H 26 4.513 4.513 4.455 0.058 17949 28 1 . 1 1 26 26 THR H H 26 7.595 7.595 7.857 -0.262 17949 29 1 . 1 1 27 27 GLY H H 27 8.388 8.388 8.361 0.027 17949 30 1 . 1 1 28 28 CYS HA H 28 4.951 4.951 4.793 0.158 17949 31 1 . 1 1 28 28 CYS H H 28 8.131 8.131 8.196 -0.065 17949 32 1 . 1 1 29 29 LYS HA H 29 4.583 4.583 4.607 -0.024 17949 33 1 . 1 1 29 29 LYS H H 29 8.302 8.302 8.151 0.151 17949 34 1 . 1 1 31 31 GLU HA H 31 4.657 4.657 4.334 0.323 17949 35 1 . 1 1 31 31 GLU H H 31 8.299 8.299 7.987 0.311 17949 36 1 . 1 1 32 32 CYS HA H 32 4.831 4.831 4.660 0.171 17949 37 1 . 1 1 32 32 CYS H H 32 8.157 8.157 8.639 -0.482 17949 38 1 . 1 1 33 33 LEU H H 33 8.495 8.495 8.493 0.002 17949 39 1 . 1 1 34 34 LYS H H 34 8.445 8.445 7.911 0.534 17949 40 1 . 1 1 35 35 LEU HA H 35 3.627 3.627 4.370 -0.743 17949 41 1 . 1 1 35 35 LEU H H 35 8.229 8.229 8.469 -0.240 17949 42 1 . 1 1 36 36 GLY H H 36 9.039 9.039 8.352 0.687 17949 43 1 . 1 1 37 37 ASP HA H 37 4.620 4.620 4.642 -0.022 17949 44 1 . 1 1 37 37 ASP H H 37 8.511 8.511 8.356 0.155 17949 45 1 . 1 1 38 38 ASN HA H 38 4.831 4.831 4.822 0.009 17949 46 1 . 1 1 38 38 ASN H H 38 9.114 9.114 8.031 1.083 17949 47 1 . 1 1 39 39 ASP HA H 39 4.526 4.526 4.687 -0.161 17949 48 1 . 1 1 39 39 ASP H H 39 9.019 9.019 8.725 0.294 17949 49 1 . 1 1 40 40 TYR HA H 40 4.336 4.336 4.216 0.120 17949 50 1 . 1 1 40 40 TYR H H 40 8.036 8.036 8.118 -0.082 17949 51 1 . 1 1 41 41 CYS HA H 41 4.213 4.213 4.250 -0.037 17949 52 1 . 1 1 41 41 CYS H H 41 8.164 8.164 8.373 -0.209 17949 53 1 . 1 1 42 42 LEU HA H 42 3.714 3.714 4.173 -0.459 17949 54 1 . 1 1 42 42 LEU H H 42 8.236 8.236 7.869 0.367 17949 55 1 . 1 1 43 43 ARG HA H 43 3.864 3.864 4.179 -0.315 17949 56 1 . 1 1 43 43 ARG H H 43 8.018 8.018 7.694 0.324 17949 57 1 . 1 1 44 44 GLU HA H 44 3.869 3.869 4.205 -0.336 17949 58 1 . 1 1 44 44 GLU H H 44 8.325 8.325 7.814 0.511 17949 59 1 . 1 1 45 45 CYS HA H 45 4.338 4.338 4.436 -0.098 17949 60 1 . 1 1 45 45 CYS H H 45 8.666 8.666 7.520 1.146 17949 61 1 . 1 1 46 46 LYS H H 46 7.959 7.959 7.728 0.231 17949 62 1 . 1 1 47 47 GLN HA H 47 3.904 3.904 4.217 -0.313 17949 63 1 . 1 1 47 47 GLN H H 47 8.230 8.230 8.023 0.207 17949 64 1 . 1 1 48 48 GLN HA H 48 4.108 4.108 4.178 -0.070 17949 65 1 . 1 1 48 48 GLN H H 48 7.614 7.614 8.308 -0.694 17949 66 1 . 1 1 49 49 TYR HA H 49 4.955 4.955 4.540 0.415 17949 67 1 . 1 1 49 49 TYR H H 49 8.260 8.260 7.870 0.390 17949 68 1 . 1 1 50 50 GLY H H 50 7.705 7.705 7.795 -0.090 17949 69 1 . 1 1 51 51 LYS HA H 51 3.883 3.883 4.244 -0.361 17949 70 1 . 1 1 51 51 LYS H H 51 8.621 8.621 8.400 0.221 17949 71 1 . 1 1 52 52 SER HA H 52 4.510 4.510 4.369 0.141 17949 72 1 . 1 1 52 52 SER H H 52 8.436 8.436 8.332 0.104 17949 73 1 . 1 1 53 53 SER HA H 53 4.637 4.637 4.483 0.154 17949 74 1 . 1 1 53 53 SER H H 53 7.884 7.884 7.622 0.262 17949 75 1 . 1 1 54 54 GLY H H 54 7.890 7.890 7.998 -0.108 17949 76 1 . 1 1 55 55 GLY H H 55 7.893 7.893 7.887 0.006 17949 77 1 . 1 1 56 56 TYR HA H 56 4.818 4.818 4.898 -0.080 17949 78 1 . 1 1 56 56 TYR H H 56 8.939 8.939 8.242 0.697 17949 79 1 . 1 1 57 57 CYS HA H 57 5.202 5.202 4.756 0.446 17949 80 1 . 1 1 57 57 CYS H H 57 9.281 9.281 9.079 0.202 17949 81 1 . 1 1 58 58 TYR HA H 58 4.930 4.930 4.323 0.607 17949 82 1 . 1 1 58 58 TYR H H 58 9.406 9.406 8.150 1.256 17949 83 1 . 1 1 59 59 ALA HA H 59 3.434 3.434 3.962 -0.528 17949 84 1 . 1 1 59 59 ALA H H 59 8.977 8.977 8.374 0.603 17949 85 1 . 1 1 60 60 PHE HA H 60 4.109 4.109 4.317 -0.208 17949 86 1 . 1 1 61 61 ALA HA H 61 5.460 5.460 4.499 0.961 17949 87 1 . 1 1 61 61 ALA H H 61 8.089 8.089 7.788 0.301 17949 88 1 . 1 1 62 62 CYS HA H 62 5.270 5.270 4.370 0.900 17949 89 1 . 1 1 62 62 CYS H H 62 8.706 8.706 8.653 0.053 17949 90 1 . 1 1 63 63 TRP HA H 63 4.623 4.623 4.443 0.180 17949 91 1 . 1 1 63 63 TRP H H 63 9.739 9.739 8.452 1.287 17949 92 1 . 1 1 64 64 CYS HA H 64 5.608 5.608 4.492 1.116 17949 93 1 . 1 1 64 64 CYS H H 64 8.649 8.649 7.860 0.789 17949 94 1 . 1 1 65 65 THR HA H 65 4.591 4.591 4.382 0.209 17949 95 1 . 1 1 65 65 THR H H 65 7.937 7.937 8.374 -0.437 17949 96 1 . 1 1 66 66 HIS HA H 66 4.010 4.010 4.266 -0.256 17949 97 1 . 1 1 66 66 HIS H H 66 8.755 8.755 8.516 0.239 17949 98 1 . 1 1 67 67 LEU HA H 67 4.176 4.176 4.283 -0.107 17949 99 1 . 1 1 67 67 LEU H H 67 8.492 8.492 7.653 0.839 17949 100 1 . 1 1 68 68 TYR HA H 68 4.548 4.548 4.509 0.039 17949 101 1 . 1 1 68 68 TYR H H 68 7.880 7.880 8.233 -0.353 17949 102 1 . 1 1 69 69 GLU HA H 69 3.766 3.766 4.112 -0.346 17949 103 1 . 1 1 69 69 GLU H H 69 8.787 8.787 8.678 0.109 17949 104 1 . 1 1 70 70 GLN HA H 70 4.256 4.256 4.237 0.019 17949 105 1 . 1 1 70 70 GLN H H 70 7.925 7.925 8.203 -0.278 17949 106 1 . 1 1 71 71 ALA HA H 71 4.045 4.045 4.201 -0.156 17949 107 1 . 1 1 71 71 ALA H H 71 7.490 7.490 7.503 -0.013 17949 108 1 . 1 1 72 72 VAL HA H 72 4.148 4.148 4.085 0.063 17949 109 1 . 1 1 72 72 VAL H H 72 8.532 8.532 8.185 0.347 17949 110 1 . 1 1 73 73 VAL HA H 73 4.616 4.616 4.495 0.120 17949 111 1 . 1 1 73 73 VAL H H 73 8.092 8.092 7.914 0.178 17949 112 1 . 1 1 74 74 TRP HA H 74 4.097 4.097 4.976 -0.879 17949 113 1 . 1 1 74 74 TRP H H 74 8.500 8.500 8.417 0.083 17949 114 1 . 1 1 76 76 LEU HA H 76 1.829 1.829 4.437 -2.608 17949 115 1 . 1 1 77 77 PRO HA H 77 4.199 4.199 4.364 -0.165 17949 116 1 . 1 1 78 78 ASN HA H 78 4.635 4.635 4.658 -0.023 17949 117 1 . 1 1 78 78 ASN H H 78 8.235 8.235 8.379 -0.144 17949 118 1 . 1 1 79 79 LYS HA H 79 4.592 4.592 4.363 0.229 17949 119 1 . 1 1 79 79 LYS H H 79 7.039 7.039 7.786 -0.747 17949 120 1 . 1 1 80 80 THR HA H 80 4.427 4.427 4.399 0.028 17949 121 1 . 1 1 80 80 THR H H 80 8.483 8.483 8.038 0.445 17949 122 1 . 1 1 81 81 CYS HA H 81 4.635 4.635 4.386 0.249 17949 123 1 . 1 1 81 81 CYS H H 81 8.835 8.835 8.662 0.173 17949 stop_ save_