NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
624346 | 5x0s | 36047 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 GLU 1 H1 GLU 1 0.142 -28.662 12.776 2 H2 GLU 1 H2 GLU 1 1.623 -29.449 13.048 3 H3 GLU 1 H3 GLU 1 1.401 -28.511 11.650 4 HA GLU 1 HA GLU 1 0.964 -27.110 14.145 5 HB2 GLU 1 HB2 GLU 1 3.655 -28.232 13.335 6 HB3 GLU 1 HB1 GLU 1 3.491 -26.821 14.382 7 HG2 GLU 1 HG2 GLU 1 2.156 -28.136 15.972 8 HG3 GLU 1 HG1 GLU 1 2.277 -29.547 14.922 9 H VAL 2 H VAL 2 0.657 -27.141 11.077 10 HA VAL 2 HA VAL 2 1.843 -24.468 10.640 11 HB VAL 2 HB VAL 2 1.963 -25.154 8.191 12 HG11 VAL 2 HG11 VAL 2 4.015 -26.728 8.753 13 HG12 VAL 2 HG12 VAL 2 3.661 -26.242 10.411 14 HG13 VAL 2 HG13 VAL 2 4.055 -25.023 9.200 15 HG21 VAL 2 HG21 VAL 2 0.453 -27.212 8.728 16 HG22 VAL 2 HG22 VAL 2 1.949 -27.968 9.275 17 HG23 VAL 2 HG23 VAL 2 1.793 -27.429 7.603 18 H ILE 3 H ILE 3 0.698 -23.266 8.856 19 HA ILE 3 HA ILE 3 -2.206 -23.731 9.106 20 HB ILE 3 HB ILE 3 -2.522 -21.482 9.231 21 HG12 ILE 3 HG12 ILE 3 -0.184 -21.243 7.317 22 HG13 ILE 3 HG11 ILE 3 -1.887 -20.930 6.980 23 HG21 ILE 3 HG21 ILE 3 0.422 -21.180 9.719 24 HG22 ILE 3 HG22 ILE 3 -0.516 -22.237 10.775 25 HG23 ILE 3 HG23 ILE 3 -0.935 -20.529 10.638 26 HD11 ILE 3 HD11 ILE 3 -0.737 -18.803 7.292 27 HD12 ILE 3 HD12 ILE 3 -0.101 -19.342 8.845 28 HD13 ILE 3 HD13 ILE 3 -1.832 -19.071 8.649 29 H LYS 4 H LYS 4 -3.456 -22.803 7.163 30 HA LYS 4 HA LYS 4 -2.104 -23.652 4.669 31 HB2 LYS 4 HB2 LYS 4 -4.008 -25.121 5.653 32 HB3 LYS 4 HB1 LYS 4 -5.076 -23.836 5.087 33 HG2 LYS 4 HG2 LYS 4 -4.318 -24.104 2.815 34 HG3 LYS 4 HG1 LYS 4 -3.037 -25.208 3.317 35 HD2 LYS 4 HD2 LYS 4 -4.450 -26.981 3.446 36 HD3 LYS 4 HD1 LYS 4 -5.732 -26.022 4.185 37 HE2 LYS 4 HE2 LYS 4 -6.136 -24.989 1.907 38 HE3 LYS 4 HE1 LYS 4 -5.030 -26.193 1.245 39 HZ1 LYS 4 HZ1 LYS 4 -7.538 -26.738 2.737 40 HZ2 LYS 4 HZ2 LYS 4 -6.448 -27.927 2.205 41 HZ3 LYS 4 HZ3 LYS 4 -7.285 -26.972 1.076 42 H LYS 5 H LYS 5 -1.713 -21.913 3.451 43 HA LYS 5 HA LYS 5 -3.771 -19.789 3.351 44 HB2 LYS 5 HB2 LYS 5 -0.763 -19.618 3.211 45 HB3 LYS 5 HB1 LYS 5 -1.808 -18.310 2.656 46 HG2 LYS 5 HG2 LYS 5 -2.285 -19.480 5.374 47 HG3 LYS 5 HG1 LYS 5 -0.945 -18.353 5.155 48 HD2 LYS 5 HD2 LYS 5 -2.329 -16.574 4.911 49 HD3 LYS 5 HD1 LYS 5 -3.444 -17.473 3.882 50 HE2 LYS 5 HE2 LYS 5 -4.468 -18.524 5.815 51 HE3 LYS 5 HE1 LYS 5 -3.271 -17.803 6.890 52 HZ1 LYS 5 HZ1 LYS 5 -5.664 -16.722 6.320 53 HZ2 LYS 5 HZ2 LYS 5 -4.661 -15.913 5.214 54 HZ3 LYS 5 HZ3 LYS 5 -4.323 -15.847 6.877 55 H ASP 6 H ASP 6 -4.902 -20.189 1.536 56 HA ASP 6 HA ASP 6 -3.368 -20.523 -0.970 57 HB2 ASP 6 HB2 ASP 6 -5.083 -21.969 -1.830 58 HB3 ASP 6 HB1 ASP 6 -4.598 -22.595 -0.255 59 H THR 7 H THR 7 -3.786 -19.083 -2.523 60 HA THR 7 HA THR 7 -5.996 -17.190 -2.082 61 HB THR 7 HB THR 7 -4.635 -15.541 -2.822 62 HG1 THR 7 HG1 THR 7 -3.913 -15.620 -4.795 63 HG21 THR 7 HG21 THR 7 -2.395 -15.849 -2.216 64 HG22 THR 7 HG22 THR 7 -2.359 -17.505 -2.821 65 HG23 THR 7 HG23 THR 7 -3.206 -17.132 -1.320 66 HA PRO 8 HA PRO 8 -7.759 -18.563 -5.933 67 HB2 PRO 8 HB2 PRO 8 -9.332 -16.496 -6.565 68 HB3 PRO 8 HB1 PRO 8 -9.557 -17.356 -5.028 69 HG2 PRO 8 HG2 PRO 8 -8.331 -14.707 -5.547 70 HG3 PRO 8 HG1 PRO 8 -9.254 -15.271 -4.146 71 HD2 PRO 8 HD2 PRO 8 -6.410 -15.132 -4.371 72 HD3 PRO 8 HD1 PRO 8 -7.348 -15.868 -3.053 73 H TYR 9 H TYR 9 -7.582 -18.470 -8.206 74 HA TYR 9 HA TYR 9 -5.962 -16.255 -9.307 75 HB2 TYR 9 HB2 TYR 9 -4.639 -18.365 -8.860 76 HB3 TYR 9 HB1 TYR 9 -5.635 -19.155 -10.083 77 HD1 TYR 9 HD1 TYR 9 -3.568 -16.062 -9.593 78 HD2 TYR 9 HD2 TYR 9 -4.955 -19.089 -12.304 79 HE1 TYR 9 HE1 TYR 9 -2.122 -15.125 -11.376 80 HE2 TYR 9 HE2 TYR 9 -3.515 -18.157 -14.086 81 HH TYR 9 HH TYR 9 -2.075 -15.113 -13.884 82 H LYS 10 H LYS 10 -8.303 -18.830 -9.902 83 HA LYS 10 HA LYS 10 -10.056 -18.922 -11.401 84 HB2 LYS 10 HB2 LYS 10 -9.969 -16.329 -11.034 85 HB3 LYS 10 HB1 LYS 10 -9.231 -16.316 -12.636 86 HG2 LYS 10 HG2 LYS 10 -11.185 -17.738 -13.425 87 HG3 LYS 10 HG1 LYS 10 -11.948 -17.408 -11.869 88 HD2 LYS 10 HD2 LYS 10 -12.033 -15.060 -12.300 89 HD3 LYS 10 HD1 LYS 10 -10.953 -15.205 -13.688 90 HE2 LYS 10 HE2 LYS 10 -12.781 -16.780 -14.660 91 HE3 LYS 10 HE1 LYS 10 -13.836 -16.051 -13.450 92 HZ1 LYS 10 HZ1 LYS 10 -13.317 -15.026 -15.900 93 HZ2 LYS 10 HZ2 LYS 10 -12.269 -14.133 -14.905 94 HZ3 LYS 10 HZ3 LYS 10 -13.937 -14.153 -14.585 95 H LYS 11 H LYS 11 -7.610 -17.061 -13.199 96 HA LYS 11 HA LYS 11 -6.141 -18.828 -14.532 97 HB2 LYS 11 HB2 LYS 11 -7.503 -19.321 -16.657 98 HB3 LYS 11 HB1 LYS 11 -7.863 -20.283 -15.227 99 HG2 LYS 11 HG2 LYS 11 -10.005 -19.588 -15.328 100 HG3 LYS 11 HG1 LYS 11 -9.462 -17.927 -15.084 101 HD2 LYS 11 HD2 LYS 11 -9.252 -17.544 -17.431 102 HD3 LYS 11 HD1 LYS 11 -9.412 -19.262 -17.796 103 HE2 LYS 11 HE2 LYS 11 -11.693 -18.370 -16.265 104 HE3 LYS 11 HE1 LYS 11 -11.481 -17.342 -17.683 105 HZ1 LYS 11 HZ1 LYS 11 -12.048 -18.991 -19.046 106 HZ2 LYS 11 HZ2 LYS 11 -12.657 -19.781 -17.671 107 HZ3 LYS 11 HZ3 LYS 11 -11.092 -20.133 -18.232 108 H ARG 12 H ARG 12 -6.105 -16.122 -14.004 109 HA ARG 12 HA ARG 12 -6.775 -14.329 -15.985 110 HB2 ARG 12 HB2 ARG 12 -4.722 -14.476 -13.890 111 HB3 ARG 12 HB1 ARG 12 -4.280 -13.450 -15.255 112 HG2 ARG 12 HG2 ARG 12 -6.034 -11.977 -14.898 113 HG3 ARG 12 HG1 ARG 12 -7.038 -13.200 -14.117 114 HD2 ARG 12 HD2 ARG 12 -5.694 -13.123 -12.114 115 HD3 ARG 12 HD1 ARG 12 -4.505 -12.083 -12.893 116 HE ARG 12 HE ARG 12 -7.167 -10.957 -12.846 117 HH11 ARG 12 HH11 ARG 12 -7.428 -9.121 -11.536 118 HH12 ARG 12 HH12 ARG 12 -6.216 -8.718 -10.366 119 HH21 ARG 12 HH21 ARG 12 -4.187 -11.420 -11.149 120 HH22 ARG 12 HH22 ARG 12 -4.380 -10.021 -10.146 121 H LYS 13 H LYS 13 -6.489 -14.544 -18.111 122 HA LYS 13 HA LYS 13 -5.520 -15.002 -20.146 123 HB2 LYS 13 HB2 LYS 13 -2.928 -14.427 -18.699 124 HB3 LYS 13 HB1 LYS 13 -3.249 -14.261 -20.426 125 HG2 LYS 13 HG2 LYS 13 -4.883 -12.490 -19.979 126 HG3 LYS 13 HG1 LYS 13 -4.640 -12.681 -18.242 127 HD2 LYS 13 HD2 LYS 13 -2.277 -12.130 -20.012 128 HD3 LYS 13 HD1 LYS 13 -3.331 -10.800 -19.531 129 HE2 LYS 13 HE2 LYS 13 -2.062 -12.741 -17.579 130 HE3 LYS 13 HE1 LYS 13 -1.388 -11.160 -17.975 131 HZ1 LYS 13 HZ1 LYS 13 -4.191 -11.155 -17.257 132 HZ2 LYS 13 HZ2 LYS 13 -2.943 -10.102 -16.785 133 HZ3 LYS 13 HZ3 LYS 13 -3.139 -11.596 -16.001 134 H PHE 14 H PHE 14 -2.469 -15.945 -19.677 135 HA PHE 14 HA PHE 14 -3.181 -18.790 -19.851 136 HB2 PHE 14 HB2 PHE 14 -1.040 -17.091 -20.929 137 HB3 PHE 14 HB1 PHE 14 -0.476 -18.642 -20.307 138 HD1 PHE 14 HD1 PHE 14 -3.785 -17.823 -21.828 139 HD2 PHE 14 HD2 PHE 14 -0.052 -19.903 -22.267 140 HE1 PHE 14 HE1 PHE 14 -4.654 -18.954 -23.857 141 HE2 PHE 14 HE2 PHE 14 -0.922 -21.035 -24.295 142 HZ PHE 14 HZ PHE 14 -3.222 -20.560 -25.090 143 HA PRO 15 HA PRO 15 -1.714 -20.036 -15.921 144 HB2 PRO 15 HB2 PRO 15 0.208 -21.959 -16.683 145 HB3 PRO 15 HB1 PRO 15 -1.513 -22.252 -16.381 146 HG2 PRO 15 HG2 PRO 15 -0.075 -21.919 -18.940 147 HG3 PRO 15 HG1 PRO 15 -1.523 -22.867 -18.567 148 HD2 PRO 15 HD2 PRO 15 -1.643 -20.526 -19.941 149 HD3 PRO 15 HD1 PRO 15 -2.950 -21.057 -18.857 150 H TYR 16 H TYR 16 -0.415 -18.858 -14.646 151 HA TYR 16 HA TYR 16 2.289 -18.178 -15.634 152 HB2 TYR 16 HB2 TYR 16 0.178 -16.515 -14.668 153 HB3 TYR 16 HB1 TYR 16 1.501 -16.449 -13.506 154 HD1 TYR 16 HD1 TYR 16 3.687 -15.567 -14.124 155 HD2 TYR 16 HD2 TYR 16 0.497 -15.789 -16.991 156 HE1 TYR 16 HE1 TYR 16 4.960 -14.088 -15.654 157 HE2 TYR 16 HE2 TYR 16 1.770 -14.310 -18.522 158 HH TYR 16 HH TYR 16 5.033 -13.654 -18.149 159 H LYS 17 H LYS 17 0.375 -19.119 -12.810 160 HA LYS 17 HA LYS 17 0.960 -20.240 -10.895 161 HB2 LYS 17 HB2 LYS 17 3.678 -20.631 -12.160 162 HB3 LYS 17 HB1 LYS 17 2.938 -21.590 -10.879 163 HG2 LYS 17 HG2 LYS 17 1.345 -22.539 -12.345 164 HG3 LYS 17 HG1 LYS 17 1.625 -21.311 -13.579 165 HD2 LYS 17 HD2 LYS 17 3.291 -22.515 -14.499 166 HD3 LYS 17 HD1 LYS 17 4.090 -22.700 -12.938 167 HE2 LYS 17 HE2 LYS 17 1.850 -24.411 -14.050 168 HE3 LYS 17 HE1 LYS 17 3.514 -24.908 -13.746 169 HZ1 LYS 17 HZ1 LYS 17 2.971 -24.120 -11.350 170 HZ2 LYS 17 HZ2 LYS 17 2.457 -25.653 -11.872 171 HZ3 LYS 17 HZ3 LYS 17 1.360 -24.357 -11.825 172 H SER 18 H SER 18 3.811 -18.418 -12.050 173 HA SER 18 HA SER 18 4.663 -17.659 -9.448 174 HB2 SER 18 HB2 SER 18 6.409 -16.662 -10.518 175 HB3 SER 18 HB1 SER 18 5.827 -17.609 -11.884 176 HG SER 18 HG SER 18 4.393 -15.639 -12.177 177 H GLU 19 H GLU 19 2.460 -16.244 -11.782 178 HA GLU 19 HA GLU 19 2.302 -13.661 -10.573 179 HB2 GLU 19 HB2 GLU 19 1.618 -14.116 -12.915 180 HB3 GLU 19 HB1 GLU 19 0.268 -15.078 -12.313 181 HG2 GLU 19 HG2 GLU 19 -0.959 -13.212 -12.080 182 HG3 GLU 19 HG1 GLU 19 0.227 -12.577 -10.941 183 H CYS 20 H CYS 20 0.802 -16.742 -9.989 184 HA CYS 20 HA CYS 20 -1.252 -15.619 -8.252 185 HB2 CYS 20 HB2 CYS 20 -2.248 -17.679 -8.330 186 HB3 CYS 20 HB1 CYS 20 -1.291 -17.805 -9.804 187 H LEU 21 H LEU 21 1.549 -17.804 -7.929 188 HA LEU 21 HA LEU 21 1.503 -18.152 -5.172 189 HB2 LEU 21 HB2 LEU 21 3.042 -19.381 -6.625 190 HB3 LEU 21 HB1 LEU 21 3.920 -17.892 -6.981 191 HG LEU 21 HG LEU 21 4.438 -17.646 -4.564 192 HD11 LEU 21 HD11 LEU 21 4.066 -19.877 -3.248 193 HD12 LEU 21 HD12 LEU 21 2.811 -20.176 -4.451 194 HD13 LEU 21 HD13 LEU 21 2.718 -18.751 -3.415 195 HD21 LEU 21 HD21 LEU 21 6.308 -18.900 -4.849 196 HD22 LEU 21 HD22 LEU 21 5.609 -19.348 -6.405 197 HD23 LEU 21 HD23 LEU 21 5.382 -20.393 -5.003 198 H LYS 22 H LYS 22 2.652 -15.462 -7.103 199 HA LYS 22 HA LYS 22 4.028 -14.047 -5.083 200 HB2 LYS 22 HB2 LYS 22 4.275 -13.488 -7.448 201 HB3 LYS 22 HB1 LYS 22 2.574 -13.033 -7.539 202 HG2 LYS 22 HG2 LYS 22 2.914 -11.202 -5.991 203 HG3 LYS 22 HG1 LYS 22 4.576 -11.714 -5.686 204 HD2 LYS 22 HD2 LYS 22 4.726 -11.482 -8.349 205 HD3 LYS 22 HD1 LYS 22 3.425 -10.326 -8.064 206 HE2 LYS 22 HE2 LYS 22 4.782 -9.017 -6.593 207 HE3 LYS 22 HE1 LYS 22 6.019 -10.272 -6.510 208 HZ1 LYS 22 HZ1 LYS 22 5.657 -8.215 -8.452 209 HZ2 LYS 22 HZ2 LYS 22 5.737 -9.749 -9.179 210 HZ3 LYS 22 HZ3 LYS 22 7.001 -9.213 -8.179 211 H ALA 23 H ALA 23 0.636 -14.186 -6.036 212 HA ALA 23 HA ALA 23 -0.349 -12.005 -4.583 213 HB1 ALA 23 HB1 ALA 23 -1.685 -14.666 -5.143 214 HB2 ALA 23 HB2 ALA 23 -1.718 -13.248 -6.192 215 HB3 ALA 23 HB3 ALA 23 -2.511 -13.199 -4.618 216 H CYS 24 H CYS 24 0.530 -15.250 -3.580 217 HA CYS 24 HA CYS 24 -0.642 -15.126 -0.981 218 HB2 CYS 24 HB2 CYS 24 0.751 -17.041 -2.533 219 HB3 CYS 24 HB1 CYS 24 1.661 -16.843 -1.036 220 H ALA 25 H ALA 25 2.726 -14.759 -2.114 221 HA ALA 25 HA ALA 25 3.734 -13.961 0.429 222 HB1 ALA 25 HB1 ALA 25 5.527 -14.599 -0.807 223 HB2 ALA 25 HB2 ALA 25 5.523 -12.920 -1.346 224 HB3 ALA 25 HB3 ALA 25 4.755 -14.164 -2.332 225 H THR 26 H THR 26 2.248 -12.289 -2.243 226 HA THR 26 HA THR 26 2.945 -9.662 -1.158 227 HB THR 26 HB THR 26 1.492 -10.558 -3.651 228 HG1 THR 26 HG1 THR 26 3.332 -9.155 -4.427 229 HG21 THR 26 HG21 THR 26 0.338 -8.580 -2.962 230 HG22 THR 26 HG22 THR 26 1.499 -8.070 -4.189 231 HG23 THR 26 HG23 THR 26 1.840 -7.792 -2.481 232 H SER 27 H SER 27 0.326 -11.936 -1.231 233 HA SER 27 HA SER 27 -1.950 -10.496 -0.872 234 HB2 SER 27 HB2 SER 27 -0.958 -13.063 0.204 235 HB3 SER 27 HB1 SER 27 -2.297 -12.341 1.091 236 HG SER 27 HG SER 27 -3.346 -12.122 -0.990 237 H PHE 28 H PHE 28 0.785 -10.629 1.264 238 HA PHE 28 HA PHE 28 -0.288 -8.441 2.830 239 HB2 PHE 28 HB2 PHE 28 -0.919 -10.912 3.777 240 HB3 PHE 28 HB1 PHE 28 0.631 -10.637 4.575 241 HD1 PHE 28 HD1 PHE 28 -2.428 -8.635 3.699 242 HD2 PHE 28 HD2 PHE 28 0.526 -9.614 6.660 243 HE1 PHE 28 HE1 PHE 28 -3.524 -7.093 5.302 244 HE2 PHE 28 HE2 PHE 28 -0.570 -8.072 8.263 245 HZ PHE 28 HZ PHE 28 -2.594 -6.811 7.584 246 H THR 29 H THR 29 1.315 -7.532 4.293 247 HA THR 29 HA THR 29 4.065 -8.468 3.962 248 HB THR 29 HB THR 29 3.457 -5.581 3.379 249 HG1 THR 29 HG1 THR 29 3.528 -7.772 1.585 250 HG21 THR 29 HG21 THR 29 5.725 -7.436 2.605 251 HG22 THR 29 HG22 THR 29 5.772 -6.276 3.932 252 HG23 THR 29 HG23 THR 29 5.639 -5.707 2.268 253 H GLY 30 H GLY 30 5.416 -7.860 5.625 254 HA2 GLY 30 HA2 GLY 30 5.372 -5.840 7.403 255 HA3 GLY 30 HA1 GLY 30 4.105 -6.891 8.029 256 H GLY 31 H GLY 31 4.812 -9.292 8.133 257 HA2 GLY 31 HA2 GLY 31 7.289 -9.365 9.681 258 HA3 GLY 31 HA1 GLY 31 6.070 -10.634 9.598 259 H ASP 32 H ASP 32 8.944 -10.919 9.309 260 HA ASP 32 HA ASP 32 9.849 -11.144 6.687 261 HB2 ASP 32 HB2 ASP 32 10.502 -12.982 9.001 262 HB3 ASP 32 HB1 ASP 32 11.468 -12.757 7.544 263 H GLU 33 H GLU 33 7.859 -11.833 5.585 264 HA GLU 33 HA GLU 33 6.556 -13.400 4.519 265 HB2 GLU 33 HB2 GLU 33 8.994 -15.083 5.130 266 HB3 GLU 33 HB1 GLU 33 7.686 -15.579 4.055 267 HG2 GLU 33 HG2 GLU 33 8.086 -13.600 2.643 268 HG3 GLU 33 HG1 GLU 33 9.390 -13.094 3.715 269 H SER 34 H SER 34 7.143 -13.517 7.744 270 HA SER 34 HA SER 34 6.278 -16.004 8.629 271 HB2 SER 34 HB2 SER 34 5.135 -13.807 10.179 272 HB3 SER 34 HB1 SER 34 6.312 -15.026 10.659 273 HG SER 34 HG SER 34 7.822 -13.612 10.333 274 H ARG 35 H ARG 35 4.713 -16.829 7.276 275 HA ARG 35 HA ARG 35 2.120 -16.895 7.906 276 HB2 ARG 35 HB2 ARG 35 2.701 -14.316 6.573 277 HB3 ARG 35 HB1 ARG 35 1.306 -15.194 5.948 278 HG2 ARG 35 HG2 ARG 35 0.127 -15.020 7.918 279 HG3 ARG 35 HG1 ARG 35 1.582 -15.014 8.913 280 HD2 ARG 35 HD2 ARG 35 0.753 -12.801 9.064 281 HD3 ARG 35 HD1 ARG 35 2.062 -12.699 7.892 282 HE ARG 35 HE ARG 35 0.476 -12.304 6.211 283 HH11 ARG 35 HH11 ARG 35 -1.624 -11.727 5.563 284 HH12 ARG 35 HH12 ARG 35 -2.951 -11.938 6.657 285 HH21 ARG 35 HH21 ARG 35 -0.985 -13.221 9.209 286 HH22 ARG 35 HH22 ARG 35 -2.588 -12.783 8.723 287 H ILE 36 H ILE 36 4.546 -16.783 5.495 288 HA ILE 36 HA ILE 36 3.169 -18.904 4.000 289 HB ILE 36 HB ILE 36 4.670 -16.848 2.432 290 HG12 ILE 36 HG12 ILE 36 3.015 -15.626 3.921 291 HG13 ILE 36 HG11 ILE 36 2.715 -15.452 2.193 292 HG21 ILE 36 HG21 ILE 36 3.903 -18.916 1.364 293 HG22 ILE 36 HG22 ILE 36 3.004 -17.539 0.725 294 HG23 ILE 36 HG23 ILE 36 2.256 -18.608 1.912 295 HD11 ILE 36 HD11 ILE 36 0.714 -16.483 2.345 296 HD12 ILE 36 HD12 ILE 36 0.875 -16.335 4.095 297 HD13 ILE 36 HD13 ILE 36 1.396 -17.812 3.282 298 H GLN 37 H GLN 37 6.164 -16.990 3.663 299 HA GLN 37 HA GLN 37 8.368 -17.622 3.622 300 HB2 GLN 37 HB2 GLN 37 7.101 -19.364 5.556 301 HB3 GLN 37 HB1 GLN 37 8.405 -20.201 4.716 302 HG2 GLN 37 HG2 GLN 37 9.959 -18.395 5.251 303 HG3 GLN 37 HG1 GLN 37 8.663 -17.474 6.011 304 HE21 GLN 37 HE21 GLN 37 7.366 -19.420 7.544 305 HE22 GLN 37 HE22 GLN 37 8.440 -20.051 8.697 306 H GLU 38 H GLU 38 5.988 -20.042 2.661 307 HA GLU 38 HA GLU 38 7.338 -20.478 0.164 308 HB2 GLU 38 HB2 GLU 38 8.640 -21.949 1.692 309 HB3 GLU 38 HB1 GLU 38 7.157 -22.820 2.072 310 HG2 GLU 38 HG2 GLU 38 6.912 -23.147 -0.471 311 HG3 GLU 38 HG1 GLU 38 8.597 -22.638 -0.576 312 H GLY 39 H GLY 39 5.991 -21.351 -1.355 313 HA2 GLY 39 HA2 GLY 39 3.519 -22.659 -0.621 314 HA3 GLY 39 HA1 GLY 39 3.296 -21.033 -1.260 315 H LYS 40 H LYS 40 2.199 -23.196 -2.568 316 HA LYS 40 HA LYS 40 3.927 -23.462 -4.948 317 HB2 LYS 40 HB2 LYS 40 2.377 -25.431 -3.428 318 HB3 LYS 40 HB1 LYS 40 2.070 -25.483 -5.165 319 HG2 LYS 40 HG2 LYS 40 4.367 -25.839 -5.666 320 HG3 LYS 40 HG1 LYS 40 4.868 -25.400 -4.033 321 HD2 LYS 40 HD2 LYS 40 4.146 -27.422 -3.121 322 HD3 LYS 40 HD1 LYS 40 2.993 -27.713 -4.423 323 HE2 LYS 40 HE2 LYS 40 5.333 -29.011 -4.297 324 HE3 LYS 40 HE1 LYS 40 4.593 -28.574 -5.837 325 HZ1 LYS 40 HZ1 LYS 40 6.016 -26.358 -4.964 326 HZ2 LYS 40 HZ2 LYS 40 6.382 -27.375 -6.276 327 HZ3 LYS 40 HZ3 LYS 40 7.037 -27.694 -4.741 328 HA PRO 41 HA PRO 41 0.422 -21.771 -7.135 329 HB2 PRO 41 HB2 PRO 41 1.102 -22.286 -9.647 330 HB3 PRO 41 HB1 PRO 41 2.203 -21.350 -8.612 331 HG2 PRO 41 HG2 PRO 41 2.374 -24.189 -9.471 332 HG3 PRO 41 HG1 PRO 41 3.660 -23.005 -9.209 333 HD2 PRO 41 HD2 PRO 41 2.782 -24.987 -7.354 334 HD3 PRO 41 HD1 PRO 41 3.918 -23.657 -7.041 335 H GLY 42 H GLY 42 -1.347 -22.238 -8.636 336 HA2 GLY 42 HA2 GLY 42 -1.952 -24.969 -9.368 337 HA3 GLY 42 HA1 GLY 42 -2.972 -24.331 -8.079 338 H PHE 43 H PHE 43 -3.903 -25.102 -10.678 339 HA PHE 43 HA PHE 43 -4.340 -22.660 -12.188 340 HB2 PHE 43 HB2 PHE 43 -5.422 -24.017 -13.788 341 HB3 PHE 43 HB1 PHE 43 -4.129 -25.040 -13.159 342 HD1 PHE 43 HD1 PHE 43 -4.687 -26.646 -11.239 343 HD2 PHE 43 HD2 PHE 43 -7.680 -24.686 -13.615 344 HE1 PHE 43 HE1 PHE 43 -6.364 -28.318 -10.505 345 HE2 PHE 43 HE2 PHE 43 -9.358 -26.359 -12.882 346 HZ PHE 43 HZ PHE 43 -8.699 -28.175 -11.326 347 H PHE 44 H PHE 44 -6.071 -21.341 -12.030 348 HA PHE 44 HA PHE 44 -8.130 -20.525 -11.380 349 HB2 PHE 44 HB2 PHE 44 -8.580 -23.262 -11.769 350 HB3 PHE 44 HB1 PHE 44 -9.263 -22.907 -10.186 351 HD1 PHE 44 HD1 PHE 44 -9.566 -22.397 -13.785 352 HD2 PHE 44 HD2 PHE 44 -10.993 -21.120 -9.939 353 HE1 PHE 44 HE1 PHE 44 -11.531 -21.337 -14.865 354 HE2 PHE 44 HE2 PHE 44 -12.956 -20.060 -11.020 355 HZ PHE 44 HZ PHE 44 -13.226 -20.169 -13.483 356 H LYS 45 H LYS 45 -5.797 -21.776 -9.471 357 HA LYS 45 HA LYS 45 -6.401 -20.222 -7.216 358 HB2 LYS 45 HB2 LYS 45 -7.171 -21.771 -5.617 359 HB3 LYS 45 HB1 LYS 45 -8.172 -22.078 -7.031 360 HG2 LYS 45 HG2 LYS 45 -6.477 -23.870 -7.681 361 HG3 LYS 45 HG1 LYS 45 -5.787 -23.671 -6.069 362 HD2 LYS 45 HD2 LYS 45 -7.306 -25.267 -5.488 363 HD3 LYS 45 HD1 LYS 45 -8.432 -23.910 -5.458 364 HE2 LYS 45 HE2 LYS 45 -9.396 -25.689 -6.808 365 HE3 LYS 45 HE1 LYS 45 -8.950 -24.352 -7.868 366 HZ1 LYS 45 HZ1 LYS 45 -6.953 -26.430 -7.377 367 HZ2 LYS 45 HZ2 LYS 45 -7.244 -25.512 -8.777 368 HZ3 LYS 45 HZ3 LYS 45 -8.256 -26.821 -8.390 369 H CYS 46 H CYS 46 -4.958 -20.850 -5.324 370 HA CYS 46 HA CYS 46 -2.673 -22.514 -6.035 371 HB2 CYS 46 HB2 CYS 46 -2.499 -19.526 -5.644 372 HB3 CYS 46 HB1 CYS 46 -1.111 -20.590 -5.411 373 H THR 47 H THR 47 -1.729 -23.410 -4.271 374 HA THR 47 HA THR 47 -2.832 -22.583 -1.653 375 HB THR 47 HB THR 47 -2.108 -24.911 -0.943 376 HG1 THR 47 HG1 THR 47 -1.546 -26.315 -2.507 377 HG21 THR 47 HG21 THR 47 -4.377 -24.904 -1.192 378 HG22 THR 47 HG22 THR 47 -4.007 -25.898 -2.601 379 HG23 THR 47 HG23 THR 47 -4.300 -24.170 -2.794 380 H CYS 48 H CYS 48 -1.520 -21.977 -0.043 381 HA CYS 48 HA CYS 48 1.389 -22.249 -0.458 382 HB2 CYS 48 HB2 CYS 48 0.370 -19.924 1.090 383 HB3 CYS 48 HB1 CYS 48 1.779 -20.047 0.038 384 H TYR 49 H TYR 49 2.627 -22.067 1.625 385 HA TYR 49 HA TYR 49 1.053 -22.943 3.961 386 HB2 TYR 49 HB2 TYR 49 3.580 -24.302 2.992 387 HB3 TYR 49 HB1 TYR 49 2.641 -24.733 4.421 388 HD1 TYR 49 HD1 TYR 49 0.997 -26.387 4.229 389 HD2 TYR 49 HD2 TYR 49 2.209 -24.206 0.733 390 HE1 TYR 49 HE1 TYR 49 -0.467 -27.818 2.829 391 HE2 TYR 49 HE2 TYR 49 0.745 -25.637 -0.667 392 HH TYR 49 HH TYR 49 -1.164 -28.282 0.778 393 H PHE 50 H PHE 50 1.973 -22.407 5.962 394 HA PHE 50 HA PHE 50 4.070 -20.359 5.782 395 HB2 PHE 50 HB2 PHE 50 2.082 -19.596 6.896 396 HB3 PHE 50 HB1 PHE 50 2.042 -21.022 7.923 397 HD1 PHE 50 HD1 PHE 50 1.913 -19.408 9.847 398 HD2 PHE 50 HD2 PHE 50 5.360 -19.627 7.284 399 HE1 PHE 50 HE1 PHE 50 3.263 -18.221 11.551 400 HE2 PHE 50 HE2 PHE 50 6.701 -18.444 8.991 401 HZ PHE 50 HZ PHE 50 5.656 -17.740 11.125 402 H THR 51 H THR 51 5.994 -21.441 5.805 403 HA THR 51 HA THR 51 6.599 -23.790 7.187 404 HB THR 51 HB THR 51 8.567 -21.561 6.644 405 HG1 THR 51 HG1 THR 51 8.123 -21.868 4.634 406 HG21 THR 51 HG21 THR 51 10.077 -23.087 7.305 407 HG22 THR 51 HG22 THR 51 9.496 -24.202 6.068 408 HG23 THR 51 HG23 THR 51 8.772 -24.215 7.676 409 H THR 52 H THR 52 5.618 -23.591 9.262 410 HA THR 52 HA THR 52 7.323 -22.144 11.181 411 HB THR 52 HB THR 52 4.581 -22.209 12.090 412 HG1 THR 52 HG1 THR 52 4.951 -20.532 9.877 413 HG21 THR 52 HG21 THR 52 6.500 -19.958 11.429 414 HG22 THR 52 HG22 THR 52 6.349 -20.761 12.991 415 HG23 THR 52 HG23 THR 52 5.016 -19.789 12.367 416 H GLY 53 H GLY 53 7.991 -23.412 12.790 417 HA2 GLY 53 HA2 GLY 53 6.829 -25.062 14.487 418 HA3 GLY 53 HA1 GLY 53 6.829 -26.089 13.056 Start of MODEL 2 1 H1 GLU 1 H1 GLU 1 -0.317 -30.149 9.894 2 H2 GLU 1 H2 GLU 1 -1.583 -31.262 10.109 3 H3 GLU 1 H3 GLU 1 -1.426 -29.936 11.160 4 HA GLU 1 HA GLU 1 -2.467 -30.039 8.428 5 HB2 GLU 1 HB2 GLU 1 -3.145 -28.638 11.020 6 HB3 GLU 1 HB1 GLU 1 -3.933 -28.228 9.495 7 HG2 GLU 1 HG2 GLU 1 -5.204 -30.098 9.528 8 HG3 GLU 1 HG1 GLU 1 -3.838 -31.115 9.983 9 H VAL 2 H VAL 2 -0.134 -28.382 10.345 10 HA VAL 2 HA VAL 2 0.849 -26.261 10.097 11 HB VAL 2 HB VAL 2 1.687 -26.510 7.440 12 HG11 VAL 2 HG11 VAL 2 2.778 -27.384 10.113 13 HG12 VAL 2 HG12 VAL 2 3.260 -26.004 9.125 14 HG13 VAL 2 HG13 VAL 2 3.699 -27.639 8.631 15 HG21 VAL 2 HG21 VAL 2 1.276 -29.217 8.750 16 HG22 VAL 2 HG22 VAL 2 2.292 -28.941 7.336 17 HG23 VAL 2 HG23 VAL 2 0.555 -28.662 7.240 18 H ILE 3 H ILE 3 -0.565 -24.585 10.129 19 HA ILE 3 HA ILE 3 -2.647 -23.797 8.736 20 HB ILE 3 HB ILE 3 -1.853 -22.163 10.189 21 HG12 ILE 3 HG12 ILE 3 -0.958 -21.013 7.536 22 HG13 ILE 3 HG11 ILE 3 -2.660 -21.265 7.929 23 HG21 ILE 3 HG21 ILE 3 0.434 -21.197 10.017 24 HG22 ILE 3 HG22 ILE 3 0.770 -22.281 8.667 25 HG23 ILE 3 HG23 ILE 3 0.471 -22.942 10.274 26 HD11 ILE 3 HD11 ILE 3 -1.390 -18.963 8.487 27 HD12 ILE 3 HD12 ILE 3 -1.005 -19.850 9.961 28 HD13 ILE 3 HD13 ILE 3 -2.688 -19.590 9.502 29 H LYS 4 H LYS 4 -3.283 -23.189 6.731 30 HA LYS 4 HA LYS 4 -1.225 -23.017 4.617 31 HB2 LYS 4 HB2 LYS 4 -2.782 -24.236 3.113 32 HB3 LYS 4 HB1 LYS 4 -2.242 -25.226 4.469 33 HG2 LYS 4 HG2 LYS 4 -4.363 -25.505 5.163 34 HG3 LYS 4 HG1 LYS 4 -4.596 -23.759 5.244 35 HD2 LYS 4 HD2 LYS 4 -5.322 -23.640 2.987 36 HD3 LYS 4 HD1 LYS 4 -4.715 -25.257 2.625 37 HE2 LYS 4 HE2 LYS 4 -6.983 -24.640 4.541 38 HE3 LYS 4 HE1 LYS 4 -7.184 -25.237 2.895 39 HZ1 LYS 4 HZ1 LYS 4 -6.009 -27.226 3.459 40 HZ2 LYS 4 HZ2 LYS 4 -7.252 -27.000 4.595 41 HZ3 LYS 4 HZ3 LYS 4 -5.645 -26.640 5.008 42 H LYS 5 H LYS 5 -1.561 -21.457 3.082 43 HA LYS 5 HA LYS 5 -4.096 -19.945 3.220 44 HB2 LYS 5 HB2 LYS 5 -1.318 -18.749 3.067 45 HB3 LYS 5 HB1 LYS 5 -2.832 -17.847 3.017 46 HG2 LYS 5 HG2 LYS 5 -2.304 -19.714 5.310 47 HG3 LYS 5 HG1 LYS 5 -1.558 -18.116 5.303 48 HD2 LYS 5 HD2 LYS 5 -4.378 -17.998 4.566 49 HD3 LYS 5 HD1 LYS 5 -4.145 -18.717 6.160 50 HE2 LYS 5 HE2 LYS 5 -3.069 -16.043 5.217 51 HE3 LYS 5 HE1 LYS 5 -4.348 -16.299 6.402 52 HZ1 LYS 5 HZ1 LYS 5 -2.292 -17.805 7.339 53 HZ2 LYS 5 HZ2 LYS 5 -2.726 -16.262 7.902 54 HZ3 LYS 5 HZ3 LYS 5 -1.505 -16.431 6.732 55 H ASP 6 H ASP 6 -4.974 -20.494 1.293 56 HA ASP 6 HA ASP 6 -3.278 -20.364 -1.110 57 HB2 ASP 6 HB2 ASP 6 -4.874 -21.755 -2.192 58 HB3 ASP 6 HB1 ASP 6 -4.647 -22.449 -0.588 59 H THR 7 H THR 7 -3.991 -19.245 -2.959 60 HA THR 7 HA THR 7 -5.949 -17.113 -2.382 61 HB THR 7 HB THR 7 -4.623 -15.565 -3.456 62 HG1 THR 7 HG1 THR 7 -4.537 -16.692 -5.418 63 HG21 THR 7 HG21 THR 7 -2.607 -15.682 -2.387 64 HG22 THR 7 HG22 THR 7 -2.267 -17.304 -2.988 65 HG23 THR 7 HG23 THR 7 -3.347 -17.083 -1.612 66 HA PRO 8 HA PRO 8 -7.976 -18.520 -6.086 67 HB2 PRO 8 HB2 PRO 8 -9.532 -16.423 -6.657 68 HB3 PRO 8 HB1 PRO 8 -9.676 -17.251 -5.092 69 HG2 PRO 8 HG2 PRO 8 -8.441 -14.637 -5.736 70 HG3 PRO 8 HG1 PRO 8 -9.255 -15.171 -4.258 71 HD2 PRO 8 HD2 PRO 8 -6.430 -15.099 -4.738 72 HD3 PRO 8 HD1 PRO 8 -7.268 -15.754 -3.315 73 H TYR 9 H TYR 9 -8.131 -18.359 -8.391 74 HA TYR 9 HA TYR 9 -6.811 -16.173 -9.778 75 HB2 TYR 9 HB2 TYR 9 -5.098 -18.049 -9.054 76 HB3 TYR 9 HB1 TYR 9 -5.790 -18.911 -10.428 77 HD1 TYR 9 HD1 TYR 9 -4.642 -15.430 -9.590 78 HD2 TYR 9 HD2 TYR 9 -4.744 -18.605 -12.481 79 HE1 TYR 9 HE1 TYR 9 -3.270 -14.064 -11.140 80 HE2 TYR 9 HE2 TYR 9 -3.372 -17.240 -14.029 81 HH TYR 9 HH TYR 9 -2.247 -15.347 -14.306 82 H LYS 10 H LYS 10 -6.585 -17.310 -12.276 83 HA LYS 10 HA LYS 10 -8.753 -18.940 -13.042 84 HB2 LYS 10 HB2 LYS 10 -10.278 -17.328 -13.965 85 HB3 LYS 10 HB1 LYS 10 -10.024 -16.931 -12.270 86 HG2 LYS 10 HG2 LYS 10 -9.280 -14.888 -12.835 87 HG3 LYS 10 HG1 LYS 10 -8.011 -15.605 -13.827 88 HD2 LYS 10 HD2 LYS 10 -9.419 -14.154 -15.208 89 HD3 LYS 10 HD1 LYS 10 -9.639 -15.833 -15.697 90 HE2 LYS 10 HE2 LYS 10 -11.538 -15.542 -13.716 91 HE3 LYS 10 HE1 LYS 10 -11.569 -13.967 -14.510 92 HZ1 LYS 10 HZ1 LYS 10 -11.475 -15.578 -16.619 93 HZ2 LYS 10 HZ2 LYS 10 -12.928 -15.038 -15.923 94 HZ3 LYS 10 HZ3 LYS 10 -12.320 -16.576 -15.538 95 H LYS 11 H LYS 11 -6.021 -18.760 -13.700 96 HA LYS 11 HA LYS 11 -4.552 -18.429 -15.485 97 HB2 LYS 11 HB2 LYS 11 -6.073 -20.504 -15.885 98 HB3 LYS 11 HB1 LYS 11 -6.817 -19.509 -17.136 99 HG2 LYS 11 HG2 LYS 11 -5.121 -20.574 -18.334 100 HG3 LYS 11 HG1 LYS 11 -4.338 -19.062 -17.874 101 HD2 LYS 11 HD2 LYS 11 -2.704 -20.448 -17.085 102 HD3 LYS 11 HD1 LYS 11 -3.771 -20.571 -15.688 103 HE2 LYS 11 HE2 LYS 11 -4.071 -22.439 -18.040 104 HE3 LYS 11 HE1 LYS 11 -2.918 -22.774 -16.751 105 HZ1 LYS 11 HZ1 LYS 11 -5.733 -22.132 -16.144 106 HZ2 LYS 11 HZ2 LYS 11 -4.593 -22.941 -15.179 107 HZ3 LYS 11 HZ3 LYS 11 -5.264 -23.715 -16.535 108 H ARG 12 H ARG 12 -5.010 -16.000 -15.233 109 HA ARG 12 HA ARG 12 -6.636 -14.353 -16.522 110 HB2 ARG 12 HB2 ARG 12 -3.648 -14.300 -16.339 111 HB3 ARG 12 HB1 ARG 12 -4.466 -13.070 -17.301 112 HG2 ARG 12 HG2 ARG 12 -5.976 -12.715 -15.239 113 HG3 ARG 12 HG1 ARG 12 -4.760 -13.634 -14.351 114 HD2 ARG 12 HD2 ARG 12 -3.215 -11.858 -15.768 115 HD3 ARG 12 HD1 ARG 12 -4.641 -10.890 -15.405 116 HE ARG 12 HE ARG 12 -4.193 -11.776 -12.994 117 HH11 ARG 12 HH11 ARG 12 -2.588 -11.207 -11.497 118 HH12 ARG 12 HH12 ARG 12 -1.037 -10.676 -12.056 119 HH21 ARG 12 HH21 ARG 12 -1.839 -10.985 -15.414 120 HH22 ARG 12 HH22 ARG 12 -0.613 -10.552 -14.270 121 H LYS 13 H LYS 13 -4.021 -16.091 -18.212 122 HA LYS 13 HA LYS 13 -5.609 -16.317 -20.601 123 HB2 LYS 13 HB2 LYS 13 -4.978 -14.114 -21.112 124 HB3 LYS 13 HB1 LYS 13 -3.357 -14.329 -20.452 125 HG2 LYS 13 HG2 LYS 13 -2.653 -15.635 -22.290 126 HG3 LYS 13 HG1 LYS 13 -4.309 -15.948 -22.811 127 HD2 LYS 13 HD2 LYS 13 -4.516 -13.430 -23.196 128 HD3 LYS 13 HD1 LYS 13 -2.765 -13.355 -23.002 129 HE2 LYS 13 HE2 LYS 13 -2.712 -15.246 -24.787 130 HE3 LYS 13 HE1 LYS 13 -4.363 -14.743 -25.146 131 HZ1 LYS 13 HZ1 LYS 13 -2.967 -12.407 -24.996 132 HZ2 LYS 13 HZ2 LYS 13 -3.445 -13.194 -26.424 133 HZ3 LYS 13 HZ3 LYS 13 -1.892 -13.455 -25.785 134 H PHE 14 H PHE 14 -2.893 -17.017 -18.666 135 HA PHE 14 HA PHE 14 -2.427 -19.545 -19.696 136 HB2 PHE 14 HB2 PHE 14 -1.348 -17.517 -21.402 137 HB3 PHE 14 HB1 PHE 14 -0.007 -18.381 -20.651 138 HD1 PHE 14 HD1 PHE 14 -2.156 -18.402 -23.399 139 HD2 PHE 14 HD2 PHE 14 -0.467 -21.053 -20.472 140 HE1 PHE 14 HE1 PHE 14 -2.540 -20.324 -24.918 141 HE2 PHE 14 HE2 PHE 14 -0.850 -22.975 -21.992 142 HZ PHE 14 HZ PHE 14 -1.887 -22.611 -24.215 143 HA PRO 15 HA PRO 15 1.177 -18.273 -16.848 144 HB2 PRO 15 HB2 PRO 15 1.476 -15.659 -16.162 145 HB3 PRO 15 HB1 PRO 15 2.164 -16.342 -17.647 146 HG2 PRO 15 HG2 PRO 15 -0.219 -14.627 -17.282 147 HG3 PRO 15 HG1 PRO 15 0.917 -14.717 -18.635 148 HD2 PRO 15 HD2 PRO 15 -1.632 -15.892 -18.561 149 HD3 PRO 15 HD1 PRO 15 -0.344 -16.285 -19.720 150 H TYR 16 H TYR 16 0.550 -19.096 -14.921 151 HA TYR 16 HA TYR 16 -1.260 -17.483 -13.233 152 HB2 TYR 16 HB2 TYR 16 -2.452 -19.466 -12.555 153 HB3 TYR 16 HB1 TYR 16 -2.458 -19.402 -14.317 154 HD1 TYR 16 HD1 TYR 16 -1.169 -21.146 -11.357 155 HD2 TYR 16 HD2 TYR 16 -1.022 -20.905 -15.644 156 HE1 TYR 16 HE1 TYR 16 -0.067 -23.365 -11.444 157 HE2 TYR 16 HE2 TYR 16 0.080 -23.126 -15.731 158 HH TYR 16 HH TYR 16 1.000 -24.836 -12.757 159 H LYS 17 H LYS 17 1.258 -19.946 -13.424 160 HA LYS 17 HA LYS 17 1.762 -20.635 -10.858 161 HB2 LYS 17 HB2 LYS 17 3.738 -19.845 -12.999 162 HB3 LYS 17 HB1 LYS 17 4.228 -20.549 -11.458 163 HG2 LYS 17 HG2 LYS 17 2.238 -22.271 -12.231 164 HG3 LYS 17 HG1 LYS 17 2.947 -21.831 -13.785 165 HD2 LYS 17 HD2 LYS 17 5.225 -22.302 -12.706 166 HD3 LYS 17 HD1 LYS 17 4.323 -23.069 -11.397 167 HE2 LYS 17 HE2 LYS 17 3.343 -24.669 -12.908 168 HE3 LYS 17 HE1 LYS 17 3.982 -23.815 -14.311 169 HZ1 LYS 17 HZ1 LYS 17 5.502 -25.298 -12.244 170 HZ2 LYS 17 HZ2 LYS 17 6.242 -24.253 -13.362 171 HZ3 LYS 17 HZ3 LYS 17 5.411 -25.632 -13.904 172 H SER 18 H SER 18 4.324 -18.551 -11.672 173 HA SER 18 HA SER 18 4.536 -17.288 -9.240 174 HB2 SER 18 HB2 SER 18 6.000 -15.697 -10.315 175 HB3 SER 18 HB1 SER 18 6.252 -17.276 -11.051 176 HG SER 18 HG SER 18 5.936 -15.352 -12.475 177 H GLU 19 H GLU 19 2.221 -16.621 -11.713 178 HA GLU 19 HA GLU 19 1.700 -13.898 -10.971 179 HB2 GLU 19 HB2 GLU 19 0.540 -15.888 -12.821 180 HB3 GLU 19 HB1 GLU 19 -0.605 -14.714 -12.174 181 HG2 GLU 19 HG2 GLU 19 0.648 -14.078 -14.341 182 HG3 GLU 19 HG1 GLU 19 0.596 -12.879 -13.049 183 H CYS 20 H CYS 20 0.568 -17.024 -9.960 184 HA CYS 20 HA CYS 20 -1.539 -15.872 -8.290 185 HB2 CYS 20 HB2 CYS 20 -2.195 -18.137 -7.893 186 HB3 CYS 20 HB1 CYS 20 -1.790 -18.037 -9.604 187 H LEU 21 H LEU 21 1.342 -17.917 -7.921 188 HA LEU 21 HA LEU 21 1.444 -18.056 -5.151 189 HB2 LEU 21 HB2 LEU 21 2.944 -19.150 -7.017 190 HB3 LEU 21 HB1 LEU 21 3.979 -17.753 -6.720 191 HG LEU 21 HG LEU 21 3.859 -18.328 -4.249 192 HD11 LEU 21 HD11 LEU 21 2.077 -20.346 -5.356 193 HD12 LEU 21 HD12 LEU 21 2.322 -19.877 -3.674 194 HD13 LEU 21 HD13 LEU 21 3.376 -21.081 -4.416 195 HD21 LEU 21 HD21 LEU 21 5.731 -19.696 -4.428 196 HD22 LEU 21 HD22 LEU 21 5.653 -19.055 -6.069 197 HD23 LEU 21 HD23 LEU 21 5.026 -20.665 -5.722 198 H LYS 22 H LYS 22 1.983 -15.395 -7.243 199 HA LYS 22 HA LYS 22 3.658 -13.847 -5.522 200 HB2 LYS 22 HB2 LYS 22 3.723 -13.115 -7.732 201 HB3 LYS 22 HB1 LYS 22 1.980 -13.278 -7.942 202 HG2 LYS 22 HG2 LYS 22 1.533 -11.319 -6.679 203 HG3 LYS 22 HG1 LYS 22 3.165 -11.285 -6.008 204 HD2 LYS 22 HD2 LYS 22 3.995 -10.186 -7.801 205 HD3 LYS 22 HD1 LYS 22 3.129 -11.218 -8.939 206 HE2 LYS 22 HE2 LYS 22 1.021 -9.934 -8.313 207 HE3 LYS 22 HE1 LYS 22 2.070 -8.794 -7.468 208 HZ1 LYS 22 HZ1 LYS 22 3.046 -8.106 -9.417 209 HZ2 LYS 22 HZ2 LYS 22 1.446 -8.371 -9.925 210 HZ3 LYS 22 HZ3 LYS 22 2.648 -9.524 -10.258 211 H ALA 23 H ALA 23 0.163 -13.907 -6.181 212 HA ALA 23 HA ALA 23 -0.636 -11.821 -4.524 213 HB1 ALA 23 HB1 ALA 23 -2.789 -12.642 -4.749 214 HB2 ALA 23 HB2 ALA 23 -2.277 -14.323 -4.598 215 HB3 ALA 23 HB3 ALA 23 -2.000 -13.449 -6.104 216 H CYS 24 H CYS 24 0.144 -15.167 -3.747 217 HA CYS 24 HA CYS 24 -0.703 -15.170 -1.056 218 HB2 CYS 24 HB2 CYS 24 0.613 -16.943 -2.824 219 HB3 CYS 24 HB1 CYS 24 1.651 -16.783 -1.408 220 H ALA 25 H ALA 25 2.490 -14.562 -2.498 221 HA ALA 25 HA ALA 25 3.733 -13.873 -0.023 222 HB1 ALA 25 HB1 ALA 25 5.647 -13.404 -1.295 223 HB2 ALA 25 HB2 ALA 25 4.706 -12.949 -2.716 224 HB3 ALA 25 HB3 ALA 25 4.827 -14.644 -2.243 225 H THR 26 H THR 26 1.728 -12.192 -2.258 226 HA THR 26 HA THR 26 2.605 -9.537 -1.554 227 HB THR 26 HB THR 26 -0.055 -10.242 -2.788 228 HG1 THR 26 HG1 THR 26 2.361 -10.850 -3.705 229 HG21 THR 26 HG21 THR 26 0.589 -7.877 -2.037 230 HG22 THR 26 HG22 THR 26 0.071 -8.056 -3.713 231 HG23 THR 26 HG23 THR 26 1.787 -7.911 -3.333 232 H SER 27 H SER 27 0.539 -11.902 -0.188 233 HA SER 27 HA SER 27 -1.287 -10.213 1.184 234 HB2 SER 27 HB2 SER 27 -1.778 -12.571 0.918 235 HB3 SER 27 HB1 SER 27 -0.319 -13.013 1.799 236 HG SER 27 HG SER 27 -1.974 -13.074 3.256 237 H PHE 28 H PHE 28 2.027 -10.813 1.599 238 HA PHE 28 HA PHE 28 2.527 -10.775 4.287 239 HB2 PHE 28 HB2 PHE 28 4.662 -10.131 3.752 240 HB3 PHE 28 HB1 PHE 28 4.102 -10.566 2.139 241 HD1 PHE 28 HD1 PHE 28 5.779 -8.102 3.915 242 HD2 PHE 28 HD2 PHE 28 2.661 -8.535 0.994 243 HE1 PHE 28 HE1 PHE 28 6.165 -5.772 3.160 244 HE2 PHE 28 HE2 PHE 28 3.046 -6.204 0.238 245 HZ PHE 28 HZ PHE 28 4.800 -4.823 1.319 246 H THR 29 H THR 29 2.408 -9.348 5.944 247 HA THR 29 HA THR 29 1.333 -6.660 5.329 248 HB THR 29 HB THR 29 0.281 -6.785 7.609 249 HG1 THR 29 HG1 THR 29 0.059 -9.102 8.258 250 HG21 THR 29 HG21 THR 29 -1.610 -7.608 6.657 251 HG22 THR 29 HG22 THR 29 -0.839 -9.133 6.220 252 HG23 THR 29 HG23 THR 29 -0.623 -7.712 5.199 253 H GLY 30 H GLY 30 4.120 -7.331 5.443 254 HA2 GLY 30 HA2 GLY 30 5.630 -5.547 6.340 255 HA3 GLY 30 HA1 GLY 30 4.931 -5.914 7.914 256 H GLY 31 H GLY 31 7.578 -6.409 6.053 257 HA2 GLY 31 HA2 GLY 31 9.426 -7.671 6.988 258 HA3 GLY 31 HA1 GLY 31 8.265 -8.893 7.500 259 H ASP 32 H ASP 32 6.773 -8.898 5.022 260 HA ASP 32 HA ASP 32 6.838 -9.717 2.853 261 HB2 ASP 32 HB2 ASP 32 9.323 -8.529 3.072 262 HB3 ASP 32 HB1 ASP 32 9.715 -10.201 2.669 263 H GLU 33 H GLU 33 7.185 -11.196 5.549 264 HA GLU 33 HA GLU 33 7.328 -13.850 4.350 265 HB2 GLU 33 HB2 GLU 33 8.990 -14.676 5.943 266 HB3 GLU 33 HB1 GLU 33 9.671 -13.360 4.988 267 HG2 GLU 33 HG2 GLU 33 8.783 -11.852 6.950 268 HG3 GLU 33 HG1 GLU 33 8.812 -13.357 7.866 269 H SER 34 H SER 34 7.763 -14.847 7.206 270 HA SER 34 HA SER 34 6.143 -15.870 8.568 271 HB2 SER 34 HB2 SER 34 6.783 -14.498 10.254 272 HB3 SER 34 HB1 SER 34 6.699 -13.067 9.234 273 HG SER 34 HG SER 34 4.562 -14.436 10.501 274 H ARG 35 H ARG 35 4.594 -16.562 7.127 275 HA ARG 35 HA ARG 35 1.986 -16.143 7.511 276 HB2 ARG 35 HB2 ARG 35 3.094 -13.855 5.992 277 HB3 ARG 35 HB1 ARG 35 1.630 -14.569 5.319 278 HG2 ARG 35 HG2 ARG 35 0.339 -14.017 7.154 279 HG3 ARG 35 HG1 ARG 35 1.709 -14.058 8.264 280 HD2 ARG 35 HD2 ARG 35 2.382 -11.909 7.729 281 HD3 ARG 35 HD1 ARG 35 1.700 -11.986 6.108 282 HE ARG 35 HE ARG 35 -0.229 -11.074 6.987 283 HH11 ARG 35 HH11 ARG 35 -1.658 -10.490 8.654 284 HH12 ARG 35 HH12 ARG 35 -1.344 -11.007 10.276 285 HH21 ARG 35 HH21 ARG 35 1.565 -12.705 9.453 286 HH22 ARG 35 HH22 ARG 35 0.482 -12.262 10.729 287 H ILE 36 H ILE 36 4.557 -16.588 5.282 288 HA ILE 36 HA ILE 36 3.083 -18.739 3.959 289 HB ILE 36 HB ILE 36 4.686 -16.870 2.243 290 HG12 ILE 36 HG12 ILE 36 2.899 -15.566 3.520 291 HG13 ILE 36 HG11 ILE 36 2.753 -15.530 1.764 292 HG21 ILE 36 HG21 ILE 36 2.977 -17.756 0.575 293 HG22 ILE 36 HG22 ILE 36 2.428 -18.848 1.846 294 HG23 ILE 36 HG23 ILE 36 4.080 -18.961 1.237 295 HD11 ILE 36 HD11 ILE 36 1.367 -17.818 2.943 296 HD12 ILE 36 HD12 ILE 36 0.772 -16.611 1.804 297 HD13 ILE 36 HD13 ILE 36 0.748 -16.276 3.535 298 H GLN 37 H GLN 37 6.165 -16.972 3.607 299 HA GLN 37 HA GLN 37 8.344 -17.694 3.685 300 HB2 GLN 37 HB2 GLN 37 7.108 -18.953 5.805 301 HB3 GLN 37 HB1 GLN 37 7.828 -20.298 4.921 302 HG2 GLN 37 HG2 GLN 37 10.013 -19.340 5.050 303 HG3 GLN 37 HG1 GLN 37 9.375 -17.793 5.601 304 HE21 GLN 37 HE21 GLN 37 8.135 -17.938 7.795 305 HE22 GLN 37 HE22 GLN 37 8.781 -18.990 8.960 306 H GLU 38 H GLU 38 5.917 -20.072 2.741 307 HA GLU 38 HA GLU 38 7.335 -20.669 0.318 308 HB2 GLU 38 HB2 GLU 38 8.581 -22.094 1.907 309 HB3 GLU 38 HB1 GLU 38 7.070 -22.871 2.379 310 HG2 GLU 38 HG2 GLU 38 6.728 -23.608 0.045 311 HG3 GLU 38 HG1 GLU 38 8.248 -22.843 -0.417 312 H GLY 39 H GLY 39 6.016 -21.631 -1.195 313 HA2 GLY 39 HA2 GLY 39 3.488 -22.817 -0.438 314 HA3 GLY 39 HA1 GLY 39 3.331 -21.243 -1.211 315 H LYS 40 H LYS 40 2.201 -23.460 -2.384 316 HA LYS 40 HA LYS 40 4.007 -24.005 -4.653 317 HB2 LYS 40 HB2 LYS 40 2.318 -25.755 -3.054 318 HB3 LYS 40 HB1 LYS 40 1.950 -25.879 -4.774 319 HG2 LYS 40 HG2 LYS 40 3.704 -27.469 -4.265 320 HG3 LYS 40 HG1 LYS 40 4.411 -26.159 -5.211 321 HD2 LYS 40 HD2 LYS 40 5.638 -25.357 -3.444 322 HD3 LYS 40 HD1 LYS 40 4.420 -25.817 -2.254 323 HE2 LYS 40 HE2 LYS 40 5.732 -28.068 -3.668 324 HE3 LYS 40 HE1 LYS 40 6.770 -27.145 -2.584 325 HZ1 LYS 40 HZ1 LYS 40 4.714 -27.391 -1.005 326 HZ2 LYS 40 HZ2 LYS 40 5.871 -28.629 -1.131 327 HZ3 LYS 40 HZ3 LYS 40 4.399 -28.751 -1.969 328 HA PRO 41 HA PRO 41 0.766 -22.138 -7.091 329 HB2 PRO 41 HB2 PRO 41 1.579 -22.753 -9.540 330 HB3 PRO 41 HB1 PRO 41 2.657 -21.851 -8.453 331 HG2 PRO 41 HG2 PRO 41 2.728 -24.719 -9.237 332 HG3 PRO 41 HG1 PRO 41 4.059 -23.596 -8.923 333 HD2 PRO 41 HD2 PRO 41 2.974 -25.480 -7.083 334 HD3 PRO 41 HD1 PRO 41 4.144 -24.192 -6.727 335 H GLY 42 H GLY 42 -0.904 -22.528 -8.696 336 HA2 GLY 42 HA2 GLY 42 -1.657 -25.178 -9.506 337 HA3 GLY 42 HA1 GLY 42 -2.696 -24.517 -8.240 338 H PHE 43 H PHE 43 -3.431 -25.117 -11.008 339 HA PHE 43 HA PHE 43 -3.654 -22.576 -12.382 340 HB2 PHE 43 HB2 PHE 43 -5.443 -24.386 -13.548 341 HB3 PHE 43 HB1 PHE 43 -3.801 -24.028 -14.089 342 HD1 PHE 43 HD1 PHE 43 -1.869 -25.286 -12.897 343 HD2 PHE 43 HD2 PHE 43 -5.976 -26.540 -12.771 344 HE1 PHE 43 HE1 PHE 43 -1.152 -27.569 -12.247 345 HE2 PHE 43 HE2 PHE 43 -5.258 -28.824 -12.124 346 HZ PHE 43 HZ PHE 43 -2.847 -29.338 -11.860 347 H PHE 44 H PHE 44 -5.337 -21.180 -12.323 348 HA PHE 44 HA PHE 44 -7.424 -20.307 -11.841 349 HB2 PHE 44 HB2 PHE 44 -8.088 -22.777 -12.530 350 HB3 PHE 44 HB1 PHE 44 -8.413 -22.932 -10.806 351 HD1 PHE 44 HD1 PHE 44 -10.197 -21.670 -9.737 352 HD2 PHE 44 HD2 PHE 44 -9.352 -21.190 -13.920 353 HE1 PHE 44 HE1 PHE 44 -12.357 -20.486 -10.037 354 HE2 PHE 44 HE2 PHE 44 -11.510 -20.005 -14.221 355 HZ PHE 44 HZ PHE 44 -13.012 -19.654 -12.279 356 H LYS 45 H LYS 45 -5.205 -21.481 -9.805 357 HA LYS 45 HA LYS 45 -5.801 -19.912 -7.627 358 HB2 LYS 45 HB2 LYS 45 -6.566 -21.784 -6.019 359 HB3 LYS 45 HB1 LYS 45 -7.775 -21.062 -7.078 360 HG2 LYS 45 HG2 LYS 45 -7.996 -22.955 -8.340 361 HG3 LYS 45 HG1 LYS 45 -6.293 -23.382 -8.187 362 HD2 LYS 45 HD2 LYS 45 -7.795 -24.974 -6.981 363 HD3 LYS 45 HD1 LYS 45 -6.653 -24.168 -5.907 364 HE2 LYS 45 HE2 LYS 45 -8.292 -23.027 -4.811 365 HE3 LYS 45 HE1 LYS 45 -9.214 -22.743 -6.287 366 HZ1 LYS 45 HZ1 LYS 45 -10.383 -24.633 -6.028 367 HZ2 LYS 45 HZ2 LYS 45 -9.966 -24.444 -4.392 368 HZ3 LYS 45 HZ3 LYS 45 -9.076 -25.499 -5.381 369 H CYS 46 H CYS 46 -4.514 -20.500 -5.682 370 HA CYS 46 HA CYS 46 -2.469 -22.544 -6.133 371 HB2 CYS 46 HB2 CYS 46 -1.940 -19.591 -5.951 372 HB3 CYS 46 HB1 CYS 46 -0.711 -20.785 -5.516 373 H THR 47 H THR 47 -1.719 -23.442 -4.307 374 HA THR 47 HA THR 47 -2.807 -22.362 -1.784 375 HB THR 47 HB THR 47 -3.341 -24.764 -2.662 376 HG1 THR 47 HG1 THR 47 -4.050 -24.398 -0.689 377 HG21 THR 47 HG21 THR 47 -0.789 -25.137 -2.931 378 HG22 THR 47 HG22 THR 47 -1.745 -26.429 -2.205 379 HG23 THR 47 HG23 THR 47 -0.790 -25.357 -1.180 380 H CYS 48 H CYS 48 -1.505 -21.760 -0.176 381 HA CYS 48 HA CYS 48 1.385 -22.291 -0.472 382 HB2 CYS 48 HB2 CYS 48 0.426 -19.845 0.939 383 HB3 CYS 48 HB1 CYS 48 1.903 -20.102 0.009 384 H TYR 49 H TYR 49 2.579 -22.091 1.634 385 HA TYR 49 HA TYR 49 0.892 -22.838 3.940 386 HB2 TYR 49 HB2 TYR 49 3.466 -24.230 3.173 387 HB3 TYR 49 HB1 TYR 49 2.398 -24.640 4.514 388 HD1 TYR 49 HD1 TYR 49 -0.178 -24.960 3.756 389 HD2 TYR 49 HD2 TYR 49 3.257 -25.480 1.232 390 HE1 TYR 49 HE1 TYR 49 -1.509 -26.406 2.242 391 HE2 TYR 49 HE2 TYR 49 1.928 -26.925 -0.281 392 HH TYR 49 HH TYR 49 -0.880 -28.343 0.532 393 H PHE 50 H PHE 50 1.593 -22.058 5.900 394 HA PHE 50 HA PHE 50 3.840 -20.170 5.767 395 HB2 PHE 50 HB2 PHE 50 1.887 -19.111 6.584 396 HB3 PHE 50 HB1 PHE 50 1.488 -20.468 7.629 397 HD1 PHE 50 HD1 PHE 50 4.983 -19.338 7.378 398 HD2 PHE 50 HD2 PHE 50 1.309 -18.980 9.579 399 HE1 PHE 50 HE1 PHE 50 6.205 -18.268 9.245 400 HE2 PHE 50 HE2 PHE 50 2.536 -17.911 11.447 401 HZ PHE 50 HZ PHE 50 4.982 -17.554 11.281 402 H THR 51 H THR 51 5.666 -21.342 6.109 403 HA THR 51 HA THR 51 6.034 -23.589 7.670 404 HB THR 51 HB THR 51 8.145 -21.453 7.567 405 HG1 THR 51 HG1 THR 51 8.084 -23.133 5.435 406 HG21 THR 51 HG21 THR 51 9.514 -23.173 8.063 407 HG22 THR 51 HG22 THR 51 8.819 -24.174 6.789 408 HG23 THR 51 HG23 THR 51 8.063 -24.124 8.381 409 H THR 52 H THR 52 5.207 -23.748 9.674 410 HA THR 52 HA THR 52 6.089 -21.747 11.667 411 HB THR 52 HB THR 52 3.939 -22.517 12.897 412 HG1 THR 52 HG1 THR 52 3.463 -24.206 11.452 413 HG21 THR 52 HG21 THR 52 3.930 -20.785 10.414 414 HG22 THR 52 HG22 THR 52 4.165 -20.263 12.082 415 HG23 THR 52 HG23 THR 52 2.588 -20.852 11.557 416 H GLY 53 H GLY 53 7.891 -22.968 12.279 417 HA2 GLY 53 HA2 GLY 53 8.989 -24.459 13.654 418 HA3 GLY 53 HA1 GLY 53 7.415 -24.974 14.253 Start of MODEL 3 1 H1 GLU 1 H1 GLU 1 3.523 -25.095 13.402 2 H2 GLU 1 H2 GLU 1 3.955 -26.561 14.146 3 H3 GLU 1 H3 GLU 1 2.629 -25.670 14.724 4 HA GLU 1 HA GLU 1 2.741 -27.599 12.631 5 HB2 GLU 1 HB2 GLU 1 0.664 -26.187 14.290 6 HB3 GLU 1 HB1 GLU 1 0.177 -27.200 12.932 7 HG2 GLU 1 HG2 GLU 1 2.200 -28.431 14.682 8 HG3 GLU 1 HG1 GLU 1 0.654 -28.127 15.472 9 H VAL 2 H VAL 2 2.914 -27.128 10.533 10 HA VAL 2 HA VAL 2 2.681 -24.565 9.409 11 HB VAL 2 HB VAL 2 2.328 -27.210 7.982 12 HG11 VAL 2 HG11 VAL 2 1.760 -25.169 6.682 13 HG12 VAL 2 HG12 VAL 2 3.203 -25.965 6.057 14 HG13 VAL 2 HG13 VAL 2 3.356 -24.512 7.044 15 HG21 VAL 2 HG21 VAL 2 4.377 -27.455 9.119 16 HG22 VAL 2 HG22 VAL 2 4.759 -25.738 8.989 17 HG23 VAL 2 HG23 VAL 2 4.866 -26.774 7.566 18 H ILE 3 H ILE 3 1.043 -23.506 8.345 19 HA ILE 3 HA ILE 3 -1.654 -24.642 8.717 20 HB ILE 3 HB ILE 3 -2.355 -22.587 9.322 21 HG12 ILE 3 HG12 ILE 3 -2.334 -21.786 6.989 22 HG13 ILE 3 HG11 ILE 3 -1.772 -20.520 8.078 23 HG21 ILE 3 HG21 ILE 3 -0.113 -22.837 10.471 24 HG22 ILE 3 HG22 ILE 3 -0.673 -21.173 10.297 25 HG23 ILE 3 HG23 ILE 3 0.568 -21.804 9.211 26 HD11 ILE 3 HD11 ILE 3 -0.418 -21.434 5.833 27 HD12 ILE 3 HD12 ILE 3 0.408 -22.240 7.168 28 HD13 ILE 3 HD13 ILE 3 0.279 -20.481 7.142 29 H LYS 4 H LYS 4 -3.265 -23.895 7.018 30 HA LYS 4 HA LYS 4 -2.047 -24.299 4.362 31 HB2 LYS 4 HB2 LYS 4 -3.680 -25.999 4.975 32 HB3 LYS 4 HB1 LYS 4 -4.879 -24.755 5.331 33 HG2 LYS 4 HG2 LYS 4 -5.455 -24.584 3.159 34 HG3 LYS 4 HG1 LYS 4 -3.770 -24.389 2.673 35 HD2 LYS 4 HD2 LYS 4 -3.476 -26.864 2.849 36 HD3 LYS 4 HD1 LYS 4 -5.198 -27.011 3.199 37 HE2 LYS 4 HE2 LYS 4 -4.590 -25.402 0.806 38 HE3 LYS 4 HE1 LYS 4 -4.115 -27.095 0.679 39 HZ1 LYS 4 HZ1 LYS 4 -6.328 -27.764 1.271 40 HZ2 LYS 4 HZ2 LYS 4 -6.414 -26.685 -0.040 41 HZ3 LYS 4 HZ3 LYS 4 -6.800 -26.155 1.527 42 H LYS 5 H LYS 5 -1.623 -22.345 3.503 43 HA LYS 5 HA LYS 5 -3.780 -20.319 3.556 44 HB2 LYS 5 HB2 LYS 5 -1.548 -19.776 4.699 45 HB3 LYS 5 HB1 LYS 5 -0.862 -19.731 3.074 46 HG2 LYS 5 HG2 LYS 5 -1.492 -17.535 3.172 47 HG3 LYS 5 HG1 LYS 5 -3.058 -18.191 2.691 48 HD2 LYS 5 HD2 LYS 5 -3.664 -18.397 5.108 49 HD3 LYS 5 HD1 LYS 5 -2.142 -17.608 5.523 50 HE2 LYS 5 HE2 LYS 5 -2.823 -15.638 4.165 51 HE3 LYS 5 HE1 LYS 5 -4.370 -16.421 3.844 52 HZ1 LYS 5 HZ1 LYS 5 -3.434 -16.060 6.612 53 HZ2 LYS 5 HZ2 LYS 5 -5.021 -16.239 6.033 54 HZ3 LYS 5 HZ3 LYS 5 -4.186 -14.778 5.795 55 H ASP 6 H ASP 6 -4.845 -20.452 1.672 56 HA ASP 6 HA ASP 6 -3.242 -20.673 -0.807 57 HB2 ASP 6 HB2 ASP 6 -5.176 -21.765 -1.834 58 HB3 ASP 6 HB1 ASP 6 -4.666 -22.648 -0.398 59 H THR 7 H THR 7 -3.601 -19.211 -2.421 60 HA THR 7 HA THR 7 -5.436 -17.001 -1.773 61 HB THR 7 HB THR 7 -2.830 -16.791 -2.304 62 HG1 THR 7 HG1 THR 7 -4.143 -14.832 -3.638 63 HG21 THR 7 HG21 THR 7 -3.407 -17.888 -4.612 64 HG22 THR 7 HG22 THR 7 -2.288 -16.525 -4.561 65 HG23 THR 7 HG23 THR 7 -3.968 -16.271 -5.035 66 HA PRO 8 HA PRO 8 -7.709 -18.043 -5.456 67 HB2 PRO 8 HB2 PRO 8 -9.074 -15.777 -5.881 68 HB3 PRO 8 HB1 PRO 8 -9.260 -16.675 -4.361 69 HG2 PRO 8 HG2 PRO 8 -7.828 -14.143 -4.889 70 HG3 PRO 8 HG1 PRO 8 -8.612 -14.713 -3.408 71 HD2 PRO 8 HD2 PRO 8 -5.813 -14.839 -4.058 72 HD3 PRO 8 HD1 PRO 8 -6.624 -15.470 -2.607 73 H TYR 9 H TYR 9 -7.506 -18.099 -7.656 74 HA TYR 9 HA TYR 9 -6.496 -15.864 -9.184 75 HB2 TYR 9 HB2 TYR 9 -4.437 -16.964 -8.203 76 HB3 TYR 9 HB1 TYR 9 -4.848 -18.398 -9.143 77 HD1 TYR 9 HD1 TYR 9 -4.035 -14.776 -9.403 78 HD2 TYR 9 HD2 TYR 9 -4.396 -18.519 -11.477 79 HE1 TYR 9 HE1 TYR 9 -2.963 -13.771 -11.400 80 HE2 TYR 9 HE2 TYR 9 -3.327 -17.515 -13.476 81 HH TYR 9 HH TYR 9 -1.609 -15.407 -13.777 82 H LYS 10 H LYS 10 -8.673 -16.323 -10.018 83 HA LYS 10 HA LYS 10 -9.244 -18.782 -11.357 84 HB2 LYS 10 HB2 LYS 10 -10.986 -17.226 -10.485 85 HB3 LYS 10 HB1 LYS 10 -10.546 -16.081 -11.753 86 HG2 LYS 10 HG2 LYS 10 -10.920 -18.643 -12.969 87 HG3 LYS 10 HG1 LYS 10 -12.315 -18.317 -11.940 88 HD2 LYS 10 HD2 LYS 10 -12.513 -16.061 -13.012 89 HD3 LYS 10 HD1 LYS 10 -11.217 -16.517 -14.118 90 HE2 LYS 10 HE2 LYS 10 -13.964 -17.752 -13.865 91 HE3 LYS 10 HE1 LYS 10 -13.238 -16.999 -15.285 92 HZ1 LYS 10 HZ1 LYS 10 -12.267 -19.486 -13.986 93 HZ2 LYS 10 HZ2 LYS 10 -11.630 -18.773 -15.391 94 HZ3 LYS 10 HZ3 LYS 10 -13.199 -19.426 -15.402 95 H LYS 11 H LYS 11 -7.430 -19.117 -12.716 96 HA LYS 11 HA LYS 11 -5.984 -18.561 -14.516 97 HB2 LYS 11 HB2 LYS 11 -8.274 -19.954 -15.058 98 HB3 LYS 11 HB1 LYS 11 -8.361 -18.651 -16.244 99 HG2 LYS 11 HG2 LYS 11 -5.821 -19.239 -16.637 100 HG3 LYS 11 HG1 LYS 11 -6.282 -20.791 -15.935 101 HD2 LYS 11 HD2 LYS 11 -7.701 -19.476 -18.269 102 HD3 LYS 11 HD1 LYS 11 -6.497 -20.755 -18.423 103 HE2 LYS 11 HE2 LYS 11 -8.139 -21.907 -16.613 104 HE3 LYS 11 HE1 LYS 11 -9.309 -20.906 -17.472 105 HZ1 LYS 11 HZ1 LYS 11 -8.931 -21.991 -19.444 106 HZ2 LYS 11 HZ2 LYS 11 -8.769 -23.267 -18.334 107 HZ3 LYS 11 HZ3 LYS 11 -7.387 -22.530 -18.994 108 H ARG 12 H ARG 12 -5.272 -16.450 -14.399 109 HA ARG 12 HA ARG 12 -6.962 -14.394 -15.679 110 HB2 ARG 12 HB2 ARG 12 -5.853 -14.193 -13.278 111 HB3 ARG 12 HB1 ARG 12 -4.446 -13.706 -14.224 112 HG2 ARG 12 HG2 ARG 12 -6.208 -12.171 -15.467 113 HG3 ARG 12 HG1 ARG 12 -7.111 -12.361 -13.964 114 HD2 ARG 12 HD2 ARG 12 -5.360 -11.403 -12.669 115 HD3 ARG 12 HD1 ARG 12 -4.206 -11.537 -13.992 116 HE ARG 12 HE ARG 12 -6.082 -9.895 -15.037 117 HH11 ARG 12 HH11 ARG 12 -6.116 -7.640 -14.761 118 HH12 ARG 12 HH12 ARG 12 -5.399 -6.936 -13.351 119 HH21 ARG 12 HH21 ARG 12 -4.405 -9.975 -12.011 120 HH22 ARG 12 HH22 ARG 12 -4.430 -8.256 -11.794 121 H LYS 13 H LYS 13 -6.548 -14.327 -17.803 122 HA LYS 13 HA LYS 13 -5.390 -14.347 -19.799 123 HB2 LYS 13 HB2 LYS 13 -3.613 -12.646 -18.039 124 HB3 LYS 13 HB1 LYS 13 -3.420 -12.784 -19.787 125 HG2 LYS 13 HG2 LYS 13 -6.182 -12.224 -18.961 126 HG3 LYS 13 HG1 LYS 13 -5.044 -10.951 -18.516 127 HD2 LYS 13 HD2 LYS 13 -4.911 -12.115 -21.278 128 HD3 LYS 13 HD1 LYS 13 -6.173 -10.941 -20.905 129 HE2 LYS 13 HE2 LYS 13 -3.224 -10.481 -20.383 130 HE3 LYS 13 HE1 LYS 13 -4.079 -9.893 -21.808 131 HZ1 LYS 13 HZ1 LYS 13 -5.608 -9.167 -19.621 132 HZ2 LYS 13 HZ2 LYS 13 -4.687 -8.147 -20.618 133 HZ3 LYS 13 HZ3 LYS 13 -4.006 -8.797 -19.204 134 H PHE 14 H PHE 14 -4.921 -16.606 -19.802 135 HA PHE 14 HA PHE 14 -3.540 -18.435 -19.958 136 HB2 PHE 14 HB2 PHE 14 -2.014 -16.136 -20.805 137 HB3 PHE 14 HB1 PHE 14 -0.956 -17.305 -20.017 138 HD1 PHE 14 HD1 PHE 14 -3.929 -17.427 -22.319 139 HD2 PHE 14 HD2 PHE 14 0.032 -18.841 -21.448 140 HE1 PHE 14 HE1 PHE 14 -3.991 -18.852 -24.348 141 HE2 PHE 14 HE2 PHE 14 -0.030 -20.267 -23.478 142 HZ PHE 14 HZ PHE 14 -2.042 -20.272 -24.927 143 HA PRO 15 HA PRO 15 -2.169 -19.342 -15.876 144 HB2 PRO 15 HB2 PRO 15 -0.516 -21.476 -16.394 145 HB3 PRO 15 HB1 PRO 15 -2.287 -21.575 -16.404 146 HG2 PRO 15 HG2 PRO 15 -0.388 -21.374 -18.681 147 HG3 PRO 15 HG1 PRO 15 -1.899 -22.290 -18.543 148 HD2 PRO 15 HD2 PRO 15 -1.707 -19.916 -19.902 149 HD3 PRO 15 HD1 PRO 15 -3.207 -20.480 -19.131 150 H TYR 16 H TYR 16 -0.255 -19.409 -14.484 151 HA TYR 16 HA TYR 16 2.285 -18.590 -15.672 152 HB2 TYR 16 HB2 TYR 16 0.462 -16.754 -14.307 153 HB3 TYR 16 HB1 TYR 16 2.072 -16.788 -13.588 154 HD1 TYR 16 HD1 TYR 16 4.095 -16.554 -15.153 155 HD2 TYR 16 HD2 TYR 16 0.077 -15.612 -16.341 156 HE1 TYR 16 HE1 TYR 16 4.971 -15.197 -17.035 157 HE2 TYR 16 HE2 TYR 16 0.952 -14.255 -18.225 158 HH TYR 16 HH TYR 16 2.787 -13.345 -19.137 159 H LYS 17 H LYS 17 0.406 -19.471 -12.825 160 HA LYS 17 HA LYS 17 0.940 -20.746 -10.999 161 HB2 LYS 17 HB2 LYS 17 3.596 -21.259 -12.347 162 HB3 LYS 17 HB1 LYS 17 2.817 -22.229 -11.100 163 HG2 LYS 17 HG2 LYS 17 0.958 -22.738 -12.635 164 HG3 LYS 17 HG1 LYS 17 1.725 -21.761 -13.889 165 HD2 LYS 17 HD2 LYS 17 2.209 -24.173 -14.192 166 HD3 LYS 17 HD1 LYS 17 3.680 -23.250 -13.879 167 HE2 LYS 17 HE2 LYS 17 3.907 -24.087 -11.717 168 HE3 LYS 17 HE1 LYS 17 2.188 -24.455 -11.569 169 HZ1 LYS 17 HZ1 LYS 17 3.893 -25.860 -13.529 170 HZ2 LYS 17 HZ2 LYS 17 2.399 -26.342 -12.881 171 HZ3 LYS 17 HZ3 LYS 17 3.797 -26.384 -11.919 172 H SER 18 H SER 18 3.661 -18.757 -12.154 173 HA SER 18 HA SER 18 4.604 -18.316 -9.443 174 HB2 SER 18 HB2 SER 18 6.448 -18.233 -10.781 175 HB3 SER 18 HB1 SER 18 5.538 -17.672 -12.180 176 HG SER 18 HG SER 18 5.676 -15.935 -10.024 177 H GLU 19 H GLU 19 2.995 -16.462 -11.995 178 HA GLU 19 HA GLU 19 2.947 -13.952 -10.790 179 HB2 GLU 19 HB2 GLU 19 2.225 -14.314 -13.090 180 HB3 GLU 19 HB1 GLU 19 0.857 -15.272 -12.536 181 HG2 GLU 19 HG2 GLU 19 -0.353 -13.387 -12.383 182 HG3 GLU 19 HG1 GLU 19 0.737 -12.827 -11.117 183 H CYS 20 H CYS 20 1.045 -16.806 -10.128 184 HA CYS 20 HA CYS 20 -0.850 -15.381 -8.459 185 HB2 CYS 20 HB2 CYS 20 -1.701 -17.305 -9.593 186 HB3 CYS 20 HB1 CYS 20 -0.383 -18.316 -8.997 187 H LEU 21 H LEU 21 1.696 -17.829 -7.903 188 HA LEU 21 HA LEU 21 1.650 -18.056 -5.186 189 HB2 LEU 21 HB2 LEU 21 3.283 -19.217 -6.634 190 HB3 LEU 21 HB1 LEU 21 4.146 -17.699 -6.872 191 HG LEU 21 HG LEU 21 4.490 -17.557 -4.401 192 HD11 LEU 21 HD11 LEU 21 2.770 -19.956 -4.547 193 HD12 LEU 21 HD12 LEU 21 2.996 -18.811 -3.224 194 HD13 LEU 21 HD13 LEU 21 4.164 -20.110 -3.476 195 HD21 LEU 21 HD21 LEU 21 5.601 -19.610 -6.201 196 HD22 LEU 21 HD22 LEU 21 5.850 -19.944 -4.488 197 HD23 LEU 21 HD23 LEU 21 6.436 -18.435 -5.185 198 H LYS 22 H LYS 22 2.460 -15.270 -7.068 199 HA LYS 22 HA LYS 22 3.784 -13.796 -4.989 200 HB2 LYS 22 HB2 LYS 22 3.795 -13.458 -7.604 201 HB3 LYS 22 HB1 LYS 22 2.369 -12.475 -7.277 202 HG2 LYS 22 HG2 LYS 22 3.601 -11.028 -5.805 203 HG3 LYS 22 HG1 LYS 22 4.999 -12.103 -5.823 204 HD2 LYS 22 HD2 LYS 22 5.350 -11.665 -8.203 205 HD3 LYS 22 HD1 LYS 22 3.899 -10.665 -8.258 206 HE2 LYS 22 HE2 LYS 22 6.395 -9.665 -7.853 207 HE3 LYS 22 HE1 LYS 22 4.927 -8.887 -7.262 208 HZ1 LYS 22 HZ1 LYS 22 5.202 -10.258 -5.206 209 HZ2 LYS 22 HZ2 LYS 22 6.395 -9.070 -5.440 210 HZ3 LYS 22 HZ3 LYS 22 6.739 -10.700 -5.774 211 H ALA 23 H ALA 23 0.519 -13.865 -6.366 212 HA ALA 23 HA ALA 23 -0.680 -11.814 -4.937 213 HB1 ALA 23 HB1 ALA 23 -1.609 -14.324 -6.212 214 HB2 ALA 23 HB2 ALA 23 -2.172 -12.668 -6.436 215 HB3 ALA 23 HB3 ALA 23 -2.703 -13.598 -5.034 216 H CYS 24 H CYS 24 0.235 -15.024 -3.872 217 HA CYS 24 HA CYS 24 -1.266 -14.945 -1.421 218 HB2 CYS 24 HB2 CYS 24 -0.137 -16.962 -2.815 219 HB3 CYS 24 HB1 CYS 24 1.128 -16.685 -1.616 220 H ALA 25 H ALA 25 2.184 -14.585 -2.246 221 HA ALA 25 HA ALA 25 2.947 -13.863 0.420 222 HB1 ALA 25 HB1 ALA 25 4.519 -14.881 -1.210 223 HB2 ALA 25 HB2 ALA 25 5.119 -13.354 -0.563 224 HB3 ALA 25 HB3 ALA 25 4.426 -13.413 -2.183 225 H THR 26 H THR 26 1.597 -12.194 -2.258 226 HA THR 26 HA THR 26 2.563 -9.574 -1.686 227 HB THR 26 HB THR 26 0.102 -10.512 -3.177 228 HG1 THR 26 HG1 THR 26 1.541 -9.797 -4.941 229 HG21 THR 26 HG21 THR 26 -0.494 -8.326 -2.908 230 HG22 THR 26 HG22 THR 26 0.700 -8.058 -4.177 231 HG23 THR 26 HG23 THR 26 1.145 -7.828 -2.486 232 H SER 27 H SER 27 0.295 -11.596 -0.151 233 HA SER 27 HA SER 27 -1.757 -10.125 0.778 234 HB2 SER 27 HB2 SER 27 -1.687 -12.194 1.787 235 HB3 SER 27 HB1 SER 27 0.038 -12.093 2.123 236 HG SER 27 HG SER 27 -0.679 -10.290 3.593 237 H PHE 28 H PHE 28 1.169 -10.231 2.801 238 HA PHE 28 HA PHE 28 2.191 -8.624 4.087 239 HB2 PHE 28 HB2 PHE 28 2.020 -7.527 1.637 240 HB3 PHE 28 HB1 PHE 28 1.021 -6.382 2.532 241 HD1 PHE 28 HD1 PHE 28 2.139 -4.538 3.388 242 HD2 PHE 28 HD2 PHE 28 4.211 -8.290 3.102 243 HE1 PHE 28 HE1 PHE 28 4.181 -3.482 4.320 244 HE2 PHE 28 HE2 PHE 28 6.253 -7.233 4.035 245 HZ PHE 28 HZ PHE 28 6.237 -4.830 4.643 246 H THR 29 H THR 29 1.124 -8.778 6.014 247 HA THR 29 HA THR 29 -0.580 -6.622 6.782 248 HB THR 29 HB THR 29 -2.080 -9.119 7.210 249 HG1 THR 29 HG1 THR 29 -2.743 -8.273 4.793 250 HG21 THR 29 HG21 THR 29 -3.949 -7.659 6.782 251 HG22 THR 29 HG22 THR 29 -2.901 -6.443 6.055 252 HG23 THR 29 HG23 THR 29 -2.804 -6.769 7.784 253 H GLY 30 H GLY 30 1.769 -8.587 7.454 254 HA2 GLY 30 HA2 GLY 30 1.103 -8.774 10.332 255 HA3 GLY 30 HA1 GLY 30 1.966 -10.064 9.498 256 H GLY 31 H GLY 31 4.124 -10.000 9.533 257 HA2 GLY 31 HA2 GLY 31 5.441 -7.410 10.105 258 HA3 GLY 31 HA1 GLY 31 5.951 -8.913 10.869 259 H ASP 32 H ASP 32 5.420 -10.414 8.349 260 HA ASP 32 HA ASP 32 6.957 -9.450 6.208 261 HB2 ASP 32 HB2 ASP 32 8.677 -9.785 8.197 262 HB3 ASP 32 HB1 ASP 32 8.588 -11.470 7.688 263 H GLU 33 H GLU 33 8.305 -12.059 5.751 264 HA GLU 33 HA GLU 33 6.366 -13.366 4.256 265 HB2 GLU 33 HB2 GLU 33 8.819 -14.562 5.566 266 HB3 GLU 33 HB1 GLU 33 7.901 -15.297 4.251 267 HG2 GLU 33 HG2 GLU 33 9.583 -14.212 3.063 268 HG3 GLU 33 HG1 GLU 33 8.318 -12.984 3.061 269 H SER 34 H SER 34 7.124 -13.637 7.663 270 HA SER 34 HA SER 34 6.082 -16.011 8.449 271 HB2 SER 34 HB2 SER 34 4.955 -13.800 10.021 272 HB3 SER 34 HB1 SER 34 6.028 -15.104 10.521 273 HG SER 34 HG SER 34 6.603 -12.549 9.819 274 H ARG 35 H ARG 35 4.498 -16.858 7.191 275 HA ARG 35 HA ARG 35 1.891 -16.826 7.758 276 HB2 ARG 35 HB2 ARG 35 2.574 -14.323 6.324 277 HB3 ARG 35 HB1 ARG 35 1.170 -15.190 5.710 278 HG2 ARG 35 HG2 ARG 35 -0.045 -14.894 7.647 279 HG3 ARG 35 HG1 ARG 35 1.392 -14.857 8.669 280 HD2 ARG 35 HD2 ARG 35 1.844 -12.613 8.177 281 HD3 ARG 35 HD1 ARG 35 0.911 -12.653 6.683 282 HE ARG 35 HE ARG 35 -0.092 -12.009 9.273 283 HH11 ARG 35 HH11 ARG 35 -2.335 -11.720 9.479 284 HH12 ARG 35 HH12 ARG 35 -3.397 -12.339 8.259 285 HH21 ARG 35 HH21 ARG 35 -0.840 -13.653 6.319 286 HH22 ARG 35 HH22 ARG 35 -2.552 -13.430 6.470 287 H ILE 36 H ILE 36 4.283 -16.666 5.259 288 HA ILE 36 HA ILE 36 3.001 -18.928 3.891 289 HB ILE 36 HB ILE 36 4.332 -16.837 2.220 290 HG12 ILE 36 HG12 ILE 36 2.656 -15.661 3.709 291 HG13 ILE 36 HG11 ILE 36 2.284 -15.576 1.987 292 HG21 ILE 36 HG21 ILE 36 3.716 -18.858 1.105 293 HG22 ILE 36 HG22 ILE 36 2.497 -17.665 0.653 294 HG23 ILE 36 HG23 ILE 36 2.130 -18.882 1.874 295 HD11 ILE 36 HD11 ILE 36 0.555 -16.464 3.972 296 HD12 ILE 36 HD12 ILE 36 1.150 -17.957 3.248 297 HD13 ILE 36 HD13 ILE 36 0.365 -16.740 2.242 298 H GLN 37 H GLN 37 5.887 -16.857 3.452 299 HA GLN 37 HA GLN 37 8.124 -17.404 3.389 300 HB2 GLN 37 HB2 GLN 37 6.999 -19.036 5.410 301 HB3 GLN 37 HB1 GLN 37 8.044 -20.081 4.450 302 HG2 GLN 37 HG2 GLN 37 9.525 -19.193 6.017 303 HG3 GLN 37 HG1 GLN 37 9.762 -18.127 4.636 304 HE21 GLN 37 HE21 GLN 37 10.514 -16.625 6.524 305 HE22 GLN 37 HE22 GLN 37 9.312 -15.684 7.267 306 H GLU 38 H GLU 38 5.901 -20.038 2.590 307 HA GLU 38 HA GLU 38 7.179 -20.406 0.015 308 HB2 GLU 38 HB2 GLU 38 8.565 -21.881 1.319 309 HB3 GLU 38 HB1 GLU 38 7.159 -22.585 2.111 310 HG2 GLU 38 HG2 GLU 38 6.409 -23.602 0.078 311 HG3 GLU 38 HG1 GLU 38 7.573 -22.691 -0.882 312 H GLY 39 H GLY 39 5.825 -21.364 -1.475 313 HA2 GLY 39 HA2 GLY 39 3.346 -22.617 -0.643 314 HA3 GLY 39 HA1 GLY 39 3.150 -21.054 -1.430 315 H LYS 40 H LYS 40 2.087 -23.392 -2.512 316 HA LYS 40 HA LYS 40 3.854 -23.899 -4.820 317 HB2 LYS 40 HB2 LYS 40 1.819 -25.602 -3.414 318 HB3 LYS 40 HB1 LYS 40 2.225 -25.921 -5.098 319 HG2 LYS 40 HG2 LYS 40 4.561 -25.488 -3.352 320 HG3 LYS 40 HG1 LYS 40 3.614 -26.922 -2.955 321 HD2 LYS 40 HD2 LYS 40 3.961 -27.896 -5.057 322 HD3 LYS 40 HD1 LYS 40 4.353 -26.352 -5.814 323 HE2 LYS 40 HE2 LYS 40 6.524 -26.349 -5.011 324 HE3 LYS 40 HE1 LYS 40 6.114 -27.325 -3.601 325 HZ1 LYS 40 HZ1 LYS 40 7.220 -28.205 -5.966 326 HZ2 LYS 40 HZ2 LYS 40 5.615 -28.760 -5.993 327 HZ3 LYS 40 HZ3 LYS 40 6.635 -29.162 -4.696 328 HA PRO 41 HA PRO 41 0.544 -22.156 -7.248 329 HB2 PRO 41 HB2 PRO 41 1.261 -22.897 -9.699 330 HB3 PRO 41 HB1 PRO 41 2.371 -21.928 -8.705 331 HG2 PRO 41 HG2 PRO 41 2.457 -24.821 -9.357 332 HG3 PRO 41 HG1 PRO 41 3.778 -23.674 -9.109 333 HD2 PRO 41 HD2 PRO 41 2.732 -25.500 -7.182 334 HD3 PRO 41 HD1 PRO 41 3.923 -24.211 -6.900 335 H GLY 42 H GLY 42 -1.204 -22.627 -8.774 336 HA2 GLY 42 HA2 GLY 42 -1.956 -25.390 -9.254 337 HA3 GLY 42 HA1 GLY 42 -2.991 -24.528 -8.119 338 H PHE 43 H PHE 43 -4.000 -25.522 -10.509 339 HA PHE 43 HA PHE 43 -4.112 -23.336 -12.430 340 HB2 PHE 43 HB2 PHE 43 -5.946 -25.671 -12.630 341 HB3 PHE 43 HB1 PHE 43 -5.027 -24.848 -13.891 342 HD1 PHE 43 HD1 PHE 43 -2.301 -24.853 -12.731 343 HD2 PHE 43 HD2 PHE 43 -5.292 -27.938 -12.814 344 HE1 PHE 43 HE1 PHE 43 -0.528 -26.578 -12.566 345 HE2 PHE 43 HE2 PHE 43 -3.515 -29.662 -12.649 346 HZ PHE 43 HZ PHE 43 -1.134 -28.982 -12.526 347 H PHE 44 H PHE 44 -5.572 -21.750 -12.360 348 HA PHE 44 HA PHE 44 -7.542 -20.620 -11.957 349 HB2 PHE 44 HB2 PHE 44 -8.867 -23.007 -10.768 350 HB3 PHE 44 HB1 PHE 44 -9.511 -21.800 -11.880 351 HD1 PHE 44 HD1 PHE 44 -7.163 -21.884 -13.860 352 HD2 PHE 44 HD2 PHE 44 -9.507 -24.978 -12.017 353 HE1 PHE 44 HE1 PHE 44 -6.685 -23.386 -15.774 354 HE2 PHE 44 HE2 PHE 44 -9.028 -26.480 -13.931 355 HZ PHE 44 HZ PHE 44 -7.618 -25.684 -15.810 356 H LYS 45 H LYS 45 -5.514 -21.909 -9.795 357 HA LYS 45 HA LYS 45 -6.160 -20.137 -7.706 358 HB2 LYS 45 HB2 LYS 45 -6.848 -21.804 -5.986 359 HB3 LYS 45 HB1 LYS 45 -8.049 -21.594 -7.261 360 HG2 LYS 45 HG2 LYS 45 -6.321 -23.600 -8.205 361 HG3 LYS 45 HG1 LYS 45 -6.587 -23.984 -6.504 362 HD2 LYS 45 HD2 LYS 45 -9.082 -23.597 -6.973 363 HD3 LYS 45 HD1 LYS 45 -8.651 -23.648 -8.682 364 HE2 LYS 45 HE2 LYS 45 -7.358 -25.866 -7.788 365 HE3 LYS 45 HE1 LYS 45 -8.742 -25.840 -6.696 366 HZ1 LYS 45 HZ1 LYS 45 -8.774 -26.848 -9.189 367 HZ2 LYS 45 HZ2 LYS 45 -9.393 -25.287 -9.448 368 HZ3 LYS 45 HZ3 LYS 45 -10.149 -26.331 -8.340 369 H CYS 46 H CYS 46 -4.965 -20.995 -5.568 370 HA CYS 46 HA CYS 46 -2.644 -22.640 -6.151 371 HB2 CYS 46 HB2 CYS 46 -1.975 -19.895 -5.204 372 HB3 CYS 46 HB1 CYS 46 -1.005 -21.030 -6.141 373 H THR 47 H THR 47 -1.554 -23.321 -4.324 374 HA THR 47 HA THR 47 -2.869 -22.636 -1.762 375 HB THR 47 HB THR 47 -2.077 -24.893 -1.014 376 HG1 THR 47 HG1 THR 47 -0.473 -24.880 -2.827 377 HG21 THR 47 HG21 THR 47 -4.375 -24.562 -1.820 378 HG22 THR 47 HG22 THR 47 -3.771 -26.145 -2.311 379 HG23 THR 47 HG23 THR 47 -3.839 -24.826 -3.480 380 H CYS 48 H CYS 48 -1.656 -21.837 -0.149 381 HA CYS 48 HA CYS 48 1.285 -21.921 -0.449 382 HB2 CYS 48 HB2 CYS 48 0.214 -19.670 1.100 383 HB3 CYS 48 HB1 CYS 48 1.460 -19.689 -0.147 384 H TYR 49 H TYR 49 2.500 -21.989 1.538 385 HA TYR 49 HA TYR 49 0.908 -22.671 3.932 386 HB2 TYR 49 HB2 TYR 49 3.299 -24.236 2.927 387 HB3 TYR 49 HB1 TYR 49 2.393 -24.556 4.407 388 HD1 TYR 49 HD1 TYR 49 2.039 -24.321 0.697 389 HD2 TYR 49 HD2 TYR 49 0.425 -25.868 4.366 390 HE1 TYR 49 HE1 TYR 49 0.409 -25.676 -0.591 391 HE2 TYR 49 HE2 TYR 49 -1.204 -27.223 3.078 392 HH TYR 49 HH TYR 49 -2.125 -26.713 0.173 393 H PHE 50 H PHE 50 2.018 -22.313 5.937 394 HA PHE 50 HA PHE 50 4.122 -20.286 5.666 395 HB2 PHE 50 HB2 PHE 50 2.251 -19.529 6.951 396 HB3 PHE 50 HB1 PHE 50 2.263 -20.989 7.936 397 HD1 PHE 50 HD1 PHE 50 5.534 -19.592 7.053 398 HD2 PHE 50 HD2 PHE 50 2.342 -19.477 9.935 399 HE1 PHE 50 HE1 PHE 50 7.036 -18.489 8.675 400 HE2 PHE 50 HE2 PHE 50 3.857 -18.372 11.556 401 HZ PHE 50 HZ PHE 50 6.202 -17.877 10.926 402 H THR 51 H THR 51 6.086 -21.235 5.616 403 HA THR 51 HA THR 51 6.780 -23.660 6.887 404 HB THR 51 HB THR 51 8.704 -21.434 6.204 405 HG1 THR 51 HG1 THR 51 8.652 -22.202 4.128 406 HG21 THR 51 HG21 THR 51 10.073 -23.523 5.575 407 HG22 THR 51 HG22 THR 51 8.863 -24.434 6.478 408 HG23 THR 51 HG23 THR 51 9.833 -23.207 7.293 409 H THR 52 H THR 52 6.148 -23.625 9.050 410 HA THR 52 HA THR 52 7.962 -22.142 10.813 411 HB THR 52 HB THR 52 6.134 -20.639 10.821 412 HG1 THR 52 HG1 THR 52 6.171 -20.701 12.900 413 HG21 THR 52 HG21 THR 52 4.568 -23.132 10.505 414 HG22 THR 52 HG22 THR 52 4.290 -21.530 9.821 415 HG23 THR 52 HG23 THR 52 3.811 -21.872 11.482 416 H GLY 53 H GLY 53 8.522 -23.260 12.616 417 HA2 GLY 53 HA2 GLY 53 7.102 -25.809 13.128 418 HA3 GLY 53 HA1 GLY 53 8.858 -25.680 13.180 Start of MODEL 4 1 H1 GLU 1 H1 GLU 1 1.958 -27.912 13.301 2 H2 GLU 1 H2 GLU 1 2.730 -27.579 11.825 3 H3 GLU 1 H3 GLU 1 1.283 -28.468 11.848 4 HA GLU 1 HA GLU 1 -0.023 -26.656 12.146 5 HB2 GLU 1 HB2 GLU 1 1.480 -26.148 14.253 6 HB3 GLU 1 HB1 GLU 1 2.216 -24.952 13.185 7 HG2 GLU 1 HG2 GLU 1 -0.212 -24.217 12.667 8 HG3 GLU 1 HG1 GLU 1 -0.648 -25.128 14.112 9 H VAL 2 H VAL 2 1.940 -27.450 10.042 10 HA VAL 2 HA VAL 2 3.297 -25.540 8.710 11 HB VAL 2 HB VAL 2 2.749 -27.883 7.914 12 HG11 VAL 2 HG11 VAL 2 0.282 -27.639 8.099 13 HG12 VAL 2 HG12 VAL 2 0.780 -28.138 6.481 14 HG13 VAL 2 HG13 VAL 2 0.321 -26.462 6.784 15 HG21 VAL 2 HG21 VAL 2 2.376 -26.715 5.422 16 HG22 VAL 2 HG22 VAL 2 3.932 -26.979 6.205 17 HG23 VAL 2 HG23 VAL 2 3.117 -25.424 6.366 18 H ILE 3 H ILE 3 -0.108 -25.527 9.341 19 HA ILE 3 HA ILE 3 -1.729 -23.951 8.978 20 HB ILE 3 HB ILE 3 0.798 -22.400 8.749 21 HG12 ILE 3 HG12 ILE 3 -1.793 -22.065 10.290 22 HG13 ILE 3 HG11 ILE 3 -0.303 -22.774 10.912 23 HG21 ILE 3 HG21 ILE 3 -0.538 -20.336 8.202 24 HG22 ILE 3 HG22 ILE 3 -1.896 -21.385 7.796 25 HG23 ILE 3 HG23 ILE 3 -0.403 -21.471 6.860 26 HD11 ILE 3 HD11 ILE 3 -0.635 -19.922 9.935 27 HD12 ILE 3 HD12 ILE 3 0.871 -20.628 10.518 28 HD13 ILE 3 HD13 ILE 3 -0.492 -20.425 11.618 29 H LYS 4 H LYS 4 -3.120 -23.694 7.329 30 HA LYS 4 HA LYS 4 -2.067 -24.082 4.602 31 HB2 LYS 4 HB2 LYS 4 -4.968 -24.303 5.356 32 HB3 LYS 4 HB1 LYS 4 -4.106 -25.069 4.022 33 HG2 LYS 4 HG2 LYS 4 -2.733 -26.038 6.191 34 HG3 LYS 4 HG1 LYS 4 -4.376 -25.938 6.825 35 HD2 LYS 4 HD2 LYS 4 -5.147 -27.144 4.729 36 HD3 LYS 4 HD1 LYS 4 -3.445 -27.428 4.360 37 HE2 LYS 4 HE2 LYS 4 -3.205 -28.979 6.022 38 HE3 LYS 4 HE1 LYS 4 -4.296 -28.126 7.114 39 HZ1 LYS 4 HZ1 LYS 4 -6.140 -28.866 5.621 40 HZ2 LYS 4 HZ2 LYS 4 -5.366 -30.116 6.472 41 HZ3 LYS 4 HZ3 LYS 4 -5.023 -29.867 4.827 42 H LYS 5 H LYS 5 -1.988 -22.364 3.313 43 HA LYS 5 HA LYS 5 -4.023 -20.251 3.630 44 HB2 LYS 5 HB2 LYS 5 -1.980 -19.477 4.746 45 HB3 LYS 5 HB1 LYS 5 -1.042 -19.822 3.293 46 HG2 LYS 5 HG2 LYS 5 -1.534 -17.459 3.300 47 HG3 LYS 5 HG1 LYS 5 -2.528 -18.210 2.048 48 HD2 LYS 5 HD2 LYS 5 -4.493 -18.011 3.297 49 HD3 LYS 5 HD1 LYS 5 -3.626 -17.927 4.831 50 HE2 LYS 5 HE2 LYS 5 -2.734 -15.693 4.157 51 HE3 LYS 5 HE1 LYS 5 -3.726 -15.771 2.700 52 HZ1 LYS 5 HZ1 LYS 5 -5.252 -14.785 3.983 53 HZ2 LYS 5 HZ2 LYS 5 -4.499 -15.247 5.434 54 HZ3 LYS 5 HZ3 LYS 5 -5.514 -16.337 4.616 55 H ASP 6 H ASP 6 -5.144 -20.606 1.777 56 HA ASP 6 HA ASP 6 -3.596 -20.740 -0.739 57 HB2 ASP 6 HB2 ASP 6 -5.592 -21.870 -1.694 58 HB3 ASP 6 HB1 ASP 6 -4.870 -22.776 -0.365 59 H THR 7 H THR 7 -3.957 -19.237 -2.273 60 HA THR 7 HA THR 7 -6.042 -17.235 -1.701 61 HB THR 7 HB THR 7 -3.441 -16.709 -1.877 62 HG1 THR 7 HG1 THR 7 -5.711 -15.371 -2.230 63 HG21 THR 7 HG21 THR 7 -2.638 -16.284 -4.027 64 HG22 THR 7 HG22 THR 7 -4.257 -16.181 -4.719 65 HG23 THR 7 HG23 THR 7 -3.584 -17.751 -4.277 66 HA PRO 8 HA PRO 8 -7.704 -18.287 -5.698 67 HB2 PRO 8 HB2 PRO 8 -9.335 -16.219 -6.128 68 HB3 PRO 8 HB1 PRO 8 -9.538 -17.233 -4.684 69 HG2 PRO 8 HG2 PRO 8 -8.405 -14.506 -4.930 70 HG3 PRO 8 HG1 PRO 8 -9.295 -15.246 -3.590 71 HD2 PRO 8 HD2 PRO 8 -6.451 -14.995 -3.844 72 HD3 PRO 8 HD1 PRO 8 -7.352 -15.842 -2.568 73 H TYR 9 H TYR 9 -7.942 -17.626 -7.965 74 HA TYR 9 HA TYR 9 -6.364 -15.350 -8.883 75 HB2 TYR 9 HB2 TYR 9 -4.871 -17.445 -8.639 76 HB3 TYR 9 HB1 TYR 9 -5.751 -18.060 -10.037 77 HD1 TYR 9 HD1 TYR 9 -4.738 -17.684 -12.091 78 HD2 TYR 9 HD2 TYR 9 -4.227 -14.800 -8.949 79 HE1 TYR 9 HE1 TYR 9 -3.317 -16.307 -13.586 80 HE2 TYR 9 HE2 TYR 9 -2.807 -13.422 -10.443 81 HH TYR 9 HH TYR 9 -2.643 -13.188 -13.119 82 H LYS 10 H LYS 10 -7.638 -18.357 -10.326 83 HA LYS 10 HA LYS 10 -8.921 -18.626 -12.239 84 HB2 LYS 10 HB2 LYS 10 -10.516 -16.565 -10.697 85 HB3 LYS 10 HB1 LYS 10 -11.144 -17.535 -12.030 86 HG2 LYS 10 HG2 LYS 10 -11.561 -19.233 -10.615 87 HG3 LYS 10 HG1 LYS 10 -9.856 -19.294 -10.171 88 HD2 LYS 10 HD2 LYS 10 -10.157 -17.726 -8.398 89 HD3 LYS 10 HD1 LYS 10 -11.765 -17.278 -8.972 90 HE2 LYS 10 HE2 LYS 10 -11.099 -20.094 -8.097 91 HE3 LYS 10 HE1 LYS 10 -11.683 -18.871 -6.967 92 HZ1 LYS 10 HZ1 LYS 10 -13.743 -19.017 -7.768 93 HZ2 LYS 10 HZ2 LYS 10 -13.244 -20.470 -8.495 94 HZ3 LYS 10 HZ3 LYS 10 -13.227 -19.023 -9.384 95 H LYS 11 H LYS 11 -6.978 -16.180 -12.011 96 HA LYS 11 HA LYS 11 -7.923 -14.070 -13.571 97 HB2 LYS 11 HB2 LYS 11 -5.559 -14.659 -12.348 98 HB3 LYS 11 HB1 LYS 11 -5.119 -14.855 -14.045 99 HG2 LYS 11 HG2 LYS 11 -4.772 -12.584 -13.852 100 HG3 LYS 11 HG1 LYS 11 -6.487 -12.563 -14.264 101 HD2 LYS 11 HD2 LYS 11 -6.876 -12.741 -11.698 102 HD3 LYS 11 HD1 LYS 11 -5.198 -12.214 -11.565 103 HE2 LYS 11 HE2 LYS 11 -6.243 -10.461 -13.433 104 HE3 LYS 11 HE1 LYS 11 -7.580 -10.673 -12.302 105 HZ1 LYS 11 HZ1 LYS 11 -6.533 -9.293 -10.946 106 HZ2 LYS 11 HZ2 LYS 11 -5.169 -9.233 -11.958 107 HZ3 LYS 11 HZ3 LYS 11 -5.295 -10.439 -10.767 108 H ARG 12 H ARG 12 -5.750 -16.650 -14.733 109 HA ARG 12 HA ARG 12 -5.763 -17.843 -16.714 110 HB2 ARG 12 HB2 ARG 12 -8.365 -17.557 -16.341 111 HB3 ARG 12 HB1 ARG 12 -8.210 -16.436 -17.695 112 HG2 ARG 12 HG2 ARG 12 -8.396 -18.284 -18.998 113 HG3 ARG 12 HG1 ARG 12 -6.716 -18.581 -18.554 114 HD2 ARG 12 HD2 ARG 12 -7.711 -20.602 -17.962 115 HD3 ARG 12 HD1 ARG 12 -7.762 -19.723 -16.436 116 HE ARG 12 HE ARG 12 -10.121 -19.383 -18.092 117 HH11 ARG 12 HH11 ARG 12 -12.037 -20.242 -17.222 118 HH12 ARG 12 HH12 ARG 12 -11.960 -21.328 -15.875 119 HH21 ARG 12 HH21 ARG 12 -8.499 -21.228 -15.658 120 HH22 ARG 12 HH22 ARG 12 -9.954 -21.885 -14.987 121 H LYS 13 H LYS 13 -5.664 -17.403 -19.145 122 HA LYS 13 HA LYS 13 -4.851 -16.182 -20.917 123 HB2 LYS 13 HB2 LYS 13 -6.714 -14.585 -20.114 124 HB3 LYS 13 HB1 LYS 13 -5.408 -13.660 -19.370 125 HG2 LYS 13 HG2 LYS 13 -4.292 -13.424 -21.529 126 HG3 LYS 13 HG1 LYS 13 -5.516 -14.435 -22.299 127 HD2 LYS 13 HD2 LYS 13 -5.962 -12.021 -22.664 128 HD3 LYS 13 HD1 LYS 13 -7.253 -12.793 -21.740 129 HE2 LYS 13 HE2 LYS 13 -6.734 -11.670 -19.810 130 HE3 LYS 13 HE1 LYS 13 -5.007 -11.645 -20.166 131 HZ1 LYS 13 HZ1 LYS 13 -6.026 -10.109 -22.126 132 HZ2 LYS 13 HZ2 LYS 13 -5.372 -9.517 -20.673 133 HZ3 LYS 13 HZ3 LYS 13 -7.051 -9.725 -20.831 134 H PHE 14 H PHE 14 -3.839 -15.459 -17.669 135 HA PHE 14 HA PHE 14 -1.142 -14.800 -18.690 136 HB2 PHE 14 HB2 PHE 14 -2.813 -13.510 -16.606 137 HB3 PHE 14 HB1 PHE 14 -1.099 -13.697 -16.233 138 HD1 PHE 14 HD1 PHE 14 0.175 -11.823 -16.747 139 HD2 PHE 14 HD2 PHE 14 -3.112 -12.879 -19.302 140 HE1 PHE 14 HE1 PHE 14 0.708 -9.906 -18.225 141 HE2 PHE 14 HE2 PHE 14 -2.579 -10.963 -20.780 142 HZ PHE 14 HZ PHE 14 -0.669 -9.475 -20.242 143 HA PRO 15 HA PRO 15 0.682 -18.264 -16.724 144 HB2 PRO 15 HB2 PRO 15 2.274 -16.235 -15.197 145 HB3 PRO 15 HB1 PRO 15 2.829 -17.678 -16.068 146 HG2 PRO 15 HG2 PRO 15 3.052 -15.204 -17.089 147 HG3 PRO 15 HG1 PRO 15 2.794 -16.637 -18.096 148 HD2 PRO 15 HD2 PRO 15 0.935 -14.425 -17.518 149 HD3 PRO 15 HD1 PRO 15 0.872 -15.639 -18.814 150 H TYR 16 H TYR 16 0.982 -19.262 -14.571 151 HA TYR 16 HA TYR 16 -0.679 -18.003 -12.475 152 HB2 TYR 16 HB2 TYR 16 -0.856 -20.814 -12.202 153 HB3 TYR 16 HB1 TYR 16 -2.140 -19.693 -12.656 154 HD1 TYR 16 HD1 TYR 16 0.164 -22.246 -13.815 155 HD2 TYR 16 HD2 TYR 16 -2.468 -19.098 -15.087 156 HE1 TYR 16 HE1 TYR 16 0.162 -23.177 -16.113 157 HE2 TYR 16 HE2 TYR 16 -2.470 -20.029 -17.385 158 HH TYR 16 HH TYR 16 -2.012 -22.003 -18.569 159 H LYS 17 H LYS 17 1.931 -20.230 -13.281 160 HA LYS 17 HA LYS 17 2.865 -21.291 -11.044 161 HB2 LYS 17 HB2 LYS 17 4.186 -20.011 -13.325 162 HB3 LYS 17 HB1 LYS 17 5.185 -20.061 -11.872 163 HG2 LYS 17 HG2 LYS 17 5.548 -22.108 -13.136 164 HG3 LYS 17 HG1 LYS 17 4.663 -22.502 -11.662 165 HD2 LYS 17 HD2 LYS 17 2.567 -22.597 -12.865 166 HD3 LYS 17 HD1 LYS 17 3.333 -21.994 -14.336 167 HE2 LYS 17 HE2 LYS 17 3.713 -24.138 -14.916 168 HE3 LYS 17 HE1 LYS 17 4.867 -24.222 -13.583 169 HZ1 LYS 17 HZ1 LYS 17 2.601 -24.542 -12.258 170 HZ2 LYS 17 HZ2 LYS 17 3.476 -25.843 -12.911 171 HZ3 LYS 17 HZ3 LYS 17 2.136 -25.213 -13.744 172 H SER 18 H SER 18 4.430 -18.194 -11.688 173 HA SER 18 HA SER 18 4.469 -17.641 -8.823 174 HB2 SER 18 HB2 SER 18 5.687 -15.984 -11.033 175 HB3 SER 18 HB1 SER 18 6.113 -15.983 -9.323 176 HG SER 18 HG SER 18 6.332 -18.458 -10.076 177 H GLU 19 H GLU 19 2.637 -16.754 -11.569 178 HA GLU 19 HA GLU 19 1.925 -14.102 -10.905 179 HB2 GLU 19 HB2 GLU 19 1.348 -15.836 -12.973 180 HB3 GLU 19 HB1 GLU 19 -0.207 -15.670 -12.157 181 HG2 GLU 19 HG2 GLU 19 0.022 -13.923 -13.853 182 HG3 GLU 19 HG1 GLU 19 0.036 -13.200 -12.246 183 H CYS 20 H CYS 20 0.602 -17.221 -9.933 184 HA CYS 20 HA CYS 20 -1.474 -15.910 -8.350 185 HB2 CYS 20 HB2 CYS 20 -1.963 -17.992 -9.635 186 HB3 CYS 20 HB1 CYS 20 -0.836 -18.855 -8.588 187 H LEU 21 H LEU 21 1.376 -17.990 -7.863 188 HA LEU 21 HA LEU 21 1.240 -18.129 -5.056 189 HB2 LEU 21 HB2 LEU 21 2.750 -19.494 -6.549 190 HB3 LEU 21 HB1 LEU 21 3.781 -18.071 -6.700 191 HG LEU 21 HG LEU 21 2.984 -18.965 -3.954 192 HD11 LEU 21 HD11 LEU 21 4.778 -20.429 -5.845 193 HD12 LEU 21 HD12 LEU 21 3.739 -21.063 -4.570 194 HD13 LEU 21 HD13 LEU 21 5.277 -20.305 -4.158 195 HD21 LEU 21 HD21 LEU 21 4.648 -17.553 -3.345 196 HD22 LEU 21 HD22 LEU 21 4.636 -16.990 -5.015 197 HD23 LEU 21 HD23 LEU 21 5.766 -18.247 -4.519 198 H LYS 22 H LYS 22 2.155 -15.585 -7.205 199 HA LYS 22 HA LYS 22 3.778 -14.036 -5.487 200 HB2 LYS 22 HB2 LYS 22 3.745 -13.428 -7.786 201 HB3 LYS 22 HB1 LYS 22 1.983 -13.330 -7.811 202 HG2 LYS 22 HG2 LYS 22 1.948 -11.313 -6.617 203 HG3 LYS 22 HG1 LYS 22 3.568 -11.560 -5.966 204 HD2 LYS 22 HD2 LYS 22 3.152 -11.270 -8.932 205 HD3 LYS 22 HD1 LYS 22 3.257 -9.842 -7.902 206 HE2 LYS 22 HE2 LYS 22 5.341 -11.843 -7.358 207 HE3 LYS 22 HE1 LYS 22 5.421 -11.158 -8.981 208 HZ1 LYS 22 HZ1 LYS 22 6.075 -9.955 -6.495 209 HZ2 LYS 22 HZ2 LYS 22 4.899 -9.039 -7.309 210 HZ3 LYS 22 HZ3 LYS 22 6.377 -9.397 -8.067 211 H ALA 23 H ALA 23 0.289 -14.090 -6.083 212 HA ALA 23 HA ALA 23 -0.533 -11.987 -4.472 213 HB1 ALA 23 HB1 ALA 23 -2.419 -14.057 -4.102 214 HB2 ALA 23 HB2 ALA 23 -1.747 -14.279 -5.717 215 HB3 ALA 23 HB3 ALA 23 -2.485 -12.741 -5.273 216 H CYS 24 H CYS 24 -0.410 -15.428 -3.479 217 HA CYS 24 HA CYS 24 -1.000 -15.094 -0.801 218 HB2 CYS 24 HB2 CYS 24 0.041 -17.189 -2.417 219 HB3 CYS 24 HB1 CYS 24 1.070 -17.064 -0.990 220 H ALA 25 H ALA 25 2.039 -14.515 -2.471 221 HA ALA 25 HA ALA 25 3.512 -14.067 -0.013 222 HB1 ALA 25 HB1 ALA 25 4.974 -14.856 -1.596 223 HB2 ALA 25 HB2 ALA 25 5.188 -13.125 -1.853 224 HB3 ALA 25 HB3 ALA 25 4.140 -14.054 -2.927 225 H THR 26 H THR 26 2.023 -12.099 -2.550 226 HA THR 26 HA THR 26 3.086 -9.612 -1.630 227 HB THR 26 HB THR 26 0.810 -10.367 -3.455 228 HG1 THR 26 HG1 THR 26 2.472 -8.810 -4.624 229 HG21 THR 26 HG21 THR 26 -0.058 -8.383 -2.558 230 HG22 THR 26 HG22 THR 26 0.869 -7.804 -3.942 231 HG23 THR 26 HG23 THR 26 1.542 -7.681 -2.316 232 H SER 27 H SER 27 0.517 -11.648 -0.606 233 HA SER 27 HA SER 27 -1.411 -10.080 0.475 234 HB2 SER 27 HB2 SER 27 -1.759 -11.762 2.133 235 HB3 SER 27 HB1 SER 27 -1.147 -12.590 0.707 236 HG SER 27 HG SER 27 0.513 -11.660 2.808 237 H PHE 28 H PHE 28 1.925 -10.221 1.456 238 HA PHE 28 HA PHE 28 1.351 -8.214 3.552 239 HB2 PHE 28 HB2 PHE 28 2.260 -10.639 4.167 240 HB3 PHE 28 HB1 PHE 28 3.801 -9.900 3.732 241 HD1 PHE 28 HD1 PHE 28 4.964 -8.693 5.357 242 HD2 PHE 28 HD2 PHE 28 0.709 -9.149 5.720 243 HE1 PHE 28 HE1 PHE 28 5.026 -7.533 7.549 244 HE2 PHE 28 HE2 PHE 28 0.771 -7.989 7.911 245 HZ PHE 28 HZ PHE 28 2.930 -7.182 8.826 246 H THR 29 H THR 29 3.987 -7.542 4.116 247 HA THR 29 HA THR 29 4.700 -6.086 1.661 248 HB THR 29 HB THR 29 5.867 -4.538 3.090 249 HG1 THR 29 HG1 THR 29 5.770 -6.682 4.796 250 HG21 THR 29 HG21 THR 29 3.105 -5.379 3.795 251 HG22 THR 29 HG22 THR 29 3.696 -3.820 3.219 252 HG23 THR 29 HG23 THR 29 3.900 -4.271 4.912 253 H GLY 30 H GLY 30 5.516 -8.892 3.133 254 HA2 GLY 30 HA2 GLY 30 7.277 -10.347 2.815 255 HA3 GLY 30 HA1 GLY 30 7.948 -9.192 1.666 256 H GLY 31 H GLY 31 7.148 -8.384 4.981 257 HA2 GLY 31 HA2 GLY 31 9.740 -7.310 5.490 258 HA3 GLY 31 HA1 GLY 31 8.448 -7.507 6.670 259 H ASP 32 H ASP 32 8.187 -10.388 6.153 260 HA ASP 32 HA ASP 32 10.729 -11.596 6.775 261 HB2 ASP 32 HB2 ASP 32 9.442 -10.476 8.927 262 HB3 ASP 32 HB1 ASP 32 8.857 -12.138 8.969 263 H GLU 33 H GLU 33 8.541 -11.909 4.849 264 HA GLU 33 HA GLU 33 7.140 -13.533 3.961 265 HB2 GLU 33 HB2 GLU 33 8.853 -15.692 5.021 266 HB3 GLU 33 HB1 GLU 33 8.395 -15.323 3.358 267 HG2 GLU 33 HG2 GLU 33 9.973 -13.393 3.388 268 HG3 GLU 33 HG1 GLU 33 10.484 -13.870 5.006 269 H SER 34 H SER 34 7.112 -12.994 7.099 270 HA SER 34 HA SER 34 6.077 -15.388 8.234 271 HB2 SER 34 HB2 SER 34 5.198 -13.833 10.011 272 HB3 SER 34 HB1 SER 34 6.926 -13.682 9.703 273 HG SER 34 HG SER 34 5.285 -12.111 8.131 274 H ARG 35 H ARG 35 4.541 -16.203 6.823 275 HA ARG 35 HA ARG 35 1.900 -15.879 7.248 276 HB2 ARG 35 HB2 ARG 35 2.916 -13.600 5.696 277 HB3 ARG 35 HB1 ARG 35 1.572 -14.431 4.919 278 HG2 ARG 35 HG2 ARG 35 0.120 -14.053 6.734 279 HG3 ARG 35 HG1 ARG 35 1.448 -13.711 7.843 280 HD2 ARG 35 HD2 ARG 35 1.868 -11.590 6.851 281 HD3 ARG 35 HD1 ARG 35 0.887 -11.970 5.439 282 HE ARG 35 HE ARG 35 -0.109 -11.208 8.094 283 HH11 ARG 35 HH11 ARG 35 -2.291 -10.577 8.094 284 HH12 ARG 35 HH12 ARG 35 -3.257 -10.819 6.677 285 HH21 ARG 35 HH21 ARG 35 -0.681 -12.243 4.842 286 HH22 ARG 35 HH22 ARG 35 -2.345 -11.762 4.835 287 H ILE 36 H ILE 36 4.470 -16.357 5.014 288 HA ILE 36 HA ILE 36 3.032 -18.594 3.786 289 HB ILE 36 HB ILE 36 4.609 -16.779 1.997 290 HG12 ILE 36 HG12 ILE 36 2.857 -15.416 3.279 291 HG13 ILE 36 HG11 ILE 36 2.705 -15.415 1.526 292 HG21 ILE 36 HG21 ILE 36 2.346 -18.765 1.716 293 HG22 ILE 36 HG22 ILE 36 3.960 -18.844 1.009 294 HG23 ILE 36 HG23 ILE 36 2.793 -17.666 0.412 295 HD11 ILE 36 HD11 ILE 36 0.730 -16.528 1.573 296 HD12 ILE 36 HD12 ILE 36 0.668 -16.040 3.266 297 HD13 ILE 36 HD13 ILE 36 1.282 -17.635 2.830 298 H GLN 37 H GLN 37 6.106 -16.807 3.396 299 HA GLN 37 HA GLN 37 8.284 -17.506 3.476 300 HB2 GLN 37 HB2 GLN 37 7.640 -18.387 5.705 301 HB3 GLN 37 HB1 GLN 37 7.168 -19.907 4.945 302 HG2 GLN 37 HG2 GLN 37 9.304 -20.580 4.686 303 HG3 GLN 37 HG1 GLN 37 9.853 -18.985 4.187 304 HE21 GLN 37 HE21 GLN 37 11.703 -18.976 5.634 305 HE22 GLN 37 HE22 GLN 37 11.516 -18.870 7.318 306 H GLU 38 H GLU 38 5.857 -19.873 2.504 307 HA GLU 38 HA GLU 38 7.246 -20.418 0.064 308 HB2 GLU 38 HB2 GLU 38 7.853 -22.670 0.380 309 HB3 GLU 38 HB1 GLU 38 8.433 -21.855 1.828 310 HG2 GLU 38 HG2 GLU 38 7.286 -23.451 2.960 311 HG3 GLU 38 HG1 GLU 38 5.854 -22.514 2.534 312 H GLY 39 H GLY 39 5.981 -21.573 -1.404 313 HA2 GLY 39 HA2 GLY 39 3.458 -22.741 -0.670 314 HA3 GLY 39 HA1 GLY 39 3.274 -21.162 -1.428 315 H LYS 40 H LYS 40 2.243 -23.475 -2.603 316 HA LYS 40 HA LYS 40 4.088 -23.929 -4.860 317 HB2 LYS 40 HB2 LYS 40 2.124 -25.665 -3.465 318 HB3 LYS 40 HB1 LYS 40 2.233 -25.847 -5.216 319 HG2 LYS 40 HG2 LYS 40 3.815 -27.378 -4.208 320 HG3 LYS 40 HG1 LYS 40 4.728 -26.072 -4.966 321 HD2 LYS 40 HD2 LYS 40 5.510 -25.304 -2.978 322 HD3 LYS 40 HD1 LYS 40 3.958 -25.536 -2.173 323 HE2 LYS 40 HE2 LYS 40 5.598 -27.932 -2.940 324 HE3 LYS 40 HE1 LYS 40 6.007 -27.029 -1.483 325 HZ1 LYS 40 HZ1 LYS 40 3.961 -28.902 -1.840 326 HZ2 LYS 40 HZ2 LYS 40 3.234 -27.395 -1.547 327 HZ3 LYS 40 HZ3 LYS 40 4.353 -28.031 -0.438 328 HA PRO 41 HA PRO 41 0.929 -22.051 -7.375 329 HB2 PRO 41 HB2 PRO 41 1.704 -22.782 -9.809 330 HB3 PRO 41 HB1 PRO 41 2.824 -21.892 -8.754 331 HG2 PRO 41 HG2 PRO 41 2.774 -24.780 -9.449 332 HG3 PRO 41 HG1 PRO 41 4.150 -23.708 -9.152 333 HD2 PRO 41 HD2 PRO 41 2.956 -25.492 -7.272 334 HD3 PRO 41 HD1 PRO 41 4.197 -24.264 -6.942 335 H GLY 42 H GLY 42 -0.781 -22.416 -8.955 336 HA2 GLY 42 HA2 GLY 42 -1.647 -25.138 -9.503 337 HA3 GLY 42 HA1 GLY 42 -2.692 -24.219 -8.422 338 H PHE 43 H PHE 43 -3.486 -25.190 -10.982 339 HA PHE 43 HA PHE 43 -3.382 -23.009 -12.873 340 HB2 PHE 43 HB2 PHE 43 -5.147 -25.472 -12.870 341 HB3 PHE 43 HB1 PHE 43 -4.850 -24.397 -14.238 342 HD1 PHE 43 HD1 PHE 43 -3.451 -27.037 -12.104 343 HD2 PHE 43 HD2 PHE 43 -2.652 -24.338 -15.349 344 HE1 PHE 43 HE1 PHE 43 -1.410 -28.326 -12.675 345 HE2 PHE 43 HE2 PHE 43 -0.611 -25.627 -15.919 346 HZ PHE 43 HZ PHE 43 0.010 -27.621 -14.581 347 H PHE 44 H PHE 44 -4.637 -21.262 -12.831 348 HA PHE 44 HA PHE 44 -6.421 -19.863 -12.436 349 HB2 PHE 44 HB2 PHE 44 -8.232 -22.091 -11.670 350 HB3 PHE 44 HB1 PHE 44 -8.516 -20.720 -12.737 351 HD1 PHE 44 HD1 PHE 44 -6.491 -20.802 -14.740 352 HD2 PHE 44 HD2 PHE 44 -8.481 -24.093 -12.830 353 HE1 PHE 44 HE1 PHE 44 -6.010 -22.234 -16.707 354 HE2 PHE 44 HE2 PHE 44 -8.001 -25.526 -14.795 355 HZ PHE 44 HZ PHE 44 -6.765 -24.596 -16.735 356 H LYS 45 H LYS 45 -4.617 -20.841 -10.342 357 HA LYS 45 HA LYS 45 -5.388 -19.502 -8.122 358 HB2 LYS 45 HB2 LYS 45 -6.220 -21.476 -6.665 359 HB3 LYS 45 HB1 LYS 45 -7.376 -20.680 -7.728 360 HG2 LYS 45 HG2 LYS 45 -7.590 -22.513 -9.065 361 HG3 LYS 45 HG1 LYS 45 -5.868 -22.887 -8.984 362 HD2 LYS 45 HD2 LYS 45 -6.100 -23.983 -6.881 363 HD3 LYS 45 HD1 LYS 45 -7.723 -23.333 -6.639 364 HE2 LYS 45 HE2 LYS 45 -7.218 -25.828 -7.624 365 HE3 LYS 45 HE1 LYS 45 -8.693 -24.919 -7.958 366 HZ1 LYS 45 HZ1 LYS 45 -7.717 -24.067 -9.961 367 HZ2 LYS 45 HZ2 LYS 45 -7.609 -25.763 -9.977 368 HZ3 LYS 45 HZ3 LYS 45 -6.238 -24.824 -9.623 369 H CYS 46 H CYS 46 -4.469 -20.668 -5.991 370 HA CYS 46 HA CYS 46 -2.328 -22.537 -6.451 371 HB2 CYS 46 HB2 CYS 46 -0.517 -20.937 -5.754 372 HB3 CYS 46 HB1 CYS 46 -1.182 -20.634 -7.360 373 H THR 47 H THR 47 -1.379 -23.265 -4.543 374 HA THR 47 HA THR 47 -2.757 -22.355 -2.088 375 HB THR 47 HB THR 47 -2.047 -24.746 -1.304 376 HG1 THR 47 HG1 THR 47 -2.284 -26.089 -3.328 377 HG21 THR 47 HG21 THR 47 -4.333 -23.715 -2.805 378 HG22 THR 47 HG22 THR 47 -4.303 -24.725 -1.361 379 HG23 THR 47 HG23 THR 47 -4.155 -25.463 -2.956 380 H CYS 48 H CYS 48 -1.511 -21.348 -0.673 381 HA CYS 48 HA CYS 48 1.378 -21.957 -0.678 382 HB2 CYS 48 HB2 CYS 48 1.868 -19.711 -0.194 383 HB3 CYS 48 HB1 CYS 48 0.587 -19.613 -1.398 384 H TYR 49 H TYR 49 2.460 -21.832 1.410 385 HA TYR 49 HA TYR 49 0.634 -22.238 3.701 386 HB2 TYR 49 HB2 TYR 49 3.000 -23.947 2.904 387 HB3 TYR 49 HB1 TYR 49 2.194 -24.046 4.470 388 HD1 TYR 49 HD1 TYR 49 0.393 -25.498 4.728 389 HD2 TYR 49 HD2 TYR 49 1.415 -24.101 0.798 390 HE1 TYR 49 HE1 TYR 49 -1.337 -26.980 3.754 391 HE2 TYR 49 HE2 TYR 49 -0.316 -25.584 -0.179 392 HH TYR 49 HH TYR 49 -1.916 -27.063 0.234 393 H PHE 50 H PHE 50 1.577 -21.775 5.768 394 HA PHE 50 HA PHE 50 3.802 -19.864 5.553 395 HB2 PHE 50 HB2 PHE 50 1.906 -18.822 6.543 396 HB3 PHE 50 HB1 PHE 50 1.603 -20.204 7.591 397 HD1 PHE 50 HD1 PHE 50 5.062 -19.052 7.033 398 HD2 PHE 50 HD2 PHE 50 1.622 -18.777 9.598 399 HE1 PHE 50 HE1 PHE 50 6.457 -18.028 8.795 400 HE2 PHE 50 HE2 PHE 50 3.028 -17.750 11.363 401 HZ PHE 50 HZ PHE 50 5.446 -17.375 10.962 402 H THR 51 H THR 51 5.661 -20.997 5.790 403 HA THR 51 HA THR 51 6.037 -23.335 7.265 404 HB THR 51 HB THR 51 8.062 -21.164 6.674 405 HG1 THR 51 HG1 THR 51 8.499 -22.926 5.012 406 HG21 THR 51 HG21 THR 51 9.236 -22.486 8.141 407 HG22 THR 51 HG22 THR 51 9.468 -23.447 6.680 408 HG23 THR 51 HG23 THR 51 8.221 -23.897 7.841 409 H THR 52 H THR 52 5.042 -23.200 9.280 410 HA THR 52 HA THR 52 6.206 -21.275 11.193 411 HB THR 52 HB THR 52 4.231 -21.618 12.544 412 HG1 THR 52 HG1 THR 52 3.757 -23.725 12.268 413 HG21 THR 52 HG21 THR 52 2.961 -20.269 11.250 414 HG22 THR 52 HG22 THR 52 2.820 -21.485 9.980 415 HG23 THR 52 HG23 THR 52 4.238 -20.437 10.045 416 H GLY 53 H GLY 53 7.962 -22.213 12.098 417 HA2 GLY 53 HA2 GLY 53 7.981 -25.063 12.707 418 HA3 GLY 53 HA1 GLY 53 9.319 -23.938 12.920 Start of MODEL 5 1 H1 GLU 1 H1 GLU 1 0.785 -29.288 13.010 2 H2 GLU 1 H2 GLU 1 0.410 -27.709 13.516 3 H3 GLU 1 H3 GLU 1 1.691 -27.976 12.430 4 HA GLU 1 HA GLU 1 -0.150 -29.031 10.956 5 HB2 GLU 1 HB2 GLU 1 -1.802 -28.698 12.893 6 HB3 GLU 1 HB1 GLU 1 -1.747 -26.979 12.498 7 HG2 GLU 1 HG2 GLU 1 -3.512 -27.616 11.155 8 HG3 GLU 1 HG1 GLU 1 -2.179 -27.898 10.036 9 H VAL 2 H VAL 2 1.324 -26.236 12.247 10 HA VAL 2 HA VAL 2 2.182 -24.348 11.269 11 HB VAL 2 HB VAL 2 1.433 -25.663 8.647 12 HG11 VAL 2 HG11 VAL 2 2.098 -23.175 8.755 13 HG12 VAL 2 HG12 VAL 2 3.043 -24.201 7.674 14 HG13 VAL 2 HG13 VAL 2 3.691 -23.747 9.251 15 HG21 VAL 2 HG21 VAL 2 4.184 -25.945 9.184 16 HG22 VAL 2 HG22 VAL 2 2.971 -27.225 9.170 17 HG23 VAL 2 HG23 VAL 2 3.366 -26.400 10.679 18 H ILE 3 H ILE 3 0.450 -24.245 8.389 19 HA ILE 3 HA ILE 3 -1.983 -23.064 9.358 20 HB ILE 3 HB ILE 3 0.128 -21.363 9.514 21 HG12 ILE 3 HG12 ILE 3 -2.728 -20.708 8.728 22 HG13 ILE 3 HG11 ILE 3 -2.112 -20.905 10.370 23 HG21 ILE 3 HG21 ILE 3 0.452 -21.536 7.025 24 HG22 ILE 3 HG22 ILE 3 0.147 -19.892 7.589 25 HG23 ILE 3 HG23 ILE 3 -1.143 -20.814 6.817 26 HD11 ILE 3 HD11 ILE 3 -2.252 -18.521 9.821 27 HD12 ILE 3 HD12 ILE 3 -1.259 -18.774 8.386 28 HD13 ILE 3 HD13 ILE 3 -0.561 -18.996 9.991 29 H LYS 4 H LYS 4 -3.200 -22.031 7.490 30 HA LYS 4 HA LYS 4 -2.528 -23.414 4.958 31 HB2 LYS 4 HB2 LYS 4 -4.514 -24.338 6.261 32 HB3 LYS 4 HB1 LYS 4 -5.327 -22.811 5.916 33 HG2 LYS 4 HG2 LYS 4 -5.068 -23.180 3.513 34 HG3 LYS 4 HG1 LYS 4 -4.165 -24.665 3.816 35 HD2 LYS 4 HD2 LYS 4 -6.040 -25.855 4.359 36 HD3 LYS 4 HD1 LYS 4 -6.816 -24.473 5.133 37 HE2 LYS 4 HE2 LYS 4 -7.547 -23.581 3.064 38 HE3 LYS 4 HE1 LYS 4 -6.438 -24.593 2.141 39 HZ1 LYS 4 HZ1 LYS 4 -8.145 -25.977 1.919 40 HZ2 LYS 4 HZ2 LYS 4 -9.066 -25.183 3.107 41 HZ3 LYS 4 HZ3 LYS 4 -7.937 -26.371 3.556 42 H LYS 5 H LYS 5 -1.731 -21.809 3.715 43 HA LYS 5 HA LYS 5 -3.332 -19.329 3.501 44 HB2 LYS 5 HB2 LYS 5 -0.919 -19.241 4.476 45 HB3 LYS 5 HB1 LYS 5 -0.415 -19.464 2.801 46 HG2 LYS 5 HG2 LYS 5 -0.561 -17.179 2.762 47 HG3 LYS 5 HG1 LYS 5 -2.264 -17.522 2.457 48 HD2 LYS 5 HD2 LYS 5 -2.758 -17.335 4.850 49 HD3 LYS 5 HD1 LYS 5 -1.050 -17.063 5.198 50 HE2 LYS 5 HE2 LYS 5 -1.129 -15.030 3.739 51 HE3 LYS 5 HE1 LYS 5 -2.866 -15.275 3.555 52 HZ1 LYS 5 HZ1 LYS 5 -2.054 -13.705 5.382 53 HZ2 LYS 5 HZ2 LYS 5 -1.631 -15.115 6.230 54 HZ3 LYS 5 HZ3 LYS 5 -3.248 -14.840 5.784 55 H ASP 6 H ASP 6 -4.542 -19.623 1.715 56 HA ASP 6 HA ASP 6 -3.116 -20.211 -0.795 57 HB2 ASP 6 HB2 ASP 6 -4.958 -21.597 -1.557 58 HB3 ASP 6 HB1 ASP 6 -4.360 -22.231 -0.025 59 H THR 7 H THR 7 -3.657 -18.931 -2.489 60 HA THR 7 HA THR 7 -5.834 -16.989 -2.034 61 HB THR 7 HB THR 7 -4.276 -15.407 -2.363 62 HG1 THR 7 HG1 THR 7 -3.790 -14.999 -4.447 63 HG21 THR 7 HG21 THR 7 -2.532 -16.903 -1.634 64 HG22 THR 7 HG22 THR 7 -1.931 -16.036 -3.048 65 HG23 THR 7 HG23 THR 7 -2.490 -17.701 -3.205 66 HA PRO 8 HA PRO 8 -7.403 -18.413 -5.957 67 HB2 PRO 8 HB2 PRO 8 -9.108 -16.452 -6.565 68 HB3 PRO 8 HB1 PRO 8 -9.295 -17.359 -5.049 69 HG2 PRO 8 HG2 PRO 8 -8.258 -14.616 -5.494 70 HG3 PRO 8 HG1 PRO 8 -9.149 -15.280 -4.115 71 HD2 PRO 8 HD2 PRO 8 -6.314 -14.938 -4.323 72 HD3 PRO 8 HD1 PRO 8 -7.212 -15.738 -3.014 73 H TYR 9 H TYR 9 -7.124 -18.276 -8.205 74 HA TYR 9 HA TYR 9 -5.324 -16.133 -9.123 75 HB2 TYR 9 HB2 TYR 9 -4.761 -18.642 -9.362 76 HB3 TYR 9 HB1 TYR 9 -5.957 -18.643 -10.655 77 HD1 TYR 9 HD1 TYR 9 -3.158 -16.431 -9.481 78 HD2 TYR 9 HD2 TYR 9 -5.124 -18.318 -12.800 79 HE1 TYR 9 HE1 TYR 9 -1.486 -15.453 -11.026 80 HE2 TYR 9 HE2 TYR 9 -3.450 -17.340 -14.347 81 HH TYR 9 HH TYR 9 -1.618 -14.853 -13.739 82 H LYS 10 H LYS 10 -7.857 -18.128 -10.669 83 HA LYS 10 HA LYS 10 -9.347 -17.569 -12.348 84 HB2 LYS 10 HB2 LYS 10 -9.791 -15.084 -10.694 85 HB3 LYS 10 HB1 LYS 10 -10.963 -15.966 -11.674 86 HG2 LYS 10 HG2 LYS 10 -9.578 -17.105 -9.231 87 HG3 LYS 10 HG1 LYS 10 -11.206 -16.423 -9.228 88 HD2 LYS 10 HD2 LYS 10 -11.815 -18.085 -11.027 89 HD3 LYS 10 HD1 LYS 10 -10.241 -18.841 -10.778 90 HE2 LYS 10 HE2 LYS 10 -11.753 -18.375 -8.294 91 HE3 LYS 10 HE1 LYS 10 -12.522 -19.509 -9.403 92 HZ1 LYS 10 HZ1 LYS 10 -10.376 -20.688 -9.542 93 HZ2 LYS 10 HZ2 LYS 10 -11.040 -20.700 -7.979 94 HZ3 LYS 10 HZ3 LYS 10 -9.751 -19.656 -8.350 95 H LYS 11 H LYS 11 -6.521 -16.124 -12.190 96 HA LYS 11 HA LYS 11 -6.839 -13.688 -13.619 97 HB2 LYS 11 HB2 LYS 11 -4.702 -15.190 -12.501 98 HB3 LYS 11 HB1 LYS 11 -4.309 -14.907 -14.197 99 HG2 LYS 11 HG2 LYS 11 -3.469 -13.003 -13.042 100 HG3 LYS 11 HG1 LYS 11 -4.978 -12.464 -13.779 101 HD2 LYS 11 HD2 LYS 11 -5.655 -11.832 -11.725 102 HD3 LYS 11 HD1 LYS 11 -5.733 -13.541 -11.302 103 HE2 LYS 11 HE2 LYS 11 -3.222 -11.859 -11.088 104 HE3 LYS 11 HE1 LYS 11 -4.308 -12.186 -9.739 105 HZ1 LYS 11 HZ1 LYS 11 -2.227 -13.728 -10.394 106 HZ2 LYS 11 HZ2 LYS 11 -3.473 -14.515 -11.240 107 HZ3 LYS 11 HZ3 LYS 11 -3.594 -14.288 -9.561 108 H ARG 12 H ARG 12 -5.754 -16.912 -14.699 109 HA ARG 12 HA ARG 12 -5.588 -17.805 -16.823 110 HB2 ARG 12 HB2 ARG 12 -8.113 -17.746 -16.170 111 HB3 ARG 12 HB1 ARG 12 -8.222 -16.486 -17.400 112 HG2 ARG 12 HG2 ARG 12 -7.192 -18.019 -19.050 113 HG3 ARG 12 HG1 ARG 12 -7.122 -19.283 -17.822 114 HD2 ARG 12 HD2 ARG 12 -9.227 -19.874 -18.336 115 HD3 ARG 12 HD1 ARG 12 -9.782 -18.280 -17.832 116 HE ARG 12 HE ARG 12 -8.691 -18.400 -20.524 117 HH11 ARG 12 HH11 ARG 12 -10.182 -17.928 -22.173 118 HH12 ARG 12 HH12 ARG 12 -11.875 -17.879 -21.815 119 HH21 ARG 12 HH21 ARG 12 -11.457 -18.648 -18.460 120 HH22 ARG 12 HH22 ARG 12 -12.598 -18.288 -19.712 121 H LYS 13 H LYS 13 -3.878 -16.604 -17.680 122 HA LYS 13 HA LYS 13 -4.646 -14.829 -19.856 123 HB2 LYS 13 HB2 LYS 13 -4.359 -13.313 -17.905 124 HB3 LYS 13 HB1 LYS 13 -2.705 -13.898 -17.727 125 HG2 LYS 13 HG2 LYS 13 -2.795 -11.777 -19.014 126 HG3 LYS 13 HG1 LYS 13 -2.155 -13.105 -19.983 127 HD2 LYS 13 HD2 LYS 13 -4.017 -13.200 -21.336 128 HD3 LYS 13 HD1 LYS 13 -5.104 -12.668 -20.054 129 HE2 LYS 13 HE2 LYS 13 -4.480 -11.040 -22.052 130 HE3 LYS 13 HE1 LYS 13 -4.651 -10.422 -20.410 131 HZ1 LYS 13 HZ1 LYS 13 -2.080 -11.301 -21.607 132 HZ2 LYS 13 HZ2 LYS 13 -2.298 -10.546 -20.101 133 HZ3 LYS 13 HZ3 LYS 13 -2.597 -9.688 -21.536 134 H PHE 14 H PHE 14 -1.446 -14.688 -18.531 135 HA PHE 14 HA PHE 14 -0.503 -16.401 -20.746 136 HB2 PHE 14 HB2 PHE 14 0.247 -13.758 -19.914 137 HB3 PHE 14 HB1 PHE 14 1.633 -14.834 -19.732 138 HD1 PHE 14 HD1 PHE 14 3.034 -14.488 -21.581 139 HD2 PHE 14 HD2 PHE 14 -1.203 -14.858 -22.181 140 HE1 PHE 14 HE1 PHE 14 3.379 -14.454 -24.037 141 HE2 PHE 14 HE2 PHE 14 -0.858 -14.825 -24.637 142 HZ PHE 14 HZ PHE 14 1.433 -14.623 -25.565 143 HA PRO 15 HA PRO 15 2.082 -17.725 -17.003 144 HB2 PRO 15 HB2 PRO 15 1.818 -16.459 -14.625 145 HB3 PRO 15 HB1 PRO 15 2.821 -15.812 -15.936 146 HG2 PRO 15 HG2 PRO 15 0.182 -14.922 -14.969 147 HG3 PRO 15 HG1 PRO 15 1.472 -14.000 -15.755 148 HD2 PRO 15 HD2 PRO 15 -0.891 -15.020 -16.981 149 HD3 PRO 15 HD1 PRO 15 0.492 -14.257 -17.796 150 H TYR 16 H TYR 16 1.724 -18.632 -14.579 151 HA TYR 16 HA TYR 16 -0.817 -19.096 -13.546 152 HB2 TYR 16 HB2 TYR 16 -0.791 -21.631 -14.476 153 HB3 TYR 16 HB1 TYR 16 -1.700 -20.332 -15.247 154 HD1 TYR 16 HD1 TYR 16 -1.574 -20.762 -17.558 155 HD2 TYR 16 HD2 TYR 16 1.988 -20.948 -15.164 156 HE1 TYR 16 HE1 TYR 16 -0.208 -21.024 -19.611 157 HE2 TYR 16 HE2 TYR 16 3.354 -21.210 -17.218 158 HH TYR 16 HH TYR 16 1.834 -21.227 -20.446 159 H LYS 17 H LYS 17 2.010 -18.818 -12.831 160 HA LYS 17 HA LYS 17 2.161 -21.085 -10.978 161 HB2 LYS 17 HB2 LYS 17 3.753 -20.995 -13.270 162 HB3 LYS 17 HB1 LYS 17 4.803 -20.402 -11.982 163 HG2 LYS 17 HG2 LYS 17 4.383 -22.376 -10.644 164 HG3 LYS 17 HG1 LYS 17 3.159 -22.940 -11.783 165 HD2 LYS 17 HD2 LYS 17 5.348 -22.565 -13.417 166 HD3 LYS 17 HD1 LYS 17 6.087 -23.155 -11.927 167 HE2 LYS 17 HE2 LYS 17 4.358 -25.015 -11.936 168 HE3 LYS 17 HE1 LYS 17 3.920 -24.493 -13.563 169 HZ1 LYS 17 HZ1 LYS 17 6.729 -25.064 -12.873 170 HZ2 LYS 17 HZ2 LYS 17 5.979 -25.078 -14.397 171 HZ3 LYS 17 HZ3 LYS 17 5.674 -26.325 -13.285 172 H SER 18 H SER 18 4.546 -18.608 -11.852 173 HA SER 18 HA SER 18 4.965 -17.852 -9.136 174 HB2 SER 18 HB2 SER 18 6.011 -15.777 -10.550 175 HB3 SER 18 HB1 SER 18 6.851 -17.299 -10.268 176 HG SER 18 HG SER 18 5.142 -17.509 -12.343 177 H GLU 19 H GLU 19 2.775 -16.832 -11.612 178 HA GLU 19 HA GLU 19 2.147 -14.268 -10.473 179 HB2 GLU 19 HB2 GLU 19 1.807 -15.033 -12.906 180 HB3 GLU 19 HB1 GLU 19 0.361 -15.851 -12.313 181 HG2 GLU 19 HG2 GLU 19 -0.677 -13.866 -12.648 182 HG3 GLU 19 HG1 GLU 19 0.130 -13.359 -11.165 183 H CYS 20 H CYS 20 1.298 -17.509 -9.807 184 HA CYS 20 HA CYS 20 -1.207 -16.846 -8.457 185 HB2 CYS 20 HB2 CYS 20 -0.245 -19.123 -9.722 186 HB3 CYS 20 HB1 CYS 20 -0.106 -19.517 -8.012 187 H LEU 21 H LEU 21 2.140 -17.483 -7.790 188 HA LEU 21 HA LEU 21 1.709 -17.667 -4.907 189 HB2 LEU 21 HB2 LEU 21 3.407 -19.125 -5.581 190 HB3 LEU 21 HB1 LEU 21 4.069 -17.977 -6.743 191 HG LEU 21 HG LEU 21 4.071 -17.260 -3.830 192 HD11 LEU 21 HD11 LEU 21 4.995 -19.608 -4.115 193 HD12 LEU 21 HD12 LEU 21 6.135 -18.435 -3.455 194 HD13 LEU 21 HD13 LEU 21 6.240 -18.909 -5.151 195 HD21 LEU 21 HD21 LEU 21 5.453 -15.611 -4.545 196 HD22 LEU 21 HD22 LEU 21 4.957 -16.053 -6.178 197 HD23 LEU 21 HD23 LEU 21 6.429 -16.738 -5.487 198 H LYS 22 H LYS 22 2.896 -15.444 -7.347 199 HA LYS 22 HA LYS 22 4.186 -13.542 -5.797 200 HB2 LYS 22 HB2 LYS 22 2.864 -13.610 -8.413 201 HB3 LYS 22 HB1 LYS 22 2.834 -12.019 -7.651 202 HG2 LYS 22 HG2 LYS 22 5.388 -13.601 -7.662 203 HG3 LYS 22 HG1 LYS 22 4.909 -12.716 -9.111 204 HD2 LYS 22 HD2 LYS 22 4.743 -10.638 -7.806 205 HD3 LYS 22 HD1 LYS 22 5.186 -11.513 -6.340 206 HE2 LYS 22 HE2 LYS 22 7.182 -10.445 -7.182 207 HE3 LYS 22 HE1 LYS 22 7.335 -12.177 -7.482 208 HZ1 LYS 22 HZ1 LYS 22 6.072 -10.581 -9.569 209 HZ2 LYS 22 HZ2 LYS 22 7.121 -11.911 -9.700 210 HZ3 LYS 22 HZ3 LYS 22 7.742 -10.368 -9.356 211 H ALA 23 H ALA 23 0.764 -14.197 -6.164 212 HA ALA 23 HA ALA 23 -0.087 -11.780 -4.835 213 HB1 ALA 23 HB1 ALA 23 -2.271 -13.283 -4.679 214 HB2 ALA 23 HB2 ALA 23 -1.415 -14.240 -5.888 215 HB3 ALA 23 HB3 ALA 23 -1.779 -12.543 -6.203 216 H CYS 24 H CYS 24 0.342 -15.191 -3.962 217 HA CYS 24 HA CYS 24 -0.729 -15.206 -1.408 218 HB2 CYS 24 HB2 CYS 24 0.790 -16.958 -2.926 219 HB3 CYS 24 HB1 CYS 24 1.825 -16.621 -1.539 220 H ALA 25 H ALA 25 2.541 -14.236 -2.417 221 HA ALA 25 HA ALA 25 3.466 -13.577 0.188 222 HB1 ALA 25 HB1 ALA 25 4.554 -13.664 -2.393 223 HB2 ALA 25 HB2 ALA 25 5.401 -13.248 -0.903 224 HB3 ALA 25 HB3 ALA 25 4.688 -11.977 -1.896 225 H THR 26 H THR 26 1.313 -12.058 -1.977 226 HA THR 26 HA THR 26 1.675 -9.398 -0.810 227 HB THR 26 HB THR 26 -0.303 -10.310 -2.911 228 HG1 THR 26 HG1 THR 26 1.507 -8.911 -4.044 229 HG21 THR 26 HG21 THR 26 -0.887 -8.206 -1.777 230 HG22 THR 26 HG22 THR 26 -0.388 -7.900 -3.441 231 HG23 THR 26 HG23 THR 26 0.725 -7.573 -2.112 232 H SER 27 H SER 27 -0.151 -12.221 -0.326 233 HA SER 27 HA SER 27 -2.649 -11.380 0.487 234 HB2 SER 27 HB2 SER 27 -0.899 -13.494 1.761 235 HB3 SER 27 HB1 SER 27 -2.631 -13.322 2.029 236 HG SER 27 HG SER 27 -2.377 -14.786 0.392 237 H PHE 28 H PHE 28 0.418 -10.792 1.987 238 HA PHE 28 HA PHE 28 -0.858 -9.062 3.947 239 HB2 PHE 28 HB2 PHE 28 -0.458 -11.580 4.800 240 HB3 PHE 28 HB1 PHE 28 1.139 -10.909 5.136 241 HD1 PHE 28 HD1 PHE 28 -2.495 -10.504 5.788 242 HD2 PHE 28 HD2 PHE 28 1.482 -9.309 6.889 243 HE1 PHE 28 HE1 PHE 28 -3.394 -9.370 7.802 244 HE2 PHE 28 HE2 PHE 28 0.583 -8.175 8.903 245 HZ PHE 28 HZ PHE 28 -1.854 -8.206 9.360 246 H THR 29 H THR 29 0.736 -7.745 5.125 247 HA THR 29 HA THR 29 2.503 -6.392 3.560 248 HB THR 29 HB THR 29 3.026 -6.950 6.484 249 HG1 THR 29 HG1 THR 29 1.660 -4.710 6.023 250 HG21 THR 29 HG21 THR 29 3.532 -4.314 6.014 251 HG22 THR 29 HG22 THR 29 3.984 -5.020 4.462 252 HG23 THR 29 HG23 THR 29 4.760 -5.578 5.944 253 H GLY 30 H GLY 30 4.367 -6.824 2.573 254 HA2 GLY 30 HA2 GLY 30 6.664 -7.618 2.719 255 HA3 GLY 30 HA1 GLY 30 6.067 -8.999 3.635 256 H GLY 31 H GLY 31 7.373 -8.310 0.799 257 HA2 GLY 31 HA2 GLY 31 5.617 -10.089 -0.780 258 HA3 GLY 31 HA1 GLY 31 6.753 -8.929 -1.461 259 H ASP 32 H ASP 32 7.511 -11.031 1.246 260 HA ASP 32 HA ASP 32 9.152 -12.733 -0.509 261 HB2 ASP 32 HB2 ASP 32 11.017 -12.577 1.127 262 HB3 ASP 32 HB1 ASP 32 10.668 -11.038 0.342 263 H GLU 33 H GLU 33 10.300 -13.590 2.271 264 HA GLU 33 HA GLU 33 8.600 -15.869 2.572 265 HB2 GLU 33 HB2 GLU 33 10.768 -14.872 4.434 266 HB3 GLU 33 HB1 GLU 33 10.101 -16.503 4.370 267 HG2 GLU 33 HG2 GLU 33 10.815 -16.246 1.791 268 HG3 GLU 33 HG1 GLU 33 11.999 -15.158 2.513 269 H SER 34 H SER 34 8.576 -16.185 5.369 270 HA SER 34 HA SER 34 7.300 -15.722 7.224 271 HB2 SER 34 HB2 SER 34 8.414 -13.345 6.674 272 HB3 SER 34 HB1 SER 34 6.730 -12.930 6.368 273 HG SER 34 HG SER 34 6.292 -13.886 8.467 274 H ARG 35 H ARG 35 5.331 -16.559 7.350 275 HA ARG 35 HA ARG 35 3.046 -16.735 7.144 276 HB2 ARG 35 HB2 ARG 35 3.094 -14.597 5.014 277 HB3 ARG 35 HB1 ARG 35 1.750 -15.110 6.025 278 HG2 ARG 35 HG2 ARG 35 2.377 -13.790 7.750 279 HG3 ARG 35 HG1 ARG 35 4.078 -14.221 7.577 280 HD2 ARG 35 HD2 ARG 35 4.494 -12.522 6.051 281 HD3 ARG 35 HD1 ARG 35 2.821 -12.462 5.505 282 HE ARG 35 HE ARG 35 2.387 -10.933 7.194 283 HH11 ARG 35 HH11 ARG 35 2.950 -9.675 8.999 284 HH12 ARG 35 HH12 ARG 35 4.422 -10.001 9.852 285 HH21 ARG 35 HH21 ARG 35 5.340 -12.635 7.791 286 HH22 ARG 35 HH22 ARG 35 5.776 -11.677 9.167 287 H ILE 36 H ILE 36 5.353 -16.976 4.681 288 HA ILE 36 HA ILE 36 3.731 -19.024 3.355 289 HB ILE 36 HB ILE 36 5.321 -17.294 1.538 290 HG12 ILE 36 HG12 ILE 36 4.008 -15.715 3.043 291 HG13 ILE 36 HG11 ILE 36 3.597 -15.623 1.332 292 HG21 ILE 36 HG21 ILE 36 3.451 -17.865 0.031 293 HG22 ILE 36 HG22 ILE 36 2.623 -18.665 1.367 294 HG23 ILE 36 HG23 ILE 36 4.149 -19.309 0.762 295 HD11 ILE 36 HD11 ILE 36 1.473 -16.241 1.738 296 HD12 ILE 36 HD12 ILE 36 1.824 -16.095 3.459 297 HD13 ILE 36 HD13 ILE 36 2.003 -17.653 2.653 298 H GLN 37 H GLN 37 6.820 -17.418 2.623 299 HA GLN 37 HA GLN 37 8.961 -18.227 2.457 300 HB2 GLN 37 HB2 GLN 37 8.776 -18.827 4.793 301 HB3 GLN 37 HB1 GLN 37 7.886 -20.294 4.389 302 HG2 GLN 37 HG2 GLN 37 9.764 -21.363 3.528 303 HG3 GLN 37 HG1 GLN 37 10.587 -19.847 3.169 304 HE21 GLN 37 HE21 GLN 37 10.354 -18.550 5.698 305 HE22 GLN 37 HE22 GLN 37 11.246 -19.435 6.840 306 H GLU 38 H GLU 38 6.315 -20.480 1.986 307 HA GLU 38 HA GLU 38 7.422 -21.401 -0.491 308 HB2 GLU 38 HB2 GLU 38 8.711 -22.797 1.074 309 HB3 GLU 38 HB1 GLU 38 7.212 -23.385 1.785 310 HG2 GLU 38 HG2 GLU 38 6.619 -24.579 -0.141 311 HG3 GLU 38 HG1 GLU 38 7.666 -23.614 -1.179 312 H GLY 39 H GLY 39 5.860 -22.325 -1.779 313 HA2 GLY 39 HA2 GLY 39 3.369 -23.280 -0.687 314 HA3 GLY 39 HA1 GLY 39 3.226 -21.703 -1.454 315 H LYS 40 H LYS 40 1.881 -24.026 -2.305 316 HA LYS 40 HA LYS 40 3.227 -24.748 -4.827 317 HB2 LYS 40 HB2 LYS 40 2.281 -26.497 -3.152 318 HB3 LYS 40 HB1 LYS 40 0.711 -26.026 -3.804 319 HG2 LYS 40 HG2 LYS 40 1.286 -27.757 -5.251 320 HG3 LYS 40 HG1 LYS 40 1.916 -26.363 -6.128 321 HD2 LYS 40 HD2 LYS 40 4.113 -26.801 -4.809 322 HD3 LYS 40 HD1 LYS 40 3.428 -28.395 -4.495 323 HE2 LYS 40 HE2 LYS 40 4.662 -28.717 -6.478 324 HE3 LYS 40 HE1 LYS 40 3.013 -28.487 -7.056 325 HZ1 LYS 40 HZ1 LYS 40 4.011 -26.962 -8.354 326 HZ2 LYS 40 HZ2 LYS 40 5.328 -26.747 -7.303 327 HZ3 LYS 40 HZ3 LYS 40 3.849 -25.973 -6.985 328 HA PRO 41 HA PRO 41 -0.018 -22.049 -6.473 329 HB2 PRO 41 HB2 PRO 41 1.310 -21.091 -8.567 330 HB3 PRO 41 HB1 PRO 41 1.812 -20.654 -6.919 331 HG2 PRO 41 HG2 PRO 41 3.028 -22.592 -8.816 332 HG3 PRO 41 HG1 PRO 41 3.802 -21.505 -7.657 333 HD2 PRO 41 HD2 PRO 41 3.248 -24.257 -7.247 334 HD3 PRO 41 HD1 PRO 41 3.756 -23.081 -6.012 335 H GLY 42 H GLY 42 -1.202 -21.900 -8.498 336 HA2 GLY 42 HA2 GLY 42 -0.849 -23.824 -10.600 337 HA3 GLY 42 HA1 GLY 42 -2.177 -24.245 -9.522 338 H PHE 43 H PHE 43 -2.695 -23.708 -12.171 339 HA PHE 43 HA PHE 43 -3.445 -20.957 -12.564 340 HB2 PHE 43 HB2 PHE 43 -4.772 -22.095 -14.519 341 HB3 PHE 43 HB1 PHE 43 -3.011 -22.032 -14.581 342 HD1 PHE 43 HD1 PHE 43 -5.938 -24.178 -14.300 343 HD2 PHE 43 HD2 PHE 43 -1.664 -24.034 -13.899 344 HE1 PHE 43 HE1 PHE 43 -5.849 -26.655 -14.371 345 HE2 PHE 43 HE2 PHE 43 -1.574 -26.511 -13.969 346 HZ PHE 43 HZ PHE 43 -3.665 -27.822 -14.204 347 H PHE 44 H PHE 44 -5.333 -19.983 -12.098 348 HA PHE 44 HA PHE 44 -7.587 -19.726 -11.609 349 HB2 PHE 44 HB2 PHE 44 -7.561 -22.222 -12.769 350 HB3 PHE 44 HB1 PHE 44 -8.240 -22.545 -11.176 351 HD1 PHE 44 HD1 PHE 44 -8.540 -20.195 -14.076 352 HD2 PHE 44 HD2 PHE 44 -10.498 -22.071 -10.746 353 HE1 PHE 44 HE1 PHE 44 -10.705 -19.228 -14.806 354 HE2 PHE 44 HE2 PHE 44 -12.663 -21.105 -11.475 355 HZ PHE 44 HZ PHE 44 -12.766 -19.683 -13.504 356 H LYS 45 H LYS 45 -5.187 -20.849 -9.737 357 HA LYS 45 HA LYS 45 -6.281 -20.066 -7.302 358 HB2 LYS 45 HB2 LYS 45 -6.461 -22.422 -6.261 359 HB3 LYS 45 HB1 LYS 45 -7.805 -21.855 -7.252 360 HG2 LYS 45 HG2 LYS 45 -7.446 -23.430 -8.832 361 HG3 LYS 45 HG1 LYS 45 -5.703 -23.173 -8.813 362 HD2 LYS 45 HD2 LYS 45 -5.483 -24.544 -6.805 363 HD3 LYS 45 HD1 LYS 45 -7.234 -24.742 -6.718 364 HE2 LYS 45 HE2 LYS 45 -6.866 -25.605 -9.229 365 HE3 LYS 45 HE1 LYS 45 -5.274 -26.001 -8.582 366 HZ1 LYS 45 HZ1 LYS 45 -7.263 -26.748 -6.731 367 HZ2 LYS 45 HZ2 LYS 45 -6.131 -27.731 -7.531 368 HZ3 LYS 45 HZ3 LYS 45 -7.641 -27.413 -8.246 369 H CYS 46 H CYS 46 -4.930 -20.666 -5.432 370 HA CYS 46 HA CYS 46 -2.393 -21.968 -5.986 371 HB2 CYS 46 HB2 CYS 46 -1.793 -19.412 -4.777 372 HB3 CYS 46 HB1 CYS 46 -1.098 -20.156 -6.212 373 H THR 47 H THR 47 -1.773 -23.059 -4.230 374 HA THR 47 HA THR 47 -2.848 -22.203 -1.616 375 HB THR 47 HB THR 47 -2.436 -24.634 -0.967 376 HG1 THR 47 HG1 THR 47 -1.659 -25.874 -2.450 377 HG21 THR 47 HG21 THR 47 -4.685 -24.112 -1.173 378 HG22 THR 47 HG22 THR 47 -4.517 -25.348 -2.421 379 HG23 THR 47 HG23 THR 47 -4.527 -23.641 -2.866 380 H CYS 48 H CYS 48 -1.419 -21.561 -0.142 381 HA CYS 48 HA CYS 48 1.397 -22.373 -0.501 382 HB2 CYS 48 HB2 CYS 48 0.779 -19.786 0.830 383 HB3 CYS 48 HB1 CYS 48 2.148 -20.229 -0.190 384 H TYR 49 H TYR 49 2.708 -22.220 1.495 385 HA TYR 49 HA TYR 49 1.117 -22.697 3.944 386 HB2 TYR 49 HB2 TYR 49 3.512 -24.301 3.014 387 HB3 TYR 49 HB1 TYR 49 2.656 -24.515 4.541 388 HD1 TYR 49 HD1 TYR 49 2.748 -25.369 1.049 389 HD2 TYR 49 HD2 TYR 49 0.142 -25.047 4.449 390 HE1 TYR 49 HE1 TYR 49 1.096 -26.836 -0.079 391 HE2 TYR 49 HE2 TYR 49 -1.509 -26.515 3.321 392 HH TYR 49 HH TYR 49 -1.084 -28.486 1.227 393 H PHE 50 H PHE 50 2.111 -22.029 5.878 394 HA PHE 50 HA PHE 50 4.307 -20.126 5.463 395 HB2 PHE 50 HB2 PHE 50 2.448 -19.104 6.540 396 HB3 PHE 50 HB1 PHE 50 2.263 -20.454 7.654 397 HD1 PHE 50 HD1 PHE 50 5.517 -18.898 6.693 398 HD2 PHE 50 HD2 PHE 50 2.490 -19.280 9.722 399 HE1 PHE 50 HE1 PHE 50 7.005 -17.779 8.320 400 HE2 PHE 50 HE2 PHE 50 3.985 -18.156 11.348 401 HZ PHE 50 HZ PHE 50 6.242 -17.406 10.648 402 H THR 51 H THR 51 6.207 -21.201 5.612 403 HA THR 51 HA THR 51 6.738 -23.446 7.208 404 HB THR 51 HB THR 51 8.764 -21.342 6.433 405 HG1 THR 51 HG1 THR 51 8.945 -22.798 4.559 406 HG21 THR 51 HG21 THR 51 9.941 -23.759 6.118 407 HG22 THR 51 HG22 THR 51 8.817 -24.136 7.424 408 HG23 THR 51 HG23 THR 51 10.003 -22.846 7.625 409 H THR 52 H THR 52 6.043 -23.263 9.317 410 HA THR 52 HA THR 52 7.544 -21.342 10.985 411 HB THR 52 HB THR 52 4.814 -22.137 11.858 412 HG1 THR 52 HG1 THR 52 3.885 -21.231 10.233 413 HG21 THR 52 HG21 THR 52 6.636 -20.556 12.952 414 HG22 THR 52 HG22 THR 52 4.922 -20.150 13.045 415 HG23 THR 52 HG23 THR 52 5.951 -19.370 11.844 416 H GLY 53 H GLY 53 7.805 -24.274 10.280 417 HA2 GLY 53 HA2 GLY 53 8.953 -25.841 11.680 418 HA3 GLY 53 HA1 GLY 53 8.044 -25.228 13.058 Start of MODEL 6 1 H1 GLU 1 H1 GLU 1 -1.716 -29.517 9.378 2 H2 GLU 1 H2 GLU 1 -2.033 -31.032 10.080 3 H3 GLU 1 H3 GLU 1 -0.768 -30.859 8.959 4 HA GLU 1 HA GLU 1 -0.898 -29.998 11.767 5 HB2 GLU 1 HB2 GLU 1 1.083 -31.433 9.985 6 HB3 GLU 1 HB1 GLU 1 1.496 -30.874 11.605 7 HG2 GLU 1 HG2 GLU 1 -0.998 -32.489 11.247 8 HG3 GLU 1 HG1 GLU 1 0.555 -33.323 11.222 9 H VAL 2 H VAL 2 -0.575 -28.613 8.785 10 HA VAL 2 HA VAL 2 1.181 -26.492 9.858 11 HB VAL 2 HB VAL 2 1.937 -26.170 7.445 12 HG11 VAL 2 HG11 VAL 2 3.416 -28.350 7.640 13 HG12 VAL 2 HG12 VAL 2 2.645 -28.482 9.221 14 HG13 VAL 2 HG13 VAL 2 3.595 -27.051 8.820 15 HG21 VAL 2 HG21 VAL 2 0.051 -28.312 7.105 16 HG22 VAL 2 HG22 VAL 2 1.654 -28.891 6.650 17 HG23 VAL 2 HG23 VAL 2 0.978 -27.462 5.870 18 H ILE 3 H ILE 3 0.812 -24.377 8.916 19 HA ILE 3 HA ILE 3 -1.941 -23.727 8.748 20 HB ILE 3 HB ILE 3 0.630 -22.245 8.405 21 HG12 ILE 3 HG12 ILE 3 -1.865 -21.677 10.033 22 HG13 ILE 3 HG11 ILE 3 -0.511 -22.646 10.620 23 HG21 ILE 3 HG21 ILE 3 -0.529 -21.241 6.606 24 HG22 ILE 3 HG22 ILE 3 -0.885 -20.187 7.975 25 HG23 ILE 3 HG23 ILE 3 -2.085 -21.359 7.429 26 HD11 ILE 3 HD11 ILE 3 1.004 -20.706 10.181 27 HD12 ILE 3 HD12 ILE 3 -0.227 -20.358 11.395 28 HD13 ILE 3 HD13 ILE 3 -0.410 -19.743 9.751 29 H LYS 4 H LYS 4 -3.280 -23.469 7.051 30 HA LYS 4 HA LYS 4 -2.199 -24.076 4.374 31 HB2 LYS 4 HB2 LYS 4 -4.995 -24.296 5.509 32 HB3 LYS 4 HB1 LYS 4 -4.598 -24.558 3.811 33 HG2 LYS 4 HG2 LYS 4 -2.766 -26.183 4.861 34 HG3 LYS 4 HG1 LYS 4 -3.921 -26.227 6.194 35 HD2 LYS 4 HD2 LYS 4 -5.680 -26.614 4.273 36 HD3 LYS 4 HD1 LYS 4 -4.269 -27.148 3.359 37 HE2 LYS 4 HE2 LYS 4 -3.934 -28.399 5.808 38 HE3 LYS 4 HE1 LYS 4 -5.676 -28.484 5.554 39 HZ1 LYS 4 HZ1 LYS 4 -4.536 -29.066 3.117 40 HZ2 LYS 4 HZ2 LYS 4 -5.285 -30.159 4.181 41 HZ3 LYS 4 HZ3 LYS 4 -3.604 -29.918 4.250 42 H LYS 5 H LYS 5 -1.674 -22.220 3.385 43 HA LYS 5 HA LYS 5 -3.683 -20.047 3.392 44 HB2 LYS 5 HB2 LYS 5 -1.647 -19.379 4.586 45 HB3 LYS 5 HB1 LYS 5 -0.670 -19.821 3.184 46 HG2 LYS 5 HG2 LYS 5 -1.048 -17.416 3.150 47 HG3 LYS 5 HG1 LYS 5 -1.950 -18.155 1.826 48 HD2 LYS 5 HD2 LYS 5 -4.002 -17.799 2.838 49 HD3 LYS 5 HD1 LYS 5 -3.323 -17.837 4.466 50 HE2 LYS 5 HE2 LYS 5 -2.495 -15.628 2.618 51 HE3 LYS 5 HE1 LYS 5 -4.083 -15.541 3.381 52 HZ1 LYS 5 HZ1 LYS 5 -2.782 -16.089 5.513 53 HZ2 LYS 5 HZ2 LYS 5 -2.717 -14.505 4.903 54 HZ3 LYS 5 HZ3 LYS 5 -1.420 -15.572 4.644 55 H ASP 6 H ASP 6 -4.737 -20.319 1.507 56 HA ASP 6 HA ASP 6 -3.103 -20.484 -0.949 57 HB2 ASP 6 HB2 ASP 6 -5.016 -21.695 -1.979 58 HB3 ASP 6 HB1 ASP 6 -4.298 -22.580 -0.635 59 H THR 7 H THR 7 -3.625 -19.129 -2.613 60 HA THR 7 HA THR 7 -5.598 -17.041 -1.981 61 HB THR 7 HB THR 7 -4.232 -15.520 -2.990 62 HG1 THR 7 HG1 THR 7 -4.051 -15.937 -5.032 63 HG21 THR 7 HG21 THR 7 -1.833 -16.153 -2.780 64 HG22 THR 7 HG22 THR 7 -2.322 -17.831 -2.551 65 HG23 THR 7 HG23 THR 7 -2.776 -16.611 -1.362 66 HA PRO 8 HA PRO 8 -7.853 -18.301 -5.609 67 HB2 PRO 8 HB2 PRO 8 -9.369 -16.145 -6.047 68 HB3 PRO 8 HB1 PRO 8 -9.463 -17.008 -4.498 69 HG2 PRO 8 HG2 PRO 8 -8.175 -14.418 -5.139 70 HG3 PRO 8 HG1 PRO 8 -8.938 -14.962 -3.638 71 HD2 PRO 8 HD2 PRO 8 -6.139 -14.966 -4.244 72 HD3 PRO 8 HD1 PRO 8 -6.933 -15.635 -2.802 73 H TYR 9 H TYR 9 -7.851 -18.254 -7.868 74 HA TYR 9 HA TYR 9 -6.585 -16.000 -9.247 75 HB2 TYR 9 HB2 TYR 9 -4.934 -17.958 -8.605 76 HB3 TYR 9 HB1 TYR 9 -5.680 -18.751 -9.994 77 HD1 TYR 9 HD1 TYR 9 -4.398 -15.338 -9.078 78 HD2 TYR 9 HD2 TYR 9 -4.651 -18.428 -12.052 79 HE1 TYR 9 HE1 TYR 9 -3.004 -13.978 -10.612 80 HE2 TYR 9 HE2 TYR 9 -3.256 -17.067 -13.585 81 HH TYR 9 HH TYR 9 -2.352 -15.043 -13.935 82 H LYS 10 H LYS 10 -6.303 -17.780 -11.627 83 HA LYS 10 HA LYS 10 -8.778 -18.892 -12.369 84 HB2 LYS 10 HB2 LYS 10 -9.462 -16.467 -12.126 85 HB3 LYS 10 HB1 LYS 10 -8.384 -16.107 -13.474 86 HG2 LYS 10 HG2 LYS 10 -9.632 -17.831 -14.829 87 HG3 LYS 10 HG1 LYS 10 -10.790 -17.947 -13.504 88 HD2 LYS 10 HD2 LYS 10 -11.137 -15.453 -13.702 89 HD3 LYS 10 HD1 LYS 10 -10.155 -15.496 -15.167 90 HE2 LYS 10 HE2 LYS 10 -11.886 -16.266 -16.386 91 HE3 LYS 10 HE1 LYS 10 -12.185 -17.567 -15.233 92 HZ1 LYS 10 HZ1 LYS 10 -13.574 -16.223 -13.963 93 HZ2 LYS 10 HZ2 LYS 10 -14.002 -15.837 -15.562 94 HZ3 LYS 10 HZ3 LYS 10 -13.009 -14.788 -14.667 95 H LYS 11 H LYS 11 -6.326 -16.738 -13.805 96 HA LYS 11 HA LYS 11 -4.590 -18.309 -15.020 97 HB2 LYS 11 HB2 LYS 11 -5.592 -18.795 -17.328 98 HB3 LYS 11 HB1 LYS 11 -6.098 -19.841 -16.005 99 HG2 LYS 11 HG2 LYS 11 -8.245 -19.258 -16.370 100 HG3 LYS 11 HG1 LYS 11 -7.840 -17.570 -16.056 101 HD2 LYS 11 HD2 LYS 11 -7.368 -17.141 -18.342 102 HD3 LYS 11 HD1 LYS 11 -7.288 -18.859 -18.730 103 HE2 LYS 11 HE2 LYS 11 -9.789 -18.852 -17.875 104 HE3 LYS 11 HE1 LYS 11 -9.693 -17.133 -18.260 105 HZ1 LYS 11 HZ1 LYS 11 -8.528 -18.565 -20.358 106 HZ2 LYS 11 HZ2 LYS 11 -9.947 -17.631 -20.385 107 HZ3 LYS 11 HZ3 LYS 11 -10.024 -19.288 -20.016 108 H ARG 12 H ARG 12 -4.796 -15.662 -14.366 109 HA ARG 12 HA ARG 12 -5.318 -13.854 -16.432 110 HB2 ARG 12 HB2 ARG 12 -4.140 -13.766 -13.846 111 HB3 ARG 12 HB1 ARG 12 -3.025 -12.968 -14.956 112 HG2 ARG 12 HG2 ARG 12 -4.826 -11.527 -15.779 113 HG3 ARG 12 HG1 ARG 12 -5.990 -12.360 -14.747 114 HD2 ARG 12 HD2 ARG 12 -3.630 -11.372 -13.304 115 HD3 ARG 12 HD1 ARG 12 -4.591 -10.095 -14.040 116 HE ARG 12 HE ARG 12 -5.690 -12.111 -12.162 117 HH11 ARG 12 HH11 ARG 12 -7.312 -11.280 -10.826 118 HH12 ARG 12 HH12 ARG 12 -7.799 -9.625 -10.980 119 HH21 ARG 12 HH21 ARG 12 -5.571 -8.918 -13.535 120 HH22 ARG 12 HH22 ARG 12 -6.815 -8.295 -12.509 121 H LYS 13 H LYS 13 -4.395 -13.516 -18.342 122 HA LYS 13 HA LYS 13 -2.939 -13.704 -20.114 123 HB2 LYS 13 HB2 LYS 13 -1.700 -12.133 -18.566 124 HB3 LYS 13 HB1 LYS 13 -0.789 -13.532 -17.996 125 HG2 LYS 13 HG2 LYS 13 0.622 -13.144 -19.718 126 HG3 LYS 13 HG1 LYS 13 -0.657 -13.768 -20.760 127 HD2 LYS 13 HD2 LYS 13 -0.294 -11.688 -21.730 128 HD3 LYS 13 HD1 LYS 13 -1.574 -11.292 -20.584 129 HE2 LYS 13 HE2 LYS 13 1.362 -10.688 -20.427 130 HE3 LYS 13 HE1 LYS 13 -0.012 -9.631 -20.101 131 HZ1 LYS 13 HZ1 LYS 13 0.864 -11.920 -18.422 132 HZ2 LYS 13 HZ2 LYS 13 -0.489 -10.937 -18.116 133 HZ3 LYS 13 HZ3 LYS 13 1.077 -10.277 -18.055 134 H PHE 14 H PHE 14 -3.910 -16.127 -19.419 135 HA PHE 14 HA PHE 14 -3.529 -18.371 -19.723 136 HB2 PHE 14 HB2 PHE 14 -1.227 -17.068 -21.024 137 HB3 PHE 14 HB1 PHE 14 -0.946 -18.738 -20.531 138 HD1 PHE 14 HD1 PHE 14 -1.555 -20.418 -22.025 139 HD2 PHE 14 HD2 PHE 14 -3.642 -16.665 -22.129 140 HE1 PHE 14 HE1 PHE 14 -2.888 -21.212 -23.960 141 HE2 PHE 14 HE2 PHE 14 -4.975 -17.460 -24.064 142 HZ PHE 14 HZ PHE 14 -4.597 -19.734 -24.980 143 HA PRO 15 HA PRO 15 -2.051 -20.240 -16.063 144 HB2 PRO 15 HB2 PRO 15 -0.123 -21.741 -17.799 145 HB3 PRO 15 HB1 PRO 15 -1.203 -22.349 -16.530 146 HG2 PRO 15 HG2 PRO 15 -1.753 -22.549 -19.173 147 HG3 PRO 15 HG1 PRO 15 -2.997 -22.448 -17.919 148 HD2 PRO 15 HD2 PRO 15 -2.310 -20.475 -19.964 149 HD3 PRO 15 HD1 PRO 15 -3.703 -20.500 -18.864 150 H TYR 16 H TYR 16 -0.995 -18.593 -14.989 151 HA TYR 16 HA TYR 16 1.919 -18.410 -15.437 152 HB2 TYR 16 HB2 TYR 16 0.198 -16.376 -16.038 153 HB3 TYR 16 HB1 TYR 16 0.614 -15.993 -14.368 154 HD1 TYR 16 HD1 TYR 16 2.296 -17.173 -17.513 155 HD2 TYR 16 HD2 TYR 16 2.525 -14.716 -13.997 156 HE1 TYR 16 HE1 TYR 16 4.501 -16.316 -18.256 157 HE2 TYR 16 HE2 TYR 16 4.730 -13.858 -14.740 158 HH TYR 16 HH TYR 16 6.069 -14.728 -17.899 159 H LYS 17 H LYS 17 1.860 -20.084 -13.731 160 HA LYS 17 HA LYS 17 0.854 -19.842 -11.182 161 HB2 LYS 17 HB2 LYS 17 3.018 -21.112 -10.516 162 HB3 LYS 17 HB1 LYS 17 1.906 -21.878 -11.650 163 HG2 LYS 17 HG2 LYS 17 3.263 -21.208 -13.534 164 HG3 LYS 17 HG1 LYS 17 4.294 -20.218 -12.499 165 HD2 LYS 17 HD2 LYS 17 5.308 -22.079 -11.502 166 HD3 LYS 17 HD1 LYS 17 3.979 -23.156 -11.934 167 HE2 LYS 17 HE2 LYS 17 5.764 -23.710 -13.419 168 HE3 LYS 17 HE1 LYS 17 4.628 -22.755 -14.372 169 HZ1 LYS 17 HZ1 LYS 17 7.274 -22.240 -14.095 170 HZ2 LYS 17 HZ2 LYS 17 6.572 -21.161 -12.986 171 HZ3 LYS 17 HZ3 LYS 17 6.107 -21.126 -14.619 172 H SER 18 H SER 18 3.170 -17.839 -12.667 173 HA SER 18 HA SER 18 4.620 -17.047 -10.328 174 HB2 SER 18 HB2 SER 18 5.911 -16.249 -11.978 175 HB3 SER 18 HB1 SER 18 4.609 -16.415 -13.153 176 HG SER 18 HG SER 18 5.365 -14.234 -11.583 177 H GLU 19 H GLU 19 1.597 -16.115 -11.772 178 HA GLU 19 HA GLU 19 1.426 -13.679 -10.162 179 HB2 GLU 19 HB2 GLU 19 -0.172 -14.869 -12.391 180 HB3 GLU 19 HB1 GLU 19 -0.941 -13.702 -11.314 181 HG2 GLU 19 HG2 GLU 19 1.762 -13.090 -12.469 182 HG3 GLU 19 HG1 GLU 19 0.321 -12.849 -13.455 183 H CYS 20 H CYS 20 0.348 -16.974 -10.140 184 HA CYS 20 HA CYS 20 -1.791 -16.526 -8.243 185 HB2 CYS 20 HB2 CYS 20 -2.322 -18.728 -8.585 186 HB3 CYS 20 HB1 CYS 20 -1.368 -18.475 -10.030 187 H LEU 21 H LEU 21 1.545 -17.569 -8.223 188 HA LEU 21 HA LEU 21 1.596 -18.212 -5.413 189 HB2 LEU 21 HB2 LEU 21 3.089 -19.177 -7.263 190 HB3 LEU 21 HB1 LEU 21 3.983 -17.661 -7.170 191 HG LEU 21 HG LEU 21 4.011 -18.168 -4.588 192 HD11 LEU 21 HD11 LEU 21 3.855 -20.977 -5.707 193 HD12 LEU 21 HD12 LEU 21 2.473 -20.177 -4.960 194 HD13 LEU 21 HD13 LEU 21 3.926 -20.492 -4.013 195 HD21 LEU 21 HD21 LEU 21 6.158 -19.275 -4.886 196 HD22 LEU 21 HD22 LEU 21 5.959 -18.084 -6.171 197 HD23 LEU 21 HD23 LEU 21 5.704 -19.795 -6.509 198 H LYS 22 H LYS 22 2.286 -15.418 -7.414 199 HA LYS 22 HA LYS 22 3.760 -13.923 -5.505 200 HB2 LYS 22 HB2 LYS 22 3.990 -13.082 -7.653 201 HB3 LYS 22 HB1 LYS 22 2.279 -13.281 -8.027 202 HG2 LYS 22 HG2 LYS 22 1.682 -11.404 -6.626 203 HG3 LYS 22 HG1 LYS 22 3.328 -11.279 -6.008 204 HD2 LYS 22 HD2 LYS 22 2.672 -10.997 -8.947 205 HD3 LYS 22 HD1 LYS 22 2.703 -9.619 -7.848 206 HE2 LYS 22 HE2 LYS 22 5.080 -10.832 -7.239 207 HE3 LYS 22 HE1 LYS 22 4.943 -11.190 -8.960 208 HZ1 LYS 22 HZ1 LYS 22 5.401 -9.095 -9.457 209 HZ2 LYS 22 HZ2 LYS 22 5.743 -8.815 -7.816 210 HZ3 LYS 22 HZ3 LYS 22 4.188 -8.511 -8.427 211 H ALA 23 H ALA 23 0.307 -13.936 -6.376 212 HA ALA 23 HA ALA 23 -0.645 -11.904 -4.790 213 HB1 ALA 23 HB1 ALA 23 -2.157 -14.484 -4.812 214 HB2 ALA 23 HB2 ALA 23 -1.867 -13.658 -6.343 215 HB3 ALA 23 HB3 ALA 23 -2.743 -12.836 -5.051 216 H CYS 24 H CYS 24 0.132 -15.222 -3.815 217 HA CYS 24 HA CYS 24 -0.764 -15.000 -1.136 218 HB2 CYS 24 HB2 CYS 24 0.249 -17.027 -2.718 219 HB3 CYS 24 HB1 CYS 24 1.533 -16.773 -1.535 220 H ALA 25 H ALA 25 2.456 -14.620 -2.607 221 HA ALA 25 HA ALA 25 3.757 -13.920 -0.167 222 HB1 ALA 25 HB1 ALA 25 4.678 -14.699 -2.558 223 HB2 ALA 25 HB2 ALA 25 5.665 -13.776 -1.424 224 HB3 ALA 25 HB3 ALA 25 4.852 -12.955 -2.757 225 H THR 26 H THR 26 1.686 -12.216 -2.267 226 HA THR 26 HA THR 26 2.752 -9.584 -1.634 227 HB THR 26 HB THR 26 0.106 -10.175 -2.955 228 HG1 THR 26 HG1 THR 26 2.048 -9.640 -4.693 229 HG21 THR 26 HG21 THR 26 0.268 -7.878 -2.533 230 HG22 THR 26 HG22 THR 26 0.927 -8.008 -4.164 231 HG23 THR 26 HG23 THR 26 2.015 -7.859 -2.784 232 H SER 27 H SER 27 0.629 -11.829 -0.226 233 HA SER 27 HA SER 27 -1.434 -10.552 0.935 234 HB2 SER 27 HB2 SER 27 -1.376 -12.594 1.893 235 HB3 SER 27 HB1 SER 27 0.380 -12.687 1.793 236 HG SER 27 HG SER 27 0.227 -11.011 3.568 237 H PHE 28 H PHE 28 1.922 -9.831 1.475 238 HA PHE 28 HA PHE 28 1.170 -7.477 3.019 239 HB2 PHE 28 HB2 PHE 28 1.595 -9.533 4.578 240 HB3 PHE 28 HB1 PHE 28 3.292 -9.235 4.205 241 HD1 PHE 28 HD1 PHE 28 0.191 -7.474 5.350 242 HD2 PHE 28 HD2 PHE 28 4.484 -7.601 5.388 243 HE1 PHE 28 HE1 PHE 28 0.231 -5.619 6.995 244 HE2 PHE 28 HE2 PHE 28 4.525 -5.745 7.032 245 HZ PHE 28 HZ PHE 28 2.398 -4.754 7.837 246 H THR 29 H THR 29 3.377 -6.345 3.703 247 HA THR 29 HA THR 29 4.643 -5.512 1.360 248 HB THR 29 HB THR 29 5.687 -5.407 4.200 249 HG1 THR 29 HG1 THR 29 3.724 -4.114 2.844 250 HG21 THR 29 HG21 THR 29 6.547 -4.118 1.619 251 HG22 THR 29 HG22 THR 29 7.539 -4.913 2.841 252 HG23 THR 29 HG23 THR 29 6.846 -3.325 3.165 253 H GLY 30 H GLY 30 6.141 -6.420 0.103 254 HA2 GLY 30 HA2 GLY 30 7.179 -8.987 0.493 255 HA3 GLY 30 HA1 GLY 30 7.830 -7.799 -0.634 256 H GLY 31 H GLY 31 9.129 -9.768 1.246 257 HA2 GLY 31 HA2 GLY 31 11.439 -9.372 1.936 258 HA3 GLY 31 HA1 GLY 31 10.908 -7.830 2.601 259 H ASP 32 H ASP 32 8.832 -10.551 3.000 260 HA ASP 32 HA ASP 32 9.759 -10.898 5.784 261 HB2 ASP 32 HB2 ASP 32 6.877 -10.823 4.862 262 HB3 ASP 32 HB1 ASP 32 7.442 -11.045 6.518 263 H GLU 33 H GLU 33 8.389 -12.905 6.699 264 HA GLU 33 HA GLU 33 8.249 -15.041 4.692 265 HB2 GLU 33 HB2 GLU 33 9.603 -16.524 6.220 266 HB3 GLU 33 HB1 GLU 33 10.526 -15.240 5.439 267 HG2 GLU 33 HG2 GLU 33 9.994 -13.854 7.565 268 HG3 GLU 33 HG1 GLU 33 9.582 -15.402 8.297 269 H SER 34 H SER 34 7.962 -14.233 8.152 270 HA SER 34 HA SER 34 6.256 -16.336 8.873 271 HB2 SER 34 HB2 SER 34 7.138 -15.155 10.686 272 HB3 SER 34 HB1 SER 34 6.755 -13.591 9.974 273 HG SER 34 HG SER 34 5.359 -14.751 11.750 274 H ARG 35 H ARG 35 4.811 -16.580 7.151 275 HA ARG 35 HA ARG 35 2.245 -15.648 7.463 276 HB2 ARG 35 HB2 ARG 35 2.134 -14.080 5.438 277 HB3 ARG 35 HB1 ARG 35 2.826 -13.411 6.915 278 HG2 ARG 35 HG2 ARG 35 5.061 -13.671 6.092 279 HG3 ARG 35 HG1 ARG 35 4.519 -14.666 4.742 280 HD2 ARG 35 HD2 ARG 35 3.035 -12.404 4.354 281 HD3 ARG 35 HD1 ARG 35 4.505 -11.728 5.049 282 HE ARG 35 HE ARG 35 4.776 -13.613 2.809 283 HH11 ARG 35 HH11 ARG 35 5.969 -12.767 1.064 284 HH12 ARG 35 HH12 ARG 35 6.404 -11.092 1.054 285 HH21 ARG 35 HH21 ARG 35 4.886 -10.399 4.090 286 HH22 ARG 35 HH22 ARG 35 5.793 -9.754 2.763 287 H ILE 36 H ILE 36 4.794 -16.551 5.266 288 HA ILE 36 HA ILE 36 3.048 -18.566 4.058 289 HB ILE 36 HB ILE 36 4.843 -16.854 2.336 290 HG12 ILE 36 HG12 ILE 36 2.979 -15.515 3.437 291 HG13 ILE 36 HG11 ILE 36 2.937 -15.548 1.676 292 HG21 ILE 36 HG21 ILE 36 3.148 -19.200 1.973 293 HG22 ILE 36 HG22 ILE 36 4.371 -18.521 0.899 294 HG23 ILE 36 HG23 ILE 36 2.723 -17.896 0.864 295 HD11 ILE 36 HD11 ILE 36 0.867 -16.300 3.435 296 HD12 ILE 36 HD12 ILE 36 1.476 -17.805 2.750 297 HD13 ILE 36 HD13 ILE 36 0.907 -16.520 1.687 298 H GLN 37 H GLN 37 6.343 -17.196 3.888 299 HA GLN 37 HA GLN 37 8.404 -18.192 4.047 300 HB2 GLN 37 HB2 GLN 37 6.957 -19.358 6.025 301 HB3 GLN 37 HB1 GLN 37 7.379 -20.772 5.057 302 HG2 GLN 37 HG2 GLN 37 9.392 -18.698 5.958 303 HG3 GLN 37 HG1 GLN 37 9.078 -20.194 6.831 304 HE21 GLN 37 HE21 GLN 37 10.832 -18.811 4.198 305 HE22 GLN 37 HE22 GLN 37 11.446 -20.263 3.566 306 H GLU 38 H GLU 38 5.953 -20.632 3.101 307 HA GLU 38 HA GLU 38 7.354 -21.032 0.584 308 HB2 GLU 38 HB2 GLU 38 8.435 -22.600 2.197 309 HB3 GLU 38 HB1 GLU 38 6.871 -23.370 2.439 310 HG2 GLU 38 HG2 GLU 38 6.753 -24.030 0.130 311 HG3 GLU 38 HG1 GLU 38 8.160 -23.051 -0.280 312 H GLY 39 H GLY 39 6.049 -21.753 -1.013 313 HA2 GLY 39 HA2 GLY 39 3.429 -22.852 -0.415 314 HA3 GLY 39 HA1 GLY 39 3.417 -21.262 -1.171 315 H LYS 40 H LYS 40 2.222 -23.382 -2.448 316 HA LYS 40 HA LYS 40 4.127 -23.989 -4.619 317 HB2 LYS 40 HB2 LYS 40 2.186 -25.682 -3.191 318 HB3 LYS 40 HB1 LYS 40 2.150 -25.841 -4.948 319 HG2 LYS 40 HG2 LYS 40 4.628 -26.157 -4.924 320 HG3 LYS 40 HG1 LYS 40 4.579 -26.134 -3.164 321 HD2 LYS 40 HD2 LYS 40 4.405 -28.407 -3.467 322 HD3 LYS 40 HD1 LYS 40 2.695 -27.996 -3.581 323 HE2 LYS 40 HE2 LYS 40 4.441 -27.998 -6.042 324 HE3 LYS 40 HE1 LYS 40 3.722 -29.492 -5.442 325 HZ1 LYS 40 HZ1 LYS 40 2.176 -28.648 -6.943 326 HZ2 LYS 40 HZ2 LYS 40 2.355 -27.051 -6.392 327 HZ3 LYS 40 HZ3 LYS 40 1.556 -28.200 -5.429 328 HA PRO 41 HA PRO 41 1.080 -22.099 -7.256 329 HB2 PRO 41 HB2 PRO 41 1.908 -22.902 -9.641 330 HB3 PRO 41 HB1 PRO 41 3.036 -22.049 -8.564 331 HG2 PRO 41 HG2 PRO 41 2.858 -24.950 -9.192 332 HG3 PRO 41 HG1 PRO 41 4.280 -23.936 -8.917 333 HD2 PRO 41 HD2 PRO 41 2.998 -25.596 -6.992 334 HD3 PRO 41 HD1 PRO 41 4.270 -24.393 -6.684 335 H GLY 42 H GLY 42 -0.596 -22.495 -8.908 336 HA2 GLY 42 HA2 GLY 42 -1.483 -25.201 -9.409 337 HA3 GLY 42 HA1 GLY 42 -2.513 -24.311 -8.291 338 H PHE 43 H PHE 43 -3.117 -25.305 -10.986 339 HA PHE 43 HA PHE 43 -3.226 -23.010 -12.729 340 HB2 PHE 43 HB2 PHE 43 -4.895 -25.483 -13.082 341 HB3 PHE 43 HB1 PHE 43 -4.160 -24.453 -14.312 342 HD1 PHE 43 HD1 PHE 43 -3.568 -27.139 -11.864 343 HD2 PHE 43 HD2 PHE 43 -1.785 -24.627 -14.857 344 HE1 PHE 43 HE1 PHE 43 -1.564 -28.599 -11.896 345 HE2 PHE 43 HE2 PHE 43 0.218 -26.088 -14.890 346 HZ PHE 43 HZ PHE 43 0.330 -28.074 -13.409 347 H PHE 44 H PHE 44 -4.701 -21.445 -12.665 348 HA PHE 44 HA PHE 44 -6.733 -20.385 -12.407 349 HB2 PHE 44 HB2 PHE 44 -8.127 -22.785 -11.353 350 HB3 PHE 44 HB1 PHE 44 -8.658 -21.602 -12.546 351 HD1 PHE 44 HD1 PHE 44 -8.242 -24.897 -12.375 352 HD2 PHE 44 HD2 PHE 44 -6.518 -21.600 -14.524 353 HE1 PHE 44 HE1 PHE 44 -7.570 -26.436 -14.199 354 HE2 PHE 44 HE2 PHE 44 -5.849 -23.140 -16.349 355 HZ PHE 44 HZ PHE 44 -6.375 -25.558 -16.186 356 H LYS 45 H LYS 45 -4.828 -21.656 -10.130 357 HA LYS 45 HA LYS 45 -5.874 -20.010 -8.038 358 HB2 LYS 45 HB2 LYS 45 -6.105 -22.078 -6.457 359 HB3 LYS 45 HB1 LYS 45 -7.452 -21.641 -7.508 360 HG2 LYS 45 HG2 LYS 45 -6.650 -23.279 -9.191 361 HG3 LYS 45 HG1 LYS 45 -5.351 -23.747 -8.094 362 HD2 LYS 45 HD2 LYS 45 -7.165 -25.335 -7.838 363 HD3 LYS 45 HD1 LYS 45 -7.095 -24.338 -6.384 364 HE2 LYS 45 HE2 LYS 45 -9.025 -23.156 -6.939 365 HE3 LYS 45 HE1 LYS 45 -8.851 -23.484 -8.663 366 HZ1 LYS 45 HZ1 LYS 45 -9.290 -25.865 -8.111 367 HZ2 LYS 45 HZ2 LYS 45 -10.611 -24.824 -7.866 368 HZ3 LYS 45 HZ3 LYS 45 -9.700 -25.371 -6.541 369 H CYS 46 H CYS 46 -4.668 -20.600 -5.887 370 HA CYS 46 HA CYS 46 -1.991 -21.693 -6.372 371 HB2 CYS 46 HB2 CYS 46 -2.401 -18.960 -6.535 372 HB3 CYS 46 HB1 CYS 46 -1.897 -19.184 -4.869 373 H THR 47 H THR 47 -1.108 -22.629 -4.549 374 HA THR 47 HA THR 47 -2.653 -22.305 -2.050 375 HB THR 47 HB THR 47 -1.765 -24.651 -1.522 376 HG1 THR 47 HG1 THR 47 -1.732 -25.542 -3.968 377 HG21 THR 47 HG21 THR 47 -3.925 -23.873 -3.418 378 HG22 THR 47 HG22 THR 47 -4.034 -24.684 -1.855 379 HG23 THR 47 HG23 THR 47 -3.548 -25.591 -3.287 380 H CYS 48 H CYS 48 -1.517 -22.069 -0.142 381 HA CYS 48 HA CYS 48 1.397 -22.206 -0.224 382 HB2 CYS 48 HB2 CYS 48 0.639 -19.754 1.092 383 HB3 CYS 48 HB1 CYS 48 1.785 -20.003 -0.222 384 H TYR 49 H TYR 49 2.388 -22.165 1.881 385 HA TYR 49 HA TYR 49 0.522 -22.522 4.142 386 HB2 TYR 49 HB2 TYR 49 2.878 -24.342 3.592 387 HB3 TYR 49 HB1 TYR 49 1.703 -24.491 4.897 388 HD1 TYR 49 HD1 TYR 49 1.913 -24.347 1.159 389 HD2 TYR 49 HD2 TYR 49 -0.203 -25.818 4.594 390 HE1 TYR 49 HE1 TYR 49 0.443 -25.689 -0.321 391 HE2 TYR 49 HE2 TYR 49 -1.673 -27.160 3.115 392 HH TYR 49 HH TYR 49 -2.394 -27.308 0.888 393 H PHE 50 H PHE 50 1.330 -21.797 6.116 394 HA PHE 50 HA PHE 50 3.802 -20.225 5.898 395 HB2 PHE 50 HB2 PHE 50 2.039 -18.871 6.681 396 HB3 PHE 50 HB1 PHE 50 1.440 -20.124 7.764 397 HD1 PHE 50 HD1 PHE 50 5.059 -19.469 7.462 398 HD2 PHE 50 HD2 PHE 50 1.494 -18.628 9.711 399 HE1 PHE 50 HE1 PHE 50 6.436 -18.544 9.299 400 HE2 PHE 50 HE2 PHE 50 2.876 -17.706 11.550 401 HZ PHE 50 HZ PHE 50 5.346 -17.662 11.343 402 H THR 51 H THR 51 5.512 -21.487 6.351 403 HA THR 51 HA THR 51 5.698 -23.754 7.868 404 HB THR 51 HB THR 51 7.822 -21.608 7.930 405 HG1 THR 51 HG1 THR 51 6.682 -22.675 5.821 406 HG21 THR 51 HG21 THR 51 9.337 -23.503 8.052 407 HG22 THR 51 HG22 THR 51 7.995 -24.631 7.854 408 HG23 THR 51 HG23 THR 51 8.124 -23.664 9.323 409 H THR 52 H THR 52 4.663 -23.959 9.779 410 HA THR 52 HA THR 52 5.645 -22.312 12.004 411 HB THR 52 HB THR 52 3.104 -22.480 12.787 412 HG1 THR 52 HG1 THR 52 1.990 -23.224 11.170 413 HG21 THR 52 HG21 THR 52 4.339 -20.399 12.624 414 HG22 THR 52 HG22 THR 52 2.790 -20.195 11.805 415 HG23 THR 52 HG23 THR 52 4.260 -20.447 10.863 416 H GLY 53 H GLY 53 6.027 -23.470 13.807 417 HA2 GLY 53 HA2 GLY 53 5.576 -26.347 13.706 418 HA3 GLY 53 HA1 GLY 53 6.537 -25.478 14.900 Start of MODEL 7 1 H1 GLU 1 H1 GLU 1 -1.351 -30.262 9.900 2 H2 GLU 1 H2 GLU 1 -1.344 -28.564 9.915 3 H3 GLU 1 H3 GLU 1 -1.845 -29.427 11.291 4 HA GLU 1 HA GLU 1 0.209 -29.446 12.070 5 HB2 GLU 1 HB2 GLU 1 0.791 -30.750 9.398 6 HB3 GLU 1 HB1 GLU 1 1.990 -30.599 10.682 7 HG2 GLU 1 HG2 GLU 1 1.107 -32.333 11.817 8 HG3 GLU 1 HG1 GLU 1 -0.514 -31.649 11.713 9 H VAL 2 H VAL 2 -0.038 -28.249 8.762 10 HA VAL 2 HA VAL 2 1.753 -26.022 9.501 11 HB VAL 2 HB VAL 2 2.537 -26.093 7.073 12 HG11 VAL 2 HG11 VAL 2 3.931 -28.307 7.687 13 HG12 VAL 2 HG12 VAL 2 3.225 -27.985 9.271 14 HG13 VAL 2 HG13 VAL 2 4.225 -26.762 8.486 15 HG21 VAL 2 HG21 VAL 2 0.908 -27.542 6.083 16 HG22 VAL 2 HG22 VAL 2 1.156 -28.777 7.319 17 HG23 VAL 2 HG23 VAL 2 2.412 -28.463 6.121 18 H ILE 3 H ILE 3 0.366 -24.363 9.626 19 HA ILE 3 HA ILE 3 -2.049 -23.823 8.750 20 HB ILE 3 HB ILE 3 -1.018 -21.984 9.726 21 HG12 ILE 3 HG12 ILE 3 -0.913 -21.235 6.789 22 HG13 ILE 3 HG11 ILE 3 -2.416 -21.374 7.701 23 HG21 ILE 3 HG21 ILE 3 1.146 -22.195 7.609 24 HG22 ILE 3 HG22 ILE 3 1.294 -22.741 9.279 25 HG23 ILE 3 HG23 ILE 3 1.107 -21.023 8.925 26 HD11 ILE 3 HD11 ILE 3 -2.128 -19.298 8.514 27 HD12 ILE 3 HD12 ILE 3 -0.638 -19.147 7.582 28 HD13 ILE 3 HD13 ILE 3 -0.590 -19.783 9.227 29 H LYS 4 H LYS 4 -3.221 -23.530 6.925 30 HA LYS 4 HA LYS 4 -1.826 -23.982 4.362 31 HB2 LYS 4 HB2 LYS 4 -3.927 -25.364 5.426 32 HB3 LYS 4 HB1 LYS 4 -4.767 -24.178 4.428 33 HG2 LYS 4 HG2 LYS 4 -3.611 -24.876 2.454 34 HG3 LYS 4 HG1 LYS 4 -2.455 -25.831 3.387 35 HD2 LYS 4 HD2 LYS 4 -3.975 -27.531 3.796 36 HD3 LYS 4 HD1 LYS 4 -5.372 -26.467 3.633 37 HE2 LYS 4 HE2 LYS 4 -4.688 -28.200 1.707 38 HE3 LYS 4 HE1 LYS 4 -5.405 -26.631 1.337 39 HZ1 LYS 4 HZ1 LYS 4 -3.277 -25.713 0.926 40 HZ2 LYS 4 HZ2 LYS 4 -3.347 -27.177 0.067 41 HZ3 LYS 4 HZ3 LYS 4 -2.482 -27.085 1.527 42 H LYS 5 H LYS 5 -1.401 -22.108 3.384 43 HA LYS 5 HA LYS 5 -3.468 -19.992 3.437 44 HB2 LYS 5 HB2 LYS 5 -1.359 -19.297 4.462 45 HB3 LYS 5 HB1 LYS 5 -0.475 -19.783 3.016 46 HG2 LYS 5 HG2 LYS 5 -0.961 -17.311 3.149 47 HG3 LYS 5 HG1 LYS 5 -1.577 -18.092 1.691 48 HD2 LYS 5 HD2 LYS 5 -3.793 -17.993 2.409 49 HD3 LYS 5 HD1 LYS 5 -3.342 -17.903 4.112 50 HE2 LYS 5 HE2 LYS 5 -2.697 -15.693 2.152 51 HE3 LYS 5 HE1 LYS 5 -4.204 -15.734 3.067 52 HZ1 LYS 5 HZ1 LYS 5 -1.593 -15.000 3.929 53 HZ2 LYS 5 HZ2 LYS 5 -2.236 -16.230 4.909 54 HZ3 LYS 5 HZ3 LYS 5 -3.084 -14.772 4.704 55 H ASP 6 H ASP 6 -4.667 -20.311 1.629 56 HA ASP 6 HA ASP 6 -3.217 -20.414 -0.946 57 HB2 ASP 6 HB2 ASP 6 -4.844 -21.926 -1.838 58 HB3 ASP 6 HB1 ASP 6 -4.313 -22.601 -0.297 59 H THR 7 H THR 7 -3.930 -19.054 -2.525 60 HA THR 7 HA THR 7 -6.335 -17.452 -1.914 61 HB THR 7 HB THR 7 -5.041 -15.620 -1.900 62 HG1 THR 7 HG1 THR 7 -3.759 -15.913 -4.271 63 HG21 THR 7 HG21 THR 7 -2.875 -17.565 -2.704 64 HG22 THR 7 HG22 THR 7 -3.167 -16.864 -1.112 65 HG23 THR 7 HG23 THR 7 -2.552 -15.855 -2.421 66 HA PRO 8 HA PRO 8 -7.417 -18.430 -6.127 67 HB2 PRO 8 HB2 PRO 8 -9.346 -16.641 -6.584 68 HB3 PRO 8 HB1 PRO 8 -9.497 -17.798 -5.246 69 HG2 PRO 8 HG2 PRO 8 -8.858 -14.904 -5.178 70 HG3 PRO 8 HG1 PRO 8 -9.716 -15.903 -3.994 71 HD2 PRO 8 HD2 PRO 8 -6.954 -15.137 -3.926 72 HD3 PRO 8 HD1 PRO 8 -7.799 -16.241 -2.819 73 H TYR 9 H TYR 9 -6.799 -18.000 -8.225 74 HA TYR 9 HA TYR 9 -6.606 -15.551 -9.497 75 HB2 TYR 9 HB2 TYR 9 -4.922 -14.771 -8.013 76 HB3 TYR 9 HB1 TYR 9 -4.071 -16.314 -8.044 77 HD1 TYR 9 HD1 TYR 9 -4.760 -13.198 -9.884 78 HD2 TYR 9 HD2 TYR 9 -2.710 -16.968 -9.964 79 HE1 TYR 9 HE1 TYR 9 -3.406 -12.422 -11.813 80 HE2 TYR 9 HE2 TYR 9 -1.358 -16.197 -11.888 81 HH TYR 9 HH TYR 9 -1.647 -14.463 -13.762 82 H LYS 10 H LYS 10 -4.892 -15.669 -11.366 83 HA LYS 10 HA LYS 10 -3.675 -17.031 -12.909 84 HB2 LYS 10 HB2 LYS 10 -3.985 -19.032 -11.350 85 HB3 LYS 10 HB1 LYS 10 -5.520 -19.298 -12.177 86 HG2 LYS 10 HG2 LYS 10 -3.214 -18.875 -13.971 87 HG3 LYS 10 HG1 LYS 10 -3.151 -20.355 -13.013 88 HD2 LYS 10 HD2 LYS 10 -5.425 -20.946 -13.784 89 HD3 LYS 10 HD1 LYS 10 -5.468 -19.479 -14.762 90 HE2 LYS 10 HE2 LYS 10 -3.244 -20.397 -15.785 91 HE3 LYS 10 HE1 LYS 10 -3.785 -21.944 -15.131 92 HZ1 LYS 10 HZ1 LYS 10 -5.084 -22.140 -16.895 93 HZ2 LYS 10 HZ2 LYS 10 -4.680 -20.583 -17.440 94 HZ3 LYS 10 HZ3 LYS 10 -5.979 -20.800 -16.368 95 H LYS 11 H LYS 11 -7.081 -16.828 -12.317 96 HA LYS 11 HA LYS 11 -8.116 -17.554 -14.811 97 HB2 LYS 11 HB2 LYS 11 -10.082 -16.343 -14.173 98 HB3 LYS 11 HB1 LYS 11 -9.407 -17.039 -12.699 99 HG2 LYS 11 HG2 LYS 11 -8.329 -14.901 -12.156 100 HG3 LYS 11 HG1 LYS 11 -8.943 -14.194 -13.651 101 HD2 LYS 11 HD2 LYS 11 -10.981 -15.469 -11.920 102 HD3 LYS 11 HD1 LYS 11 -10.238 -14.007 -11.269 103 HE2 LYS 11 HE2 LYS 11 -10.847 -12.741 -13.235 104 HE3 LYS 11 HE1 LYS 11 -11.401 -14.198 -14.060 105 HZ1 LYS 11 HZ1 LYS 11 -13.214 -12.863 -13.084 106 HZ2 LYS 11 HZ2 LYS 11 -12.571 -13.154 -11.539 107 HZ3 LYS 11 HZ3 LYS 11 -13.154 -14.445 -12.476 108 H ARG 12 H ARG 12 -5.767 -15.382 -14.355 109 HA ARG 12 HA ARG 12 -6.716 -13.563 -16.487 110 HB2 ARG 12 HB2 ARG 12 -5.886 -12.781 -14.069 111 HB3 ARG 12 HB1 ARG 12 -4.313 -12.899 -14.858 112 HG2 ARG 12 HG2 ARG 12 -4.851 -10.737 -15.455 113 HG3 ARG 12 HG1 ARG 12 -5.615 -11.592 -16.795 114 HD2 ARG 12 HD2 ARG 12 -6.894 -10.395 -14.351 115 HD3 ARG 12 HD1 ARG 12 -7.321 -10.170 -16.044 116 HE ARG 12 HE ARG 12 -7.677 -12.835 -14.846 117 HH11 ARG 12 HH11 ARG 12 -9.771 -13.664 -15.111 118 HH12 ARG 12 HH12 ARG 12 -11.022 -12.657 -15.756 119 HH21 ARG 12 HH21 ARG 12 -8.969 -9.887 -16.129 120 HH22 ARG 12 HH22 ARG 12 -10.568 -10.519 -16.332 121 H LYS 13 H LYS 13 -4.803 -12.674 -17.810 122 HA LYS 13 HA LYS 13 -3.620 -14.798 -19.229 123 HB2 LYS 13 HB2 LYS 13 -3.344 -11.829 -19.219 124 HB3 LYS 13 HB1 LYS 13 -2.089 -12.771 -20.027 125 HG2 LYS 13 HG2 LYS 13 -4.895 -13.564 -20.599 126 HG3 LYS 13 HG1 LYS 13 -4.372 -12.016 -21.262 127 HD2 LYS 13 HD2 LYS 13 -2.485 -13.070 -22.375 128 HD3 LYS 13 HD1 LYS 13 -2.857 -14.618 -21.615 129 HE2 LYS 13 HE2 LYS 13 -3.720 -13.946 -24.093 130 HE3 LYS 13 HE1 LYS 13 -4.597 -15.050 -23.036 131 HZ1 LYS 13 HZ1 LYS 13 -5.980 -13.241 -23.966 132 HZ2 LYS 13 HZ2 LYS 13 -5.036 -12.116 -23.112 133 HZ3 LYS 13 HZ3 LYS 13 -5.961 -13.268 -22.271 134 H PHE 14 H PHE 14 -1.274 -15.121 -19.562 135 HA PHE 14 HA PHE 14 0.908 -15.369 -18.833 136 HB2 PHE 14 HB2 PHE 14 0.160 -13.098 -17.491 137 HB3 PHE 14 HB1 PHE 14 0.561 -14.191 -16.168 138 HD1 PHE 14 HD1 PHE 14 2.812 -14.645 -15.618 139 HD2 PHE 14 HD2 PHE 14 1.862 -12.855 -19.407 140 HE1 PHE 14 HE1 PHE 14 5.227 -14.292 -16.057 141 HE2 PHE 14 HE2 PHE 14 4.277 -12.503 -19.845 142 HZ PHE 14 HZ PHE 14 5.959 -13.220 -18.170 143 HA PRO 15 HA PRO 15 0.260 -19.291 -16.823 144 HB2 PRO 15 HB2 PRO 15 3.038 -18.807 -15.827 145 HB3 PRO 15 HB1 PRO 15 2.358 -20.240 -16.621 146 HG2 PRO 15 HG2 PRO 15 3.926 -18.497 -17.915 147 HG3 PRO 15 HG1 PRO 15 2.608 -19.368 -18.714 148 HD2 PRO 15 HD2 PRO 15 2.783 -16.501 -18.005 149 HD3 PRO 15 HD1 PRO 15 1.770 -17.307 -19.221 150 H TYR 16 H TYR 16 1.287 -20.165 -14.473 151 HA TYR 16 HA TYR 16 0.294 -18.208 -12.488 152 HB2 TYR 16 HB2 TYR 16 0.101 -20.663 -11.267 153 HB3 TYR 16 HB1 TYR 16 -1.227 -19.826 -12.073 154 HD1 TYR 16 HD1 TYR 16 0.703 -22.800 -12.001 155 HD2 TYR 16 HD2 TYR 16 -1.351 -20.155 -14.691 156 HE1 TYR 16 HE1 TYR 16 0.587 -24.610 -13.692 157 HE2 TYR 16 HE2 TYR 16 -1.467 -21.965 -16.383 158 HH TYR 16 HH TYR 16 -0.085 -24.101 -16.887 159 H LYS 17 H LYS 17 1.932 -21.299 -11.996 160 HA LYS 17 HA LYS 17 3.622 -21.713 -10.421 161 HB2 LYS 17 HB2 LYS 17 4.829 -20.074 -12.651 162 HB3 LYS 17 HB1 LYS 17 5.805 -20.875 -11.418 163 HG2 LYS 17 HG2 LYS 17 4.829 -23.044 -12.021 164 HG3 LYS 17 HG1 LYS 17 3.801 -22.263 -13.222 165 HD2 LYS 17 HD2 LYS 17 5.675 -21.644 -14.567 166 HD3 LYS 17 HD1 LYS 17 6.816 -22.049 -13.284 167 HE2 LYS 17 HE2 LYS 17 5.898 -23.746 -15.350 168 HE3 LYS 17 HE1 LYS 17 6.901 -24.191 -13.969 169 HZ1 LYS 17 HZ1 LYS 17 5.091 -24.892 -12.763 170 HZ2 LYS 17 HZ2 LYS 17 4.641 -25.360 -14.333 171 HZ3 LYS 17 HZ3 LYS 17 3.987 -23.952 -13.644 172 H SER 18 H SER 18 4.912 -18.590 -11.392 173 HA SER 18 HA SER 18 5.097 -17.821 -8.580 174 HB2 SER 18 HB2 SER 18 6.582 -17.260 -10.994 175 HB3 SER 18 HB1 SER 18 6.125 -15.761 -10.192 176 HG SER 18 HG SER 18 6.901 -17.574 -8.374 177 H GLU 19 H GLU 19 3.573 -16.738 -11.578 178 HA GLU 19 HA GLU 19 2.565 -14.277 -10.736 179 HB2 GLU 19 HB2 GLU 19 2.455 -15.595 -13.052 180 HB3 GLU 19 HB1 GLU 19 0.843 -15.994 -12.454 181 HG2 GLU 19 HG2 GLU 19 0.675 -13.950 -13.736 182 HG3 GLU 19 HG1 GLU 19 0.466 -13.545 -12.034 183 H CYS 20 H CYS 20 1.732 -17.437 -9.714 184 HA CYS 20 HA CYS 20 -0.883 -16.590 -8.677 185 HB2 CYS 20 HB2 CYS 20 -0.167 -18.932 -9.800 186 HB3 CYS 20 HB1 CYS 20 0.177 -19.305 -8.111 187 H LEU 21 H LEU 21 2.181 -17.977 -7.551 188 HA LEU 21 HA LEU 21 1.542 -17.804 -4.782 189 HB2 LEU 21 HB2 LEU 21 3.570 -18.931 -6.306 190 HB3 LEU 21 HB1 LEU 21 4.386 -17.642 -5.421 191 HG LEU 21 HG LEU 21 4.403 -19.729 -4.114 192 HD11 LEU 21 HD11 LEU 21 3.741 -17.242 -3.209 193 HD12 LEU 21 HD12 LEU 21 4.019 -18.628 -2.155 194 HD13 LEU 21 HD13 LEU 21 2.375 -18.185 -2.614 195 HD21 LEU 21 HD21 LEU 21 1.615 -19.837 -3.396 196 HD22 LEU 21 HD22 LEU 21 2.611 -21.100 -4.117 197 HD23 LEU 21 HD23 LEU 21 1.762 -19.952 -5.150 198 H LYS 22 H LYS 22 2.902 -15.590 -7.127 199 HA LYS 22 HA LYS 22 4.140 -13.721 -5.474 200 HB2 LYS 22 HB2 LYS 22 4.300 -13.517 -7.876 201 HB3 LYS 22 HB1 LYS 22 2.555 -13.311 -8.020 202 HG2 LYS 22 HG2 LYS 22 2.672 -11.211 -6.760 203 HG3 LYS 22 HG1 LYS 22 4.409 -11.421 -6.542 204 HD2 LYS 22 HD2 LYS 22 4.464 -10.078 -8.410 205 HD3 LYS 22 HD1 LYS 22 4.310 -11.640 -9.216 206 HE2 LYS 22 HE2 LYS 22 1.911 -11.367 -9.418 207 HE3 LYS 22 HE1 LYS 22 1.953 -9.901 -8.438 208 HZ1 LYS 22 HZ1 LYS 22 2.517 -10.248 -11.226 209 HZ2 LYS 22 HZ2 LYS 22 3.754 -9.412 -10.414 210 HZ3 LYS 22 HZ3 LYS 22 2.158 -8.833 -10.364 211 H ALA 23 H ALA 23 0.728 -13.939 -6.462 212 HA ALA 23 HA ALA 23 -0.234 -11.669 -5.144 213 HB1 ALA 23 HB1 ALA 23 -1.350 -14.072 -6.341 214 HB2 ALA 23 HB2 ALA 23 -2.035 -12.450 -6.244 215 HB3 ALA 23 HB3 ALA 23 -2.255 -13.582 -4.909 216 H CYS 24 H CYS 24 0.189 -14.993 -4.000 217 HA CYS 24 HA CYS 24 -0.926 -14.741 -1.448 218 HB2 CYS 24 HB2 CYS 24 0.241 -16.762 -2.823 219 HB3 CYS 24 HB1 CYS 24 1.522 -16.388 -1.671 220 H ALA 25 H ALA 25 2.514 -14.454 -2.370 221 HA ALA 25 HA ALA 25 3.564 -13.731 0.084 222 HB1 ALA 25 HB1 ALA 25 4.763 -12.201 -2.084 223 HB2 ALA 25 HB2 ALA 25 4.511 -13.891 -2.523 224 HB3 ALA 25 HB3 ALA 25 5.459 -13.483 -1.094 225 H THR 26 H THR 26 1.471 -11.913 -1.954 226 HA THR 26 HA THR 26 2.174 -9.362 -0.710 227 HB THR 26 HB THR 26 -0.113 -9.841 -2.615 228 HG1 THR 26 HG1 THR 26 1.891 -8.960 -3.974 229 HG21 THR 26 HG21 THR 26 0.853 -7.600 -1.250 230 HG22 THR 26 HG22 THR 26 -0.249 -7.592 -2.627 231 HG23 THR 26 HG23 THR 26 1.488 -7.427 -2.887 232 H SER 27 H SER 27 0.069 -11.980 -0.195 233 HA SER 27 HA SER 27 -2.276 -10.970 0.775 234 HB2 SER 27 HB2 SER 27 -1.873 -13.347 0.785 235 HB3 SER 27 HB1 SER 27 -0.559 -13.169 1.944 236 HG SER 27 HG SER 27 -3.078 -12.146 2.601 237 H PHE 28 H PHE 28 0.870 -10.976 2.396 238 HA PHE 28 HA PHE 28 -0.258 -9.126 4.409 239 HB2 PHE 28 HB2 PHE 28 0.670 -11.637 4.971 240 HB3 PHE 28 HB1 PHE 28 2.120 -10.662 5.215 241 HD1 PHE 28 HD1 PHE 28 -1.564 -10.422 5.927 242 HD2 PHE 28 HD2 PHE 28 2.441 -9.798 7.349 243 HE1 PHE 28 HE1 PHE 28 -2.459 -9.633 8.101 244 HE2 PHE 28 HE2 PHE 28 1.546 -9.009 9.523 245 HZ PHE 28 HZ PHE 28 -0.905 -8.927 9.899 246 H THR 29 H THR 29 1.790 -8.098 5.618 247 HA THR 29 HA THR 29 4.056 -7.512 3.963 248 HB THR 29 HB THR 29 2.160 -5.204 4.401 249 HG1 THR 29 HG1 THR 29 2.161 -5.711 1.902 250 HG21 THR 29 HG21 THR 29 4.346 -4.410 4.025 251 HG22 THR 29 HG22 THR 29 3.614 -4.375 2.421 252 HG23 THR 29 HG23 THR 29 4.706 -5.688 2.863 253 H GLY 30 H GLY 30 4.749 -8.340 6.128 254 HA2 GLY 30 HA2 GLY 30 5.219 -6.058 7.925 255 HA3 GLY 30 HA1 GLY 30 4.553 -7.541 8.602 256 H GLY 31 H GLY 31 5.838 -9.548 8.227 257 HA2 GLY 31 HA2 GLY 31 8.696 -8.953 8.583 258 HA3 GLY 31 HA1 GLY 31 7.883 -10.438 9.066 259 H ASP 32 H ASP 32 10.208 -10.685 7.711 260 HA ASP 32 HA ASP 32 9.651 -11.012 4.867 261 HB2 ASP 32 HB2 ASP 32 11.958 -10.516 6.382 262 HB3 ASP 32 HB1 ASP 32 12.161 -12.150 5.754 263 H GLU 33 H GLU 33 8.865 -12.824 4.027 264 HA GLU 33 HA GLU 33 8.447 -15.063 3.678 265 HB2 GLU 33 HB2 GLU 33 10.241 -15.751 5.994 266 HB3 GLU 33 HB1 GLU 33 9.911 -16.683 4.534 267 HG2 GLU 33 HG2 GLU 33 10.930 -14.270 3.576 268 HG3 GLU 33 HG1 GLU 33 11.922 -14.623 4.990 269 H SER 34 H SER 34 8.635 -14.065 7.080 270 HA SER 34 HA SER 34 6.914 -15.952 8.203 271 HB2 SER 34 HB2 SER 34 7.968 -14.601 9.778 272 HB3 SER 34 HB1 SER 34 7.625 -13.125 8.881 273 HG SER 34 HG SER 34 6.201 -14.295 10.826 274 H ARG 35 H ARG 35 5.304 -16.338 6.617 275 HA ARG 35 HA ARG 35 2.805 -15.335 7.052 276 HB2 ARG 35 HB2 ARG 35 2.610 -13.869 4.898 277 HB3 ARG 35 HB1 ARG 35 3.240 -13.140 6.374 278 HG2 ARG 35 HG2 ARG 35 5.390 -13.017 5.561 279 HG3 ARG 35 HG1 ARG 35 5.207 -14.462 4.566 280 HD2 ARG 35 HD2 ARG 35 3.951 -13.267 2.910 281 HD3 ARG 35 HD1 ARG 35 3.785 -11.862 3.959 282 HE ARG 35 HE ARG 35 6.182 -12.643 2.464 283 HH11 ARG 35 HH11 ARG 35 7.758 -11.012 2.347 284 HH12 ARG 35 HH12 ARG 35 7.595 -9.588 3.320 285 HH21 ARG 35 HH21 ARG 35 4.622 -10.606 4.787 286 HH22 ARG 35 HH22 ARG 35 5.820 -9.358 4.701 287 H ILE 36 H ILE 36 5.144 -16.410 4.702 288 HA ILE 36 HA ILE 36 3.276 -18.440 3.759 289 HB ILE 36 HB ILE 36 4.822 -16.863 1.711 290 HG12 ILE 36 HG12 ILE 36 3.217 -15.356 3.000 291 HG13 ILE 36 HG11 ILE 36 2.910 -15.481 1.271 292 HG21 ILE 36 HG21 ILE 36 2.740 -17.793 0.394 293 HG22 ILE 36 HG22 ILE 36 2.640 -18.919 1.748 294 HG23 ILE 36 HG23 ILE 36 4.099 -18.853 0.763 295 HD11 ILE 36 HD11 ILE 36 0.894 -16.445 1.590 296 HD12 ILE 36 HD12 ILE 36 1.042 -15.934 3.271 297 HD13 ILE 36 HD13 ILE 36 1.530 -17.560 2.798 298 H GLN 37 H GLN 37 6.535 -17.046 3.322 299 HA GLN 37 HA GLN 37 8.603 -18.050 3.319 300 HB2 GLN 37 HB2 GLN 37 7.299 -19.334 5.289 301 HB3 GLN 37 HB1 GLN 37 7.547 -20.686 4.182 302 HG2 GLN 37 HG2 GLN 37 9.750 -18.804 5.060 303 HG3 GLN 37 HG1 GLN 37 9.421 -20.355 5.827 304 HE21 GLN 37 HE21 GLN 37 10.332 -18.896 2.679 305 HE22 GLN 37 HE22 GLN 37 11.095 -20.289 2.083 306 H GLU 38 H GLU 38 6.247 -20.614 2.481 307 HA GLU 38 HA GLU 38 7.374 -20.743 -0.214 308 HB2 GLU 38 HB2 GLU 38 8.637 -22.357 1.254 309 HB3 GLU 38 HB1 GLU 38 7.121 -23.220 1.497 310 HG2 GLU 38 HG2 GLU 38 8.351 -24.257 -0.329 311 HG3 GLU 38 HG1 GLU 38 6.911 -23.473 -0.971 312 H GLY 39 H GLY 39 5.980 -21.693 -1.725 313 HA2 GLY 39 HA2 GLY 39 3.430 -22.773 -0.874 314 HA3 GLY 39 HA1 GLY 39 3.327 -21.192 -1.641 315 H LYS 40 H LYS 40 2.078 -23.415 -2.718 316 HA LYS 40 HA LYS 40 3.720 -23.995 -5.104 317 HB2 LYS 40 HB2 LYS 40 1.661 -25.639 -3.642 318 HB3 LYS 40 HB1 LYS 40 2.083 -25.983 -5.317 319 HG2 LYS 40 HG2 LYS 40 4.398 -25.586 -3.532 320 HG3 LYS 40 HG1 LYS 40 3.419 -27.004 -3.159 321 HD2 LYS 40 HD2 LYS 40 4.149 -26.473 -6.016 322 HD3 LYS 40 HD1 LYS 40 5.367 -27.162 -4.941 323 HE2 LYS 40 HE2 LYS 40 3.710 -28.741 -6.276 324 HE3 LYS 40 HE1 LYS 40 4.171 -29.125 -4.617 325 HZ1 LYS 40 HZ1 LYS 40 2.167 -27.925 -3.874 326 HZ2 LYS 40 HZ2 LYS 40 1.808 -29.284 -4.829 327 HZ3 LYS 40 HZ3 LYS 40 1.706 -27.724 -5.493 328 HA PRO 41 HA PRO 41 0.327 -22.125 -7.319 329 HB2 PRO 41 HB2 PRO 41 0.867 -22.870 -9.816 330 HB3 PRO 41 HB1 PRO 41 2.063 -21.944 -8.885 331 HG2 PRO 41 HG2 PRO 41 2.021 -24.831 -9.565 332 HG3 PRO 41 HG1 PRO 41 3.390 -23.727 -9.382 333 HD2 PRO 41 HD2 PRO 41 2.392 -25.543 -7.419 334 HD3 PRO 41 HD1 PRO 41 3.646 -24.304 -7.193 335 H GLY 42 H GLY 42 -1.526 -22.522 -8.750 336 HA2 GLY 42 HA2 GLY 42 -2.412 -25.196 -9.326 337 HA3 GLY 42 HA1 GLY 42 -3.264 -24.487 -7.957 338 H PHE 43 H PHE 43 -3.055 -24.660 -11.352 339 HA PHE 43 HA PHE 43 -3.929 -22.388 -12.467 340 HB2 PHE 43 HB2 PHE 43 -5.720 -24.008 -13.651 341 HB3 PHE 43 HB1 PHE 43 -3.997 -24.061 -14.023 342 HD1 PHE 43 HD1 PHE 43 -2.519 -25.696 -12.729 343 HD2 PHE 43 HD2 PHE 43 -6.810 -25.875 -12.685 344 HE1 PHE 43 HE1 PHE 43 -2.413 -28.038 -11.922 345 HE2 PHE 43 HE2 PHE 43 -6.705 -28.217 -11.877 346 HZ PHE 43 HZ PHE 43 -4.506 -29.299 -11.496 347 H PHE 44 H PHE 44 -5.350 -20.881 -11.891 348 HA PHE 44 HA PHE 44 -7.460 -19.989 -11.428 349 HB2 PHE 44 HB2 PHE 44 -8.175 -22.509 -12.055 350 HB3 PHE 44 HB1 PHE 44 -8.571 -22.509 -10.338 351 HD1 PHE 44 HD1 PHE 44 -10.683 -21.754 -9.715 352 HD2 PHE 44 HD2 PHE 44 -8.914 -20.272 -13.338 353 HE1 PHE 44 HE1 PHE 44 -12.745 -20.462 -10.191 354 HE2 PHE 44 HE2 PHE 44 -10.976 -18.978 -13.814 355 HZ PHE 44 HZ PHE 44 -12.892 -19.072 -12.241 356 H LYS 45 H LYS 45 -5.139 -20.482 -9.617 357 HA LYS 45 HA LYS 45 -5.765 -19.188 -7.367 358 HB2 LYS 45 HB2 LYS 45 -6.168 -21.100 -5.699 359 HB3 LYS 45 HB1 LYS 45 -7.540 -20.563 -6.658 360 HG2 LYS 45 HG2 LYS 45 -7.773 -22.656 -7.465 361 HG3 LYS 45 HG1 LYS 45 -6.157 -22.558 -8.164 362 HD2 LYS 45 HD2 LYS 45 -5.201 -23.238 -5.961 363 HD3 LYS 45 HD1 LYS 45 -6.841 -23.439 -5.345 364 HE2 LYS 45 HE2 LYS 45 -7.095 -24.952 -7.520 365 HE3 LYS 45 HE1 LYS 45 -5.348 -25.096 -7.334 366 HZ1 LYS 45 HZ1 LYS 45 -6.961 -26.718 -6.104 367 HZ2 LYS 45 HZ2 LYS 45 -7.044 -25.455 -4.971 368 HZ3 LYS 45 HZ3 LYS 45 -5.547 -26.165 -5.347 369 H CYS 46 H CYS 46 -4.518 -20.131 -5.310 370 HA CYS 46 HA CYS 46 -2.122 -21.615 -6.067 371 HB2 CYS 46 HB2 CYS 46 -1.369 -19.220 -4.598 372 HB3 CYS 46 HB1 CYS 46 -0.677 -19.893 -6.073 373 H THR 47 H THR 47 -1.495 -22.896 -4.423 374 HA THR 47 HA THR 47 -2.710 -22.402 -1.783 375 HB THR 47 HB THR 47 -2.021 -24.827 -1.377 376 HG1 THR 47 HG1 THR 47 -0.800 -25.551 -2.919 377 HG21 THR 47 HG21 THR 47 -4.130 -23.842 -3.249 378 HG22 THR 47 HG22 THR 47 -4.299 -24.611 -1.671 379 HG23 THR 47 HG23 THR 47 -3.908 -25.585 -3.088 380 H CYS 48 H CYS 48 -1.402 -21.251 -0.559 381 HA CYS 48 HA CYS 48 1.486 -21.837 -0.586 382 HB2 CYS 48 HB2 CYS 48 0.688 -19.507 0.953 383 HB3 CYS 48 HB1 CYS 48 1.820 -19.624 -0.393 384 H TYR 49 H TYR 49 2.614 -22.049 1.406 385 HA TYR 49 HA TYR 49 0.912 -22.588 3.761 386 HB2 TYR 49 HB2 TYR 49 3.353 -24.216 3.023 387 HB3 TYR 49 HB1 TYR 49 2.175 -24.552 4.293 388 HD1 TYR 49 HD1 TYR 49 0.471 -26.079 3.841 389 HD2 TYR 49 HD2 TYR 49 2.297 -23.950 0.588 390 HE1 TYR 49 HE1 TYR 49 -0.903 -27.367 2.226 391 HE2 TYR 49 HE2 TYR 49 0.923 -25.237 -1.026 392 HH TYR 49 HH TYR 49 -0.807 -26.648 -1.250 393 H PHE 50 H PHE 50 1.637 -21.603 5.591 394 HA PHE 50 HA PHE 50 4.134 -20.082 5.346 395 HB2 PHE 50 HB2 PHE 50 2.428 -18.649 6.037 396 HB3 PHE 50 HB1 PHE 50 1.712 -19.852 7.103 397 HD1 PHE 50 HD1 PHE 50 1.727 -18.564 9.136 398 HD2 PHE 50 HD2 PHE 50 5.344 -19.133 6.889 399 HE1 PHE 50 HE1 PHE 50 3.049 -17.676 11.036 400 HE2 PHE 50 HE2 PHE 50 6.664 -18.245 8.789 401 HZ PHE 50 HZ PHE 50 5.517 -17.515 10.863 402 H THR 51 H THR 51 5.813 -21.303 5.878 403 HA THR 51 HA THR 51 5.963 -23.447 7.613 404 HB THR 51 HB THR 51 8.149 -21.379 7.308 405 HG1 THR 51 HG1 THR 51 7.273 -22.010 5.287 406 HG21 THR 51 HG21 THR 51 9.547 -22.963 8.147 407 HG22 THR 51 HG22 THR 51 8.717 -24.275 7.311 408 HG23 THR 51 HG23 THR 51 8.074 -23.649 8.829 409 H THR 52 H THR 52 5.621 -23.664 9.728 410 HA THR 52 HA THR 52 6.343 -21.476 11.544 411 HB THR 52 HB THR 52 4.133 -21.831 12.747 412 HG1 THR 52 HG1 THR 52 3.871 -23.769 11.163 413 HG21 THR 52 HG21 THR 52 2.872 -20.436 11.024 414 HG22 THR 52 HG22 THR 52 4.278 -20.630 9.978 415 HG23 THR 52 HG23 THR 52 4.439 -19.802 11.526 416 H GLY 53 H GLY 53 7.624 -22.337 13.030 417 HA2 GLY 53 HA2 GLY 53 7.177 -24.111 14.958 418 HA3 GLY 53 HA1 GLY 53 7.497 -25.198 13.610 Start of MODEL 8 1 H1 GLU 1 H1 GLU 1 3.706 -29.052 12.423 2 H2 GLU 1 H2 GLU 1 2.631 -29.687 11.270 3 H3 GLU 1 H3 GLU 1 2.656 -30.314 12.849 4 HA GLU 1 HA GLU 1 0.745 -28.884 12.550 5 HB2 GLU 1 HB2 GLU 1 2.827 -27.510 14.271 6 HB3 GLU 1 HB1 GLU 1 1.078 -27.526 14.510 7 HG2 GLU 1 HG2 GLU 1 2.919 -29.930 14.668 8 HG3 GLU 1 HG1 GLU 1 2.149 -29.123 16.032 9 H VAL 2 H VAL 2 1.817 -28.315 10.157 10 HA VAL 2 HA VAL 2 2.679 -25.553 10.004 11 HB VAL 2 HB VAL 2 3.220 -27.638 8.432 12 HG11 VAL 2 HG11 VAL 2 1.862 -27.755 6.486 13 HG12 VAL 2 HG12 VAL 2 1.006 -26.270 6.898 14 HG13 VAL 2 HG13 VAL 2 0.721 -27.739 7.831 15 HG21 VAL 2 HG21 VAL 2 3.997 -26.060 6.793 16 HG22 VAL 2 HG22 VAL 2 4.106 -25.255 8.358 17 HG23 VAL 2 HG23 VAL 2 2.776 -24.879 7.262 18 H ILE 3 H ILE 3 1.510 -24.132 8.331 19 HA ILE 3 HA ILE 3 -1.393 -24.265 8.874 20 HB ILE 3 HB ILE 3 -1.008 -22.240 9.795 21 HG12 ILE 3 HG12 ILE 3 -0.412 -21.328 6.964 22 HG13 ILE 3 HG11 ILE 3 -2.039 -21.689 7.545 23 HG21 ILE 3 HG21 ILE 3 1.084 -20.980 9.468 24 HG22 ILE 3 HG22 ILE 3 1.548 -22.083 8.171 25 HG23 ILE 3 HG23 ILE 3 1.419 -22.674 9.828 26 HD11 ILE 3 HD11 ILE 3 -0.902 -19.222 7.703 27 HD12 ILE 3 HD12 ILE 3 -0.449 -19.885 9.273 28 HD13 ILE 3 HD13 ILE 3 -2.149 -19.794 8.810 29 H LYS 4 H LYS 4 -2.829 -23.601 7.189 30 HA LYS 4 HA LYS 4 -1.685 -24.017 4.498 31 HB2 LYS 4 HB2 LYS 4 -4.589 -24.305 5.273 32 HB3 LYS 4 HB1 LYS 4 -3.783 -24.916 3.828 33 HG2 LYS 4 HG2 LYS 4 -2.295 -26.255 5.477 34 HG3 LYS 4 HG1 LYS 4 -3.547 -25.903 6.668 35 HD2 LYS 4 HD2 LYS 4 -5.066 -26.738 4.558 36 HD3 LYS 4 HD1 LYS 4 -3.621 -27.726 4.340 37 HE2 LYS 4 HE2 LYS 4 -5.084 -28.969 5.782 38 HE3 LYS 4 HE1 LYS 4 -3.799 -28.325 6.804 39 HZ1 LYS 4 HZ1 LYS 4 -6.170 -28.052 7.617 40 HZ2 LYS 4 HZ2 LYS 4 -6.347 -26.878 6.402 41 HZ3 LYS 4 HZ3 LYS 4 -5.194 -26.666 7.631 42 H LYS 5 H LYS 5 -1.501 -22.258 3.295 43 HA LYS 5 HA LYS 5 -3.542 -20.131 3.542 44 HB2 LYS 5 HB2 LYS 5 -1.382 -19.440 4.574 45 HB3 LYS 5 HB1 LYS 5 -0.586 -19.718 3.026 46 HG2 LYS 5 HG2 LYS 5 -1.165 -17.333 3.308 47 HG3 LYS 5 HG1 LYS 5 -2.051 -18.048 1.961 48 HD2 LYS 5 HD2 LYS 5 -4.074 -17.988 3.074 49 HD3 LYS 5 HD1 LYS 5 -3.323 -18.126 4.664 50 HE2 LYS 5 HE2 LYS 5 -4.350 -15.821 3.863 51 HE3 LYS 5 HE1 LYS 5 -2.852 -15.857 4.793 52 HZ1 LYS 5 HZ1 LYS 5 -2.684 -16.070 1.877 53 HZ2 LYS 5 HZ2 LYS 5 -1.597 -15.366 2.976 54 HZ3 LYS 5 HZ3 LYS 5 -3.023 -14.549 2.546 55 H ASP 6 H ASP 6 -4.724 -20.441 1.725 56 HA ASP 6 HA ASP 6 -3.255 -20.643 -0.837 57 HB2 ASP 6 HB2 ASP 6 -5.098 -21.954 -1.710 58 HB3 ASP 6 HB1 ASP 6 -4.520 -22.700 -0.221 59 H THR 7 H THR 7 -3.765 -19.231 -2.438 60 HA THR 7 HA THR 7 -5.975 -17.346 -1.894 61 HB THR 7 HB THR 7 -3.369 -16.645 -2.004 62 HG1 THR 7 HG1 THR 7 -5.189 -15.318 -1.542 63 HG21 THR 7 HG21 THR 7 -4.395 -16.199 -4.818 64 HG22 THR 7 HG22 THR 7 -3.243 -17.463 -4.384 65 HG23 THR 7 HG23 THR 7 -2.807 -15.766 -4.182 66 HA PRO 8 HA PRO 8 -7.377 -18.464 -5.978 67 HB2 PRO 8 HB2 PRO 8 -9.050 -16.452 -6.525 68 HB3 PRO 8 HB1 PRO 8 -9.314 -17.473 -5.097 69 HG2 PRO 8 HG2 PRO 8 -8.264 -14.709 -5.272 70 HG3 PRO 8 HG1 PRO 8 -9.216 -15.479 -3.993 71 HD2 PRO 8 HD2 PRO 8 -6.376 -15.119 -4.037 72 HD3 PRO 8 HD1 PRO 8 -7.330 -16.022 -2.841 73 H TYR 9 H TYR 9 -7.195 -18.043 -8.253 74 HA TYR 9 HA TYR 9 -6.128 -15.578 -9.263 75 HB2 TYR 9 HB2 TYR 9 -4.083 -16.451 -8.277 76 HB3 TYR 9 HB1 TYR 9 -4.300 -17.987 -9.114 77 HD1 TYR 9 HD1 TYR 9 -3.668 -14.359 -9.591 78 HD2 TYR 9 HD2 TYR 9 -3.678 -18.251 -11.408 79 HE1 TYR 9 HE1 TYR 9 -2.472 -13.442 -11.558 80 HE2 TYR 9 HE2 TYR 9 -2.489 -17.335 -13.377 81 HH TYR 9 HH TYR 9 -0.825 -14.673 -13.446 82 H LYS 10 H LYS 10 -8.231 -16.211 -10.308 83 HA LYS 10 HA LYS 10 -9.017 -18.161 -11.859 84 HB2 LYS 10 HB2 LYS 10 -8.719 -15.479 -13.201 85 HB3 LYS 10 HB1 LYS 10 -10.026 -16.649 -13.361 86 HG2 LYS 10 HG2 LYS 10 -10.555 -16.278 -10.927 87 HG3 LYS 10 HG1 LYS 10 -9.370 -14.971 -10.926 88 HD2 LYS 10 HD2 LYS 10 -10.731 -14.114 -13.006 89 HD3 LYS 10 HD1 LYS 10 -12.016 -15.122 -12.340 90 HE2 LYS 10 HE2 LYS 10 -12.508 -13.369 -11.000 91 HE3 LYS 10 HE1 LYS 10 -11.036 -13.773 -10.116 92 HZ1 LYS 10 HZ1 LYS 10 -10.104 -12.379 -12.231 93 HZ2 LYS 10 HZ2 LYS 10 -10.386 -11.733 -10.685 94 HZ3 LYS 10 HZ3 LYS 10 -11.562 -11.579 -11.901 95 H LYS 11 H LYS 11 -7.138 -15.845 -13.780 96 HA LYS 11 HA LYS 11 -4.998 -17.517 -14.463 97 HB2 LYS 11 HB2 LYS 11 -5.645 -18.379 -16.629 98 HB3 LYS 11 HB1 LYS 11 -6.815 -18.934 -15.437 99 HG2 LYS 11 HG2 LYS 11 -7.236 -16.454 -17.128 100 HG3 LYS 11 HG1 LYS 11 -7.818 -18.051 -17.595 101 HD2 LYS 11 HD2 LYS 11 -8.939 -18.118 -15.270 102 HD3 LYS 11 HD1 LYS 11 -8.645 -16.379 -15.224 103 HE2 LYS 11 HE2 LYS 11 -10.868 -16.748 -16.124 104 HE3 LYS 11 HE1 LYS 11 -9.828 -16.181 -17.430 105 HZ1 LYS 11 HZ1 LYS 11 -9.961 -19.061 -17.012 106 HZ2 LYS 11 HZ2 LYS 11 -9.866 -18.174 -18.459 107 HZ3 LYS 11 HZ3 LYS 11 -11.351 -18.323 -17.647 108 H ARG 12 H ARG 12 -5.594 -14.767 -13.940 109 HA ARG 12 HA ARG 12 -5.852 -12.841 -15.669 110 HB2 ARG 12 HB2 ARG 12 -4.372 -13.009 -13.417 111 HB3 ARG 12 HB1 ARG 12 -3.089 -12.784 -14.607 112 HG2 ARG 12 HG2 ARG 12 -4.816 -10.915 -15.487 113 HG3 ARG 12 HG1 ARG 12 -5.250 -10.916 -13.778 114 HD2 ARG 12 HD2 ARG 12 -2.549 -10.923 -13.575 115 HD3 ARG 12 HD1 ARG 12 -2.737 -10.048 -15.093 116 HE ARG 12 HE ARG 12 -4.404 -9.127 -12.883 117 HH11 ARG 12 HH11 ARG 12 -4.015 -6.981 -12.251 118 HH12 ARG 12 HH12 ARG 12 -2.617 -6.149 -12.843 119 HH21 ARG 12 HH21 ARG 12 -1.484 -8.837 -14.717 120 HH22 ARG 12 HH22 ARG 12 -1.183 -7.200 -14.239 121 H LYS 13 H LYS 13 -5.002 -11.965 -17.520 122 HA LYS 13 HA LYS 13 -4.125 -13.438 -19.592 123 HB2 LYS 13 HB2 LYS 13 -2.714 -11.252 -20.180 124 HB3 LYS 13 HB1 LYS 13 -4.477 -11.259 -20.231 125 HG2 LYS 13 HG2 LYS 13 -4.661 -10.187 -18.130 126 HG3 LYS 13 HG1 LYS 13 -2.989 -10.552 -17.704 127 HD2 LYS 13 HD2 LYS 13 -2.136 -8.959 -19.262 128 HD3 LYS 13 HD1 LYS 13 -3.704 -8.787 -20.052 129 HE2 LYS 13 HE2 LYS 13 -4.121 -7.049 -18.681 130 HE3 LYS 13 HE1 LYS 13 -4.171 -8.194 -17.341 131 HZ1 LYS 13 HZ1 LYS 13 -1.698 -6.916 -18.372 132 HZ2 LYS 13 HZ2 LYS 13 -1.830 -7.915 -17.005 133 HZ3 LYS 13 HZ3 LYS 13 -2.560 -6.381 -17.012 134 H PHE 14 H PHE 14 -2.243 -14.282 -20.400 135 HA PHE 14 HA PHE 14 -0.105 -15.122 -20.401 136 HB2 PHE 14 HB2 PHE 14 0.417 -12.638 -20.186 137 HB3 PHE 14 HB1 PHE 14 0.598 -12.923 -18.455 138 HD1 PHE 14 HD1 PHE 14 1.728 -14.333 -21.743 139 HD2 PHE 14 HD2 PHE 14 2.692 -13.547 -17.631 140 HE1 PHE 14 HE1 PHE 14 4.031 -15.173 -22.124 141 HE2 PHE 14 HE2 PHE 14 4.995 -14.386 -18.011 142 HZ PHE 14 HZ PHE 14 5.664 -15.199 -20.257 143 HA PRO 15 HA PRO 15 -1.525 -16.970 -16.207 144 HB2 PRO 15 HB2 PRO 15 -1.045 -19.305 -18.024 145 HB3 PRO 15 HB1 PRO 15 -2.297 -19.080 -16.786 146 HG2 PRO 15 HG2 PRO 15 -2.810 -18.800 -19.399 147 HG3 PRO 15 HG1 PRO 15 -3.627 -17.832 -18.162 148 HD2 PRO 15 HD2 PRO 15 -1.594 -16.992 -20.142 149 HD3 PRO 15 HD1 PRO 15 -2.773 -16.006 -19.251 150 H TYR 16 H TYR 16 -0.031 -17.524 -14.694 151 HA TYR 16 HA TYR 16 2.413 -18.909 -15.376 152 HB2 TYR 16 HB2 TYR 16 2.493 -16.160 -15.628 153 HB3 TYR 16 HB1 TYR 16 3.091 -16.420 -13.990 154 HD1 TYR 16 HD1 TYR 16 3.424 -18.306 -17.229 155 HD2 TYR 16 HD2 TYR 16 5.418 -16.437 -13.917 156 HE1 TYR 16 HE1 TYR 16 5.609 -19.027 -18.141 157 HE2 TYR 16 HE2 TYR 16 7.607 -17.159 -14.831 158 HH TYR 16 HH TYR 16 8.617 -18.477 -16.352 159 H LYS 17 H LYS 17 1.708 -20.409 -13.853 160 HA LYS 17 HA LYS 17 0.617 -20.383 -11.472 161 HB2 LYS 17 HB2 LYS 17 2.900 -21.769 -10.775 162 HB3 LYS 17 HB1 LYS 17 1.511 -22.442 -11.628 163 HG2 LYS 17 HG2 LYS 17 2.525 -22.150 -13.748 164 HG3 LYS 17 HG1 LYS 17 3.737 -21.040 -13.106 165 HD2 LYS 17 HD2 LYS 17 3.693 -23.736 -11.876 166 HD3 LYS 17 HD1 LYS 17 4.219 -23.675 -13.559 167 HE2 LYS 17 HE2 LYS 17 6.109 -22.463 -13.070 168 HE3 LYS 17 HE1 LYS 17 5.345 -21.616 -11.724 169 HZ1 LYS 17 HZ1 LYS 17 5.801 -23.295 -10.281 170 HZ2 LYS 17 HZ2 LYS 17 7.126 -23.481 -11.328 171 HZ3 LYS 17 HZ3 LYS 17 5.774 -24.500 -11.474 172 H SER 18 H SER 18 3.831 -19.013 -12.041 173 HA SER 18 HA SER 18 4.421 -18.419 -9.330 174 HB2 SER 18 HB2 SER 18 5.817 -18.283 -11.678 175 HB3 SER 18 HB1 SER 18 5.520 -16.579 -11.345 176 HG SER 18 HG SER 18 6.203 -17.913 -9.097 177 H GLU 19 H GLU 19 3.084 -16.423 -11.958 178 HA GLU 19 HA GLU 19 2.829 -13.996 -10.686 179 HB2 GLU 19 HB2 GLU 19 2.199 -14.548 -13.072 180 HB3 GLU 19 HB1 GLU 19 0.679 -15.183 -12.446 181 HG2 GLU 19 HG2 GLU 19 -0.170 -13.107 -12.332 182 HG3 GLU 19 HG1 GLU 19 1.144 -12.610 -11.267 183 H CYS 20 H CYS 20 1.222 -16.939 -9.966 184 HA CYS 20 HA CYS 20 -0.921 -15.630 -8.471 185 HB2 CYS 20 HB2 CYS 20 -1.419 -17.662 -9.788 186 HB3 CYS 20 HB1 CYS 20 -0.280 -18.571 -8.793 187 H LEU 21 H LEU 21 1.797 -17.847 -7.849 188 HA LEU 21 HA LEU 21 1.564 -18.130 -5.111 189 HB2 LEU 21 HB2 LEU 21 3.353 -19.042 -6.830 190 HB3 LEU 21 HB1 LEU 21 4.285 -17.653 -6.270 191 HG LEU 21 HG LEU 21 3.090 -19.811 -4.502 192 HD11 LEU 21 HD11 LEU 21 5.776 -19.341 -5.715 193 HD12 LEU 21 HD12 LEU 21 4.962 -20.862 -5.344 194 HD13 LEU 21 HD13 LEU 21 5.731 -19.935 -4.055 195 HD21 LEU 21 HD21 LEU 21 3.124 -17.984 -3.080 196 HD22 LEU 21 HD22 LEU 21 4.410 -17.178 -3.978 197 HD23 LEU 21 HD23 LEU 21 4.794 -18.519 -2.901 198 H LYS 22 H LYS 22 2.888 -15.424 -6.953 199 HA LYS 22 HA LYS 22 3.991 -13.980 -4.799 200 HB2 LYS 22 HB2 LYS 22 4.063 -13.603 -7.428 201 HB3 LYS 22 HB1 LYS 22 2.718 -12.519 -7.072 202 HG2 LYS 22 HG2 LYS 22 4.042 -11.209 -5.575 203 HG3 LYS 22 HG1 LYS 22 5.330 -12.413 -5.547 204 HD2 LYS 22 HD2 LYS 22 5.072 -11.839 -8.248 205 HD3 LYS 22 HD1 LYS 22 4.830 -10.270 -7.479 206 HE2 LYS 22 HE2 LYS 22 7.155 -12.129 -6.904 207 HE3 LYS 22 HE1 LYS 22 7.231 -10.724 -7.969 208 HZ1 LYS 22 HZ1 LYS 22 7.949 -9.874 -5.970 209 HZ2 LYS 22 HZ2 LYS 22 6.885 -10.822 -5.047 210 HZ3 LYS 22 HZ3 LYS 22 6.299 -9.490 -5.922 211 H ALA 23 H ALA 23 0.767 -13.839 -6.307 212 HA ALA 23 HA ALA 23 -0.380 -11.798 -4.848 213 HB1 ALA 23 HB1 ALA 23 -1.928 -12.540 -6.334 214 HB2 ALA 23 HB2 ALA 23 -2.451 -13.563 -4.997 215 HB3 ALA 23 HB3 ALA 23 -1.370 -14.209 -6.232 216 H CYS 24 H CYS 24 0.584 -14.950 -3.786 217 HA CYS 24 HA CYS 24 -0.982 -14.868 -1.342 218 HB2 CYS 24 HB2 CYS 24 0.148 -16.905 -2.822 219 HB3 CYS 24 HB1 CYS 24 1.238 -16.775 -1.440 220 H ALA 25 H ALA 25 2.398 -14.459 -2.319 221 HA ALA 25 HA ALA 25 3.386 -14.045 0.333 222 HB1 ALA 25 HB1 ALA 25 4.551 -13.360 -2.375 223 HB2 ALA 25 HB2 ALA 25 4.900 -14.791 -1.404 224 HB3 ALA 25 HB3 ALA 25 5.421 -13.200 -0.848 225 H THR 26 H THR 26 2.057 -11.985 -2.168 226 HA THR 26 HA THR 26 2.877 -9.522 -0.895 227 HB THR 26 HB THR 26 2.323 -10.033 -3.429 228 HG1 THR 26 HG1 THR 26 1.751 -7.769 -3.583 229 HG21 THR 26 HG21 THR 26 -0.114 -10.588 -2.539 230 HG22 THR 26 HG22 THR 26 0.119 -9.781 -4.090 231 HG23 THR 26 HG23 THR 26 -0.311 -8.839 -2.662 232 H SER 27 H SER 27 0.363 -11.773 -0.471 233 HA SER 27 HA SER 27 -1.921 -10.504 0.160 234 HB2 SER 27 HB2 SER 27 -1.729 -12.852 0.601 235 HB3 SER 27 HB1 SER 27 -0.478 -12.584 1.812 236 HG SER 27 HG SER 27 -1.971 -11.715 3.163 237 H PHE 28 H PHE 28 1.125 -10.080 1.788 238 HA PHE 28 HA PHE 28 -0.088 -8.582 3.984 239 HB2 PHE 28 HB2 PHE 28 1.737 -9.979 4.635 240 HB3 PHE 28 HB1 PHE 28 2.758 -9.357 3.338 241 HD1 PHE 28 HD1 PHE 28 1.016 -8.414 6.492 242 HD2 PHE 28 HD2 PHE 28 4.020 -7.360 3.609 243 HE1 PHE 28 HE1 PHE 28 1.814 -6.601 7.985 244 HE2 PHE 28 HE2 PHE 28 4.819 -5.548 5.102 245 HZ PHE 28 HZ PHE 28 3.716 -5.169 7.290 246 H THR 29 H THR 29 1.687 -8.043 1.012 247 HA THR 29 HA THR 29 1.966 -6.113 -0.220 248 HB THR 29 HB THR 29 0.671 -4.412 1.861 249 HG1 THR 29 HG1 THR 29 -1.337 -5.227 0.688 250 HG21 THR 29 HG21 THR 29 1.395 -3.431 -0.255 251 HG22 THR 29 HG22 THR 29 -0.367 -3.444 -0.182 252 HG23 THR 29 HG23 THR 29 0.485 -4.644 -1.154 253 H GLY 30 H GLY 30 4.211 -6.226 0.163 254 HA2 GLY 30 HA2 GLY 30 5.860 -4.394 0.660 255 HA3 GLY 30 HA1 GLY 30 5.209 -4.432 2.296 256 H GLY 31 H GLY 31 7.955 -4.953 1.287 257 HA2 GLY 31 HA2 GLY 31 8.842 -7.498 1.128 258 HA3 GLY 31 HA1 GLY 31 9.671 -6.292 2.109 259 H ASP 32 H ASP 32 7.698 -9.118 2.122 260 HA ASP 32 HA ASP 32 8.233 -9.563 4.921 261 HB2 ASP 32 HB2 ASP 32 5.975 -8.099 4.453 262 HB3 ASP 32 HB1 ASP 32 5.335 -9.742 4.430 263 H GLU 33 H GLU 33 8.151 -11.706 5.435 264 HA GLU 33 HA GLU 33 7.202 -13.540 3.314 265 HB2 GLU 33 HB2 GLU 33 9.503 -13.922 5.244 266 HB3 GLU 33 HB1 GLU 33 8.961 -15.098 4.047 267 HG2 GLU 33 HG2 GLU 33 10.887 -13.804 3.207 268 HG3 GLU 33 HG1 GLU 33 9.445 -13.494 2.242 269 H SER 34 H SER 34 7.718 -13.179 6.818 270 HA SER 34 HA SER 34 6.574 -15.468 7.778 271 HB2 SER 34 HB2 SER 34 5.533 -13.273 9.313 272 HB3 SER 34 HB1 SER 34 6.832 -14.389 9.725 273 HG SER 34 HG SER 34 6.998 -11.829 9.036 274 H ARG 35 H ARG 35 4.959 -16.256 6.487 275 HA ARG 35 HA ARG 35 2.355 -16.035 7.108 276 HB2 ARG 35 HB2 ARG 35 3.184 -13.659 5.582 277 HB3 ARG 35 HB1 ARG 35 1.777 -14.485 4.915 278 HG2 ARG 35 HG2 ARG 35 0.494 -14.147 6.828 279 HG3 ARG 35 HG1 ARG 35 1.907 -13.985 7.871 280 HD2 ARG 35 HD2 ARG 35 2.073 -11.760 7.490 281 HD3 ARG 35 HD1 ARG 35 1.785 -11.947 5.763 282 HE ARG 35 HE ARG 35 -0.224 -11.442 7.815 283 HH11 ARG 35 HH11 ARG 35 -2.295 -10.975 7.005 284 HH12 ARG 35 HH12 ARG 35 -2.649 -11.259 5.333 285 HH21 ARG 35 HH21 ARG 35 0.524 -12.443 4.588 286 HH22 ARG 35 HH22 ARG 35 -1.053 -12.089 3.965 287 H ILE 36 H ILE 36 4.793 -16.445 4.733 288 HA ILE 36 HA ILE 36 3.253 -18.609 3.512 289 HB ILE 36 HB ILE 36 4.746 -16.780 1.666 290 HG12 ILE 36 HG12 ILE 36 2.345 -15.816 1.227 291 HG13 ILE 36 HG11 ILE 36 2.027 -16.321 2.883 292 HG21 ILE 36 HG21 ILE 36 2.210 -18.343 1.195 293 HG22 ILE 36 HG22 ILE 36 3.794 -19.115 1.115 294 HG23 ILE 36 HG23 ILE 36 3.400 -17.796 0.013 295 HD11 ILE 36 HD11 ILE 36 2.907 -13.903 2.468 296 HD12 ILE 36 HD12 ILE 36 4.470 -14.684 2.234 297 HD13 ILE 36 HD13 ILE 36 3.627 -14.841 3.773 298 H GLN 37 H GLN 37 6.310 -16.862 2.906 299 HA GLN 37 HA GLN 37 8.481 -17.584 2.811 300 HB2 GLN 37 HB2 GLN 37 7.432 -19.831 4.549 301 HB3 GLN 37 HB1 GLN 37 9.130 -19.462 4.261 302 HG2 GLN 37 HG2 GLN 37 7.515 -17.155 5.133 303 HG3 GLN 37 HG1 GLN 37 7.669 -18.437 6.334 304 HE21 GLN 37 HE21 GLN 37 10.240 -19.380 5.958 305 HE22 GLN 37 HE22 GLN 37 11.370 -18.136 6.198 306 H GLU 38 H GLU 38 5.973 -19.975 2.174 307 HA GLU 38 HA GLU 38 7.202 -20.711 -0.313 308 HB2 GLU 38 HB2 GLU 38 8.470 -22.092 1.351 309 HB3 GLU 38 HB1 GLU 38 6.953 -22.870 1.789 310 HG2 GLU 38 HG2 GLU 38 6.653 -23.537 -0.593 311 HG3 GLU 38 HG1 GLU 38 8.231 -22.843 -0.960 312 H GLY 39 H GLY 39 5.758 -21.736 -1.676 313 HA2 GLY 39 HA2 GLY 39 3.256 -22.794 -0.699 314 HA3 GLY 39 HA1 GLY 39 3.088 -21.235 -1.496 315 H LYS 40 H LYS 40 1.909 -23.652 -2.378 316 HA LYS 40 HA LYS 40 3.425 -24.314 -4.816 317 HB2 LYS 40 HB2 LYS 40 1.214 -25.709 -3.321 318 HB3 LYS 40 HB1 LYS 40 1.617 -26.137 -4.983 319 HG2 LYS 40 HG2 LYS 40 4.015 -26.435 -4.223 320 HG3 LYS 40 HG1 LYS 40 3.436 -26.259 -2.566 321 HD2 LYS 40 HD2 LYS 40 2.472 -28.348 -4.546 322 HD3 LYS 40 HD1 LYS 40 3.587 -28.643 -3.210 323 HE2 LYS 40 HE2 LYS 40 1.764 -27.705 -1.675 324 HE3 LYS 40 HE1 LYS 40 0.677 -27.838 -3.057 325 HZ1 LYS 40 HZ1 LYS 40 0.812 -30.114 -3.062 326 HZ2 LYS 40 HZ2 LYS 40 0.910 -29.797 -1.396 327 HZ3 LYS 40 HZ3 LYS 40 2.318 -30.150 -2.281 328 HA PRO 41 HA PRO 41 0.195 -21.907 -6.816 329 HB2 PRO 41 HB2 PRO 41 1.322 -21.584 -9.186 330 HB3 PRO 41 HB1 PRO 41 2.126 -20.924 -7.743 331 HG2 PRO 41 HG2 PRO 41 2.733 -23.416 -9.270 332 HG3 PRO 41 HG1 PRO 41 3.836 -22.217 -8.581 333 HD2 PRO 41 HD2 PRO 41 3.113 -24.644 -7.353 334 HD3 PRO 41 HD1 PRO 41 3.868 -23.249 -6.544 335 H GLY 42 H GLY 42 -1.272 -22.078 -8.605 336 HA2 GLY 42 HA2 GLY 42 -1.362 -24.442 -10.260 337 HA3 GLY 42 HA1 GLY 42 -2.591 -24.424 -8.998 338 H PHE 43 H PHE 43 -3.277 -24.415 -11.704 339 HA PHE 43 HA PHE 43 -3.797 -21.747 -12.644 340 HB2 PHE 43 HB2 PHE 43 -4.329 -24.511 -13.550 341 HB3 PHE 43 HB1 PHE 43 -5.521 -23.312 -14.056 342 HD1 PHE 43 HD1 PHE 43 -1.876 -22.819 -13.431 343 HD2 PHE 43 HD2 PHE 43 -5.022 -22.987 -16.351 344 HE1 PHE 43 HE1 PHE 43 -0.309 -21.993 -15.166 345 HE2 PHE 43 HE2 PHE 43 -3.455 -22.161 -18.086 346 HZ PHE 43 HZ PHE 43 -1.099 -21.664 -17.495 347 H PHE 44 H PHE 44 -5.546 -20.475 -12.275 348 HA PHE 44 HA PHE 44 -7.486 -19.719 -11.280 349 HB2 PHE 44 HB2 PHE 44 -8.141 -21.824 -12.902 350 HB3 PHE 44 HB1 PHE 44 -8.833 -22.330 -11.363 351 HD1 PHE 44 HD1 PHE 44 -10.386 -20.742 -10.136 352 HD2 PHE 44 HD2 PHE 44 -9.137 -20.101 -14.195 353 HE1 PHE 44 HE1 PHE 44 -12.277 -19.171 -10.470 354 HE2 PHE 44 HE2 PHE 44 -11.027 -18.530 -14.529 355 HZ PHE 44 HZ PHE 44 -12.598 -18.066 -12.667 356 H LYS 45 H LYS 45 -5.385 -21.353 -9.727 357 HA LYS 45 HA LYS 45 -6.573 -21.080 -7.175 358 HB2 LYS 45 HB2 LYS 45 -7.778 -23.137 -8.036 359 HB3 LYS 45 HB1 LYS 45 -6.222 -23.963 -8.006 360 HG2 LYS 45 HG2 LYS 45 -6.115 -23.037 -5.539 361 HG3 LYS 45 HG1 LYS 45 -7.868 -22.938 -5.716 362 HD2 LYS 45 HD2 LYS 45 -7.880 -25.339 -6.430 363 HD3 LYS 45 HD1 LYS 45 -6.153 -25.411 -6.074 364 HE2 LYS 45 HE2 LYS 45 -7.582 -26.234 -4.186 365 HE3 LYS 45 HE1 LYS 45 -6.560 -24.867 -3.739 366 HZ1 LYS 45 HZ1 LYS 45 -9.087 -24.876 -3.164 367 HZ2 LYS 45 HZ2 LYS 45 -9.256 -24.344 -4.770 368 HZ3 LYS 45 HZ3 LYS 45 -8.327 -23.446 -3.667 369 H CYS 46 H CYS 46 -5.106 -21.477 -5.492 370 HA CYS 46 HA CYS 46 -2.499 -22.607 -6.074 371 HB2 CYS 46 HB2 CYS 46 -2.620 -19.721 -5.207 372 HB3 CYS 46 HB1 CYS 46 -1.210 -20.642 -5.724 373 H THR 47 H THR 47 -1.629 -23.461 -4.286 374 HA THR 47 HA THR 47 -2.907 -22.775 -1.707 375 HB THR 47 HB THR 47 -2.030 -25.073 -1.014 376 HG1 THR 47 HG1 THR 47 -0.669 -25.657 -2.570 377 HG21 THR 47 HG21 THR 47 -3.955 -26.204 -2.014 378 HG22 THR 47 HG22 THR 47 -4.092 -24.931 -3.229 379 HG23 THR 47 HG23 THR 47 -4.403 -24.567 -1.532 380 H CYS 48 H CYS 48 -1.682 -21.607 -0.398 381 HA CYS 48 HA CYS 48 1.249 -21.936 -0.551 382 HB2 CYS 48 HB2 CYS 48 0.383 -19.530 0.819 383 HB3 CYS 48 HB1 CYS 48 1.470 -19.702 -0.558 384 H TYR 49 H TYR 49 2.432 -21.752 1.457 385 HA TYR 49 HA TYR 49 0.820 -22.302 3.871 386 HB2 TYR 49 HB2 TYR 49 3.392 -23.748 3.232 387 HB3 TYR 49 HB1 TYR 49 2.226 -24.115 4.501 388 HD1 TYR 49 HD1 TYR 49 0.115 -25.235 3.998 389 HD2 TYR 49 HD2 TYR 49 2.917 -24.275 0.888 390 HE1 TYR 49 HE1 TYR 49 -1.117 -26.712 2.432 391 HE2 TYR 49 HE2 TYR 49 1.686 -25.750 -0.678 392 HH TYR 49 HH TYR 49 0.157 -27.708 -0.542 393 H PHE 50 H PHE 50 1.891 -21.742 5.863 394 HA PHE 50 HA PHE 50 3.989 -19.707 5.450 395 HB2 PHE 50 HB2 PHE 50 2.198 -18.624 6.489 396 HB3 PHE 50 HB1 PHE 50 1.812 -20.010 7.495 397 HD1 PHE 50 HD1 PHE 50 5.256 -18.769 6.946 398 HD2 PHE 50 HD2 PHE 50 1.895 -18.859 9.623 399 HE1 PHE 50 HE1 PHE 50 6.672 -17.845 8.756 400 HE2 PHE 50 HE2 PHE 50 3.315 -17.933 11.432 401 HZ PHE 50 HZ PHE 50 5.703 -17.427 11.001 402 H THR 51 H THR 51 5.873 -20.820 5.607 403 HA THR 51 HA THR 51 6.564 -23.032 7.009 404 HB THR 51 HB THR 51 8.240 -20.524 6.757 405 HG1 THR 51 HG1 THR 51 9.081 -21.954 4.992 406 HG21 THR 51 HG21 THR 51 8.783 -23.297 7.714 407 HG22 THR 51 HG22 THR 51 9.496 -21.769 8.234 408 HG23 THR 51 HG23 THR 51 10.018 -22.518 6.724 409 H THR 52 H THR 52 5.789 -23.465 9.004 410 HA THR 52 HA THR 52 6.632 -21.661 11.180 411 HB THR 52 HB THR 52 4.401 -22.419 12.292 412 HG1 THR 52 HG1 THR 52 4.153 -23.744 10.173 413 HG21 THR 52 HG21 THR 52 4.861 -20.107 11.730 414 HG22 THR 52 HG22 THR 52 3.228 -20.495 11.186 415 HG23 THR 52 HG23 THR 52 4.551 -20.418 10.023 416 H GLY 53 H GLY 53 7.615 -22.672 12.824 417 HA2 GLY 53 HA2 GLY 53 7.034 -25.420 13.513 418 HA3 GLY 53 HA1 GLY 53 8.621 -25.193 12.782 Start of MODEL 9 1 H1 GLU 1 H1 GLU 1 -1.978 -27.125 11.443 2 H2 GLU 1 H2 GLU 1 -1.372 -25.730 10.686 3 H3 GLU 1 H3 GLU 1 -2.278 -25.599 12.118 4 HA GLU 1 HA GLU 1 -0.440 -25.715 13.315 5 HB2 GLU 1 HB2 GLU 1 -1.018 -28.255 12.912 6 HB3 GLU 1 HB1 GLU 1 0.448 -28.228 11.932 7 HG2 GLU 1 HG2 GLU 1 1.273 -26.894 14.177 8 HG3 GLU 1 HG1 GLU 1 0.141 -28.059 14.860 9 H VAL 2 H VAL 2 -0.274 -25.758 9.927 10 HA VAL 2 HA VAL 2 2.473 -24.669 10.022 11 HB VAL 2 HB VAL 2 2.728 -25.655 7.686 12 HG11 VAL 2 HG11 VAL 2 2.510 -28.084 9.205 13 HG12 VAL 2 HG12 VAL 2 3.072 -26.798 10.272 14 HG13 VAL 2 HG13 VAL 2 3.964 -27.173 8.797 15 HG21 VAL 2 HG21 VAL 2 0.053 -26.182 7.940 16 HG22 VAL 2 HG22 VAL 2 0.752 -27.742 8.375 17 HG23 VAL 2 HG23 VAL 2 1.122 -27.015 6.812 18 H ILE 3 H ILE 3 -0.131 -23.321 10.099 19 HA ILE 3 HA ILE 3 -1.232 -21.561 9.113 20 HB ILE 3 HB ILE 3 1.499 -21.246 7.849 21 HG12 ILE 3 HG12 ILE 3 1.222 -19.246 9.659 22 HG13 ILE 3 HG11 ILE 3 0.232 -20.487 10.430 23 HG21 ILE 3 HG21 ILE 3 0.718 -18.857 7.541 24 HG22 ILE 3 HG22 ILE 3 -0.913 -19.416 7.916 25 HG23 ILE 3 HG23 ILE 3 -0.075 -20.032 6.491 26 HD11 ILE 3 HD11 ILE 3 2.255 -21.150 11.278 27 HD12 ILE 3 HD12 ILE 3 3.163 -20.433 9.948 28 HD13 ILE 3 HD13 ILE 3 2.366 -21.990 9.731 29 H LYS 4 H LYS 4 -2.076 -20.690 7.046 30 HA LYS 4 HA LYS 4 -1.712 -22.385 4.693 31 HB2 LYS 4 HB2 LYS 4 -4.283 -22.210 6.255 32 HB3 LYS 4 HB1 LYS 4 -4.265 -22.611 4.537 33 HG2 LYS 4 HG2 LYS 4 -2.615 -24.445 5.064 34 HG3 LYS 4 HG1 LYS 4 -2.886 -24.115 6.775 35 HD2 LYS 4 HD2 LYS 4 -5.455 -24.316 5.643 36 HD3 LYS 4 HD1 LYS 4 -4.526 -25.637 4.934 37 HE2 LYS 4 HE2 LYS 4 -4.789 -25.042 7.896 38 HE3 LYS 4 HE1 LYS 4 -5.568 -26.368 7.034 39 HZ1 LYS 4 HZ1 LYS 4 -3.069 -26.384 8.192 40 HZ2 LYS 4 HZ2 LYS 4 -2.781 -26.334 6.519 41 HZ3 LYS 4 HZ3 LYS 4 -3.733 -27.574 7.183 42 H LYS 5 H LYS 5 -1.316 -20.917 3.173 43 HA LYS 5 HA LYS 5 -3.100 -18.564 2.994 44 HB2 LYS 5 HB2 LYS 5 -0.175 -18.623 2.216 45 HB3 LYS 5 HB1 LYS 5 -1.247 -17.222 2.222 46 HG2 LYS 5 HG2 LYS 5 -0.560 -18.841 4.692 47 HG3 LYS 5 HG1 LYS 5 0.250 -17.342 4.236 48 HD2 LYS 5 HD2 LYS 5 -2.399 -16.626 4.062 49 HD3 LYS 5 HD1 LYS 5 -2.414 -17.745 5.425 50 HE2 LYS 5 HE2 LYS 5 -0.652 -15.297 5.123 51 HE3 LYS 5 HE1 LYS 5 -1.985 -15.500 6.261 52 HZ1 LYS 5 HZ1 LYS 5 -0.722 -17.460 7.144 53 HZ2 LYS 5 HZ2 LYS 5 -0.015 -15.946 7.444 54 HZ3 LYS 5 HZ3 LYS 5 0.601 -16.945 6.216 55 H ASP 6 H ASP 6 -4.431 -19.110 1.355 56 HA ASP 6 HA ASP 6 -3.188 -20.053 -1.157 57 HB2 ASP 6 HB2 ASP 6 -5.257 -21.292 -1.600 58 HB3 ASP 6 HB1 ASP 6 -4.540 -21.806 -0.074 59 H THR 7 H THR 7 -3.692 -19.009 -3.009 60 HA THR 7 HA THR 7 -5.717 -16.860 -2.840 61 HB THR 7 HB THR 7 -4.334 -15.380 -3.920 62 HG1 THR 7 HG1 THR 7 -2.965 -15.966 -5.516 63 HG21 THR 7 HG21 THR 7 -2.201 -17.267 -2.918 64 HG22 THR 7 HG22 THR 7 -3.191 -16.290 -1.835 65 HG23 THR 7 HG23 THR 7 -2.127 -15.508 -3.007 66 HA PRO 8 HA PRO 8 -7.328 -18.758 -6.536 67 HB2 PRO 8 HB2 PRO 8 -8.892 -16.812 -7.486 68 HB3 PRO 8 HB1 PRO 8 -9.160 -17.460 -5.854 69 HG2 PRO 8 HG2 PRO 8 -7.932 -14.892 -6.690 70 HG3 PRO 8 HG1 PRO 8 -8.899 -15.270 -5.256 71 HD2 PRO 8 HD2 PRO 8 -6.047 -15.140 -5.408 72 HD3 PRO 8 HD1 PRO 8 -7.025 -15.691 -4.031 73 H TYR 9 H TYR 9 -7.179 -18.893 -8.835 74 HA TYR 9 HA TYR 9 -5.532 -16.844 -10.169 75 HB2 TYR 9 HB2 TYR 9 -4.337 -19.083 -9.397 76 HB3 TYR 9 HB1 TYR 9 -5.088 -19.712 -10.864 77 HD1 TYR 9 HD1 TYR 9 -3.145 -16.735 -9.667 78 HD2 TYR 9 HD2 TYR 9 -3.986 -19.430 -12.902 79 HE1 TYR 9 HE1 TYR 9 -1.390 -15.643 -11.032 80 HE2 TYR 9 HE2 TYR 9 -2.233 -18.337 -14.269 81 HH TYR 9 HH TYR 9 -1.098 -15.518 -13.895 82 H LYS 10 H LYS 10 -5.375 -18.047 -12.658 83 HA LYS 10 HA LYS 10 -6.573 -18.171 -14.623 84 HB2 LYS 10 HB2 LYS 10 -7.252 -20.328 -13.421 85 HB3 LYS 10 HB1 LYS 10 -8.742 -19.487 -12.991 86 HG2 LYS 10 HG2 LYS 10 -9.056 -20.779 -15.052 87 HG3 LYS 10 HG1 LYS 10 -9.175 -19.053 -15.386 88 HD2 LYS 10 HD2 LYS 10 -7.285 -19.039 -16.656 89 HD3 LYS 10 HD1 LYS 10 -6.444 -20.159 -15.584 90 HE2 LYS 10 HE2 LYS 10 -7.887 -22.007 -16.507 91 HE3 LYS 10 HE1 LYS 10 -8.505 -20.855 -17.691 92 HZ1 LYS 10 HZ1 LYS 10 -6.559 -22.275 -18.401 93 HZ2 LYS 10 HZ2 LYS 10 -5.609 -21.352 -17.336 94 HZ3 LYS 10 HZ3 LYS 10 -6.397 -20.604 -18.643 95 H LYS 11 H LYS 11 -7.443 -16.329 -12.082 96 HA LYS 11 HA LYS 11 -9.869 -15.228 -13.325 97 HB2 LYS 11 HB2 LYS 11 -9.779 -15.854 -10.851 98 HB3 LYS 11 HB1 LYS 11 -8.686 -14.486 -10.648 99 HG2 LYS 11 HG2 LYS 11 -10.717 -13.366 -12.125 100 HG3 LYS 11 HG1 LYS 11 -11.594 -14.504 -11.101 101 HD2 LYS 11 HD2 LYS 11 -9.558 -12.524 -10.047 102 HD3 LYS 11 HD1 LYS 11 -11.296 -12.224 -10.071 103 HE2 LYS 11 HE2 LYS 11 -10.167 -14.711 -8.795 104 HE3 LYS 11 HE1 LYS 11 -10.278 -13.197 -7.898 105 HZ1 LYS 11 HZ1 LYS 11 -12.344 -13.878 -7.453 106 HZ2 LYS 11 HZ2 LYS 11 -12.364 -15.009 -8.721 107 HZ3 LYS 11 HZ3 LYS 11 -12.710 -13.374 -9.029 108 H ARG 12 H ARG 12 -6.514 -14.642 -12.790 109 HA ARG 12 HA ARG 12 -6.823 -11.832 -13.654 110 HB2 ARG 12 HB2 ARG 12 -5.621 -12.327 -11.476 111 HB3 ARG 12 HB1 ARG 12 -4.362 -13.098 -12.442 112 HG2 ARG 12 HG2 ARG 12 -3.879 -11.052 -13.600 113 HG3 ARG 12 HG1 ARG 12 -5.305 -10.264 -12.926 114 HD2 ARG 12 HD2 ARG 12 -4.242 -9.749 -11.001 115 HD3 ARG 12 HD1 ARG 12 -3.547 -11.360 -10.863 116 HE ARG 12 HE ARG 12 -2.077 -10.216 -12.852 117 HH11 ARG 12 HH11 ARG 12 -0.193 -8.999 -12.474 118 HH12 ARG 12 HH12 ARG 12 0.022 -8.196 -10.953 119 HH21 ARG 12 HH21 ARG 12 -2.999 -9.288 -9.650 120 HH22 ARG 12 HH22 ARG 12 -1.568 -8.359 -9.357 121 H LYS 13 H LYS 13 -5.187 -11.019 -15.166 122 HA LYS 13 HA LYS 13 -4.913 -12.747 -17.424 123 HB2 LYS 13 HB2 LYS 13 -3.697 -10.846 -18.434 124 HB3 LYS 13 HB1 LYS 13 -5.214 -10.332 -17.693 125 HG2 LYS 13 HG2 LYS 13 -3.746 -9.912 -15.571 126 HG3 LYS 13 HG1 LYS 13 -2.401 -9.916 -16.712 127 HD2 LYS 13 HD2 LYS 13 -4.849 -8.131 -16.848 128 HD3 LYS 13 HD1 LYS 13 -3.218 -7.627 -16.400 129 HE2 LYS 13 HE2 LYS 13 -2.599 -8.709 -18.741 130 HE3 LYS 13 HE1 LYS 13 -4.298 -8.382 -19.089 131 HZ1 LYS 13 HZ1 LYS 13 -3.844 -6.068 -18.248 132 HZ2 LYS 13 HZ2 LYS 13 -3.124 -6.471 -19.733 133 HZ3 LYS 13 HZ3 LYS 13 -2.192 -6.450 -18.312 134 H PHE 14 H PHE 14 -2.512 -12.390 -18.520 135 HA PHE 14 HA PHE 14 -0.426 -13.358 -18.585 136 HB2 PHE 14 HB2 PHE 14 -0.022 -11.295 -17.202 137 HB3 PHE 14 HB1 PHE 14 -0.207 -12.297 -15.763 138 HD1 PHE 14 HD1 PHE 14 1.681 -12.179 -19.000 139 HD2 PHE 14 HD2 PHE 14 1.659 -13.395 -14.880 140 HE1 PHE 14 HE1 PHE 14 4.041 -12.913 -19.203 141 HE2 PHE 14 HE2 PHE 14 4.020 -14.127 -15.083 142 HZ PHE 14 HZ PHE 14 5.211 -13.886 -17.245 143 HA PRO 15 HA PRO 15 -2.140 -17.006 -16.130 144 HB2 PRO 15 HB2 PRO 15 -1.367 -18.292 -18.701 145 HB3 PRO 15 HB1 PRO 15 -2.837 -18.501 -17.732 146 HG2 PRO 15 HG2 PRO 15 -2.838 -17.114 -20.014 147 HG3 PRO 15 HG1 PRO 15 -3.860 -16.664 -18.638 148 HD2 PRO 15 HD2 PRO 15 -1.362 -15.362 -19.633 149 HD3 PRO 15 HD1 PRO 15 -2.773 -14.638 -18.827 150 H TYR 16 H TYR 16 -0.538 -17.429 -14.686 151 HA TYR 16 HA TYR 16 1.633 -19.129 -15.406 152 HB2 TYR 16 HB2 TYR 16 2.114 -16.217 -15.298 153 HB3 TYR 16 HB1 TYR 16 3.250 -17.201 -14.374 154 HD1 TYR 16 HD1 TYR 16 2.248 -16.101 -17.655 155 HD2 TYR 16 HD2 TYR 16 4.377 -19.176 -15.545 156 HE1 TYR 16 HE1 TYR 16 3.397 -16.746 -19.757 157 HE2 TYR 16 HE2 TYR 16 5.528 -19.821 -17.645 158 HH TYR 16 HH TYR 16 4.503 -18.925 -20.648 159 H LYS 17 H LYS 17 1.766 -20.424 -13.698 160 HA LYS 17 HA LYS 17 0.558 -20.092 -11.249 161 HB2 LYS 17 HB2 LYS 17 3.004 -21.557 -10.871 162 HB3 LYS 17 HB1 LYS 17 1.351 -22.165 -10.956 163 HG2 LYS 17 HG2 LYS 17 1.465 -22.167 -13.415 164 HG3 LYS 17 HG1 LYS 17 3.115 -21.546 -13.344 165 HD2 LYS 17 HD2 LYS 17 2.602 -23.981 -11.734 166 HD3 LYS 17 HD1 LYS 17 2.520 -24.195 -13.484 167 HE2 LYS 17 HE2 LYS 17 4.749 -23.056 -13.668 168 HE3 LYS 17 HE1 LYS 17 4.837 -23.040 -11.907 169 HZ1 LYS 17 HZ1 LYS 17 4.986 -25.309 -13.757 170 HZ2 LYS 17 HZ2 LYS 17 4.318 -25.566 -12.217 171 HZ3 LYS 17 HZ3 LYS 17 5.906 -24.985 -12.369 172 H SER 18 H SER 18 3.613 -18.806 -12.345 173 HA SER 18 HA SER 18 4.790 -18.177 -9.868 174 HB2 SER 18 HB2 SER 18 6.388 -17.299 -11.182 175 HB3 SER 18 HB1 SER 18 5.396 -17.759 -12.563 176 HG SER 18 HG SER 18 6.065 -15.402 -12.115 177 H GLU 19 H GLU 19 2.952 -16.036 -12.048 178 HA GLU 19 HA GLU 19 2.713 -13.829 -10.375 179 HB2 GLU 19 HB2 GLU 19 2.033 -13.895 -12.761 180 HB3 GLU 19 HB1 GLU 19 0.644 -14.881 -12.319 181 HG2 GLU 19 HG2 GLU 19 -0.526 -13.067 -11.686 182 HG3 GLU 19 HG1 GLU 19 0.782 -12.539 -10.627 183 H CYS 20 H CYS 20 1.401 -16.930 -10.069 184 HA CYS 20 HA CYS 20 -0.906 -16.174 -8.479 185 HB2 CYS 20 HB2 CYS 20 -0.551 -18.274 -10.024 186 HB3 CYS 20 HB1 CYS 20 0.196 -18.956 -8.577 187 H LEU 21 H LEU 21 2.210 -17.785 -7.930 188 HA LEU 21 HA LEU 21 1.908 -18.063 -5.119 189 HB2 LEU 21 HB2 LEU 21 3.584 -19.211 -6.733 190 HB3 LEU 21 HB1 LEU 21 4.564 -17.764 -6.506 191 HG LEU 21 HG LEU 21 4.218 -18.163 -3.975 192 HD11 LEU 21 HD11 LEU 21 2.708 -20.334 -5.063 193 HD12 LEU 21 HD12 LEU 21 2.987 -19.944 -3.366 194 HD13 LEU 21 HD13 LEU 21 4.100 -21.011 -4.221 195 HD21 LEU 21 HD21 LEU 21 6.043 -19.327 -5.922 196 HD22 LEU 21 HD22 LEU 21 5.900 -20.345 -4.487 197 HD23 LEU 21 HD23 LEU 21 6.391 -18.659 -4.328 198 H LYS 22 H LYS 22 2.516 -15.378 -7.113 199 HA LYS 22 HA LYS 22 4.078 -13.812 -5.293 200 HB2 LYS 22 HB2 LYS 22 4.015 -13.384 -7.734 201 HB3 LYS 22 HB1 LYS 22 2.320 -12.915 -7.590 202 HG2 LYS 22 HG2 LYS 22 2.908 -11.078 -6.101 203 HG3 LYS 22 HG1 LYS 22 4.598 -11.582 -6.098 204 HD2 LYS 22 HD2 LYS 22 4.866 -11.032 -8.409 205 HD3 LYS 22 HD1 LYS 22 3.127 -10.851 -8.637 206 HE2 LYS 22 HE2 LYS 22 4.251 -9.133 -6.521 207 HE3 LYS 22 HE1 LYS 22 4.846 -8.772 -8.143 208 HZ1 LYS 22 HZ1 LYS 22 2.007 -9.258 -8.002 209 HZ2 LYS 22 HZ2 LYS 22 2.862 -8.017 -8.788 210 HZ3 LYS 22 HZ3 LYS 22 2.513 -7.894 -7.129 211 H ALA 23 H ALA 23 0.629 -14.104 -6.025 212 HA ALA 23 HA ALA 23 -0.303 -11.970 -4.450 213 HB1 ALA 23 HB1 ALA 23 -1.688 -14.598 -5.043 214 HB2 ALA 23 HB2 ALA 23 -1.695 -13.185 -6.097 215 HB3 ALA 23 HB3 ALA 23 -2.467 -13.108 -4.513 216 H CYS 24 H CYS 24 0.196 -15.402 -3.648 217 HA CYS 24 HA CYS 24 -0.822 -15.556 -1.121 218 HB2 CYS 24 HB2 CYS 24 1.298 -16.914 -2.590 219 HB3 CYS 24 HB1 CYS 24 1.596 -16.885 -0.851 220 H ALA 25 H ALA 25 2.369 -14.240 -2.004 221 HA ALA 25 HA ALA 25 3.149 -13.625 0.659 222 HB1 ALA 25 HB1 ALA 25 4.143 -12.035 -1.675 223 HB2 ALA 25 HB2 ALA 25 4.551 -13.748 -1.567 224 HB3 ALA 25 HB3 ALA 25 5.028 -12.645 -0.277 225 H THR 26 H THR 26 1.097 -12.067 -1.651 226 HA THR 26 HA THR 26 1.215 -9.445 -0.468 227 HB THR 26 HB THR 26 -0.958 -10.561 -2.249 228 HG1 THR 26 HG1 THR 26 1.371 -9.184 -3.061 229 HG21 THR 26 HG21 THR 26 -0.770 -8.028 -2.963 230 HG22 THR 26 HG22 THR 26 -0.048 -7.846 -1.364 231 HG23 THR 26 HG23 THR 26 -1.687 -8.476 -1.524 232 H SER 27 H SER 27 -0.310 -12.375 0.333 233 HA SER 27 HA SER 27 -2.760 -11.839 1.355 234 HB2 SER 27 HB2 SER 27 -2.356 -13.526 3.052 235 HB3 SER 27 HB1 SER 27 -1.568 -14.015 1.556 236 HG SER 27 HG SER 27 0.122 -12.495 2.922 237 H PHE 28 H PHE 28 0.161 -10.319 2.303 238 HA PHE 28 HA PHE 28 -1.130 -8.407 3.922 239 HB2 PHE 28 HB2 PHE 28 -0.965 -10.702 5.329 240 HB3 PHE 28 HB1 PHE 28 0.607 -10.004 5.715 241 HD1 PHE 28 HD1 PHE 28 -3.036 -9.609 6.016 242 HD2 PHE 28 HD2 PHE 28 0.789 -7.863 6.897 243 HE1 PHE 28 HE1 PHE 28 -4.114 -8.051 7.616 244 HE2 PHE 28 HE2 PHE 28 -0.290 -6.305 8.497 245 HZ PHE 28 HZ PHE 28 -2.742 -6.399 8.856 246 H THR 29 H THR 29 0.211 -6.706 4.420 247 HA THR 29 HA THR 29 1.995 -5.346 3.723 248 HB THR 29 HB THR 29 3.976 -5.902 5.174 249 HG1 THR 29 HG1 THR 29 3.111 -8.276 5.002 250 HG21 THR 29 HG21 THR 29 1.235 -5.328 5.949 251 HG22 THR 29 HG22 THR 29 2.736 -4.636 6.565 252 HG23 THR 29 HG23 THR 29 2.111 -6.138 7.247 253 H GLY 30 H GLY 30 4.043 -8.144 4.207 254 HA2 GLY 30 HA2 GLY 30 4.489 -9.404 1.945 255 HA3 GLY 30 HA1 GLY 30 5.087 -7.813 1.485 256 H GLY 31 H GLY 31 6.678 -10.168 1.564 257 HA2 GLY 31 HA2 GLY 31 8.862 -9.215 3.175 258 HA3 GLY 31 HA1 GLY 31 8.173 -10.713 3.792 259 H ASP 32 H ASP 32 9.577 -12.280 3.260 260 HA ASP 32 HA ASP 32 10.118 -12.737 0.422 261 HB2 ASP 32 HB2 ASP 32 12.545 -13.147 0.931 262 HB3 ASP 32 HB1 ASP 32 12.056 -11.457 1.045 263 H GLU 33 H GLU 33 10.561 -13.850 3.763 264 HA GLU 33 HA GLU 33 9.997 -16.595 2.830 265 HB2 GLU 33 HB2 GLU 33 12.265 -15.597 4.499 266 HB3 GLU 33 HB1 GLU 33 11.583 -17.179 4.871 267 HG2 GLU 33 HG2 GLU 33 11.968 -17.938 2.594 268 HG3 GLU 33 HG1 GLU 33 12.511 -16.330 2.114 269 H SER 34 H SER 34 10.186 -14.443 5.665 270 HA SER 34 HA SER 34 8.520 -16.101 7.289 271 HB2 SER 34 HB2 SER 34 9.015 -13.151 7.688 272 HB3 SER 34 HB1 SER 34 8.634 -14.361 8.910 273 HG SER 34 HG SER 34 10.808 -15.063 7.460 274 H ARG 35 H ARG 35 6.653 -16.531 6.165 275 HA ARG 35 HA ARG 35 4.337 -15.321 6.603 276 HB2 ARG 35 HB2 ARG 35 5.846 -13.677 4.648 277 HB3 ARG 35 HB1 ARG 35 4.164 -14.006 4.245 278 HG2 ARG 35 HG2 ARG 35 3.341 -12.869 6.081 279 HG3 ARG 35 HG1 ARG 35 4.785 -13.171 7.048 280 HD2 ARG 35 HD2 ARG 35 6.009 -11.623 5.401 281 HD3 ARG 35 HD1 ARG 35 4.410 -11.147 4.836 282 HE ARG 35 HE ARG 35 5.665 -10.273 7.235 283 HH11 ARG 35 HH11 ARG 35 4.423 -9.049 8.688 284 HH12 ARG 35 HH12 ARG 35 2.694 -9.084 8.585 285 HH21 ARG 35 HH21 ARG 35 2.633 -11.282 5.905 286 HH22 ARG 35 HH22 ARG 35 1.682 -10.349 7.011 287 H ILE 36 H ILE 36 6.387 -16.692 4.154 288 HA ILE 36 HA ILE 36 4.232 -18.521 3.388 289 HB ILE 36 HB ILE 36 5.887 -17.429 1.160 290 HG12 ILE 36 HG12 ILE 36 4.972 -15.445 2.485 291 HG13 ILE 36 HG11 ILE 36 4.438 -15.544 0.809 292 HG21 ILE 36 HG21 ILE 36 3.730 -17.856 -0.044 293 HG22 ILE 36 HG22 ILE 36 3.040 -18.421 1.478 294 HG23 ILE 36 HG23 ILE 36 4.387 -19.291 0.744 295 HD11 ILE 36 HD11 ILE 36 2.783 -15.349 3.040 296 HD12 ILE 36 HD12 ILE 36 2.690 -17.053 2.590 297 HD13 ILE 36 HD13 ILE 36 2.281 -15.805 1.413 298 H GLN 37 H GLN 37 7.584 -17.630 2.543 299 HA GLN 37 HA GLN 37 9.505 -18.877 2.458 300 HB2 GLN 37 HB2 GLN 37 8.233 -19.743 4.728 301 HB3 GLN 37 HB1 GLN 37 8.450 -21.247 3.830 302 HG2 GLN 37 HG2 GLN 37 10.639 -19.232 4.415 303 HG3 GLN 37 HG1 GLN 37 10.406 -20.755 5.272 304 HE21 GLN 37 HE21 GLN 37 12.614 -19.710 3.334 305 HE22 GLN 37 HE22 GLN 37 12.779 -20.978 2.217 306 H GLU 38 H GLU 38 6.618 -20.984 2.097 307 HA GLU 38 HA GLU 38 7.541 -21.766 -0.545 308 HB2 GLU 38 HB2 GLU 38 7.616 -24.135 -0.097 309 HB3 GLU 38 HB1 GLU 38 8.701 -23.326 1.030 310 HG2 GLU 38 HG2 GLU 38 6.892 -23.347 2.742 311 HG3 GLU 38 HG1 GLU 38 5.880 -24.256 1.622 312 H GLY 39 H GLY 39 5.914 -22.691 -1.811 313 HA2 GLY 39 HA2 GLY 39 3.351 -23.359 -0.694 314 HA3 GLY 39 HA1 GLY 39 3.342 -21.812 -1.533 315 H LYS 40 H LYS 40 1.744 -23.865 -2.379 316 HA LYS 40 HA LYS 40 3.040 -24.786 -4.874 317 HB2 LYS 40 HB2 LYS 40 1.273 -26.131 -2.931 318 HB3 LYS 40 HB1 LYS 40 0.862 -26.390 -4.625 319 HG2 LYS 40 HG2 LYS 40 3.114 -27.175 -5.103 320 HG3 LYS 40 HG1 LYS 40 3.633 -26.793 -3.461 321 HD2 LYS 40 HD2 LYS 40 3.184 -29.078 -3.288 322 HD3 LYS 40 HD1 LYS 40 1.652 -28.375 -2.767 323 HE2 LYS 40 HE2 LYS 40 1.373 -30.216 -4.449 324 HE3 LYS 40 HE1 LYS 40 0.697 -28.675 -4.979 325 HZ1 LYS 40 HZ1 LYS 40 2.228 -28.453 -6.585 326 HZ2 LYS 40 HZ2 LYS 40 2.378 -30.140 -6.438 327 HZ3 LYS 40 HZ3 LYS 40 3.481 -29.115 -5.652 328 HA PRO 41 HA PRO 41 -0.365 -22.231 -6.438 329 HB2 PRO 41 HB2 PRO 41 0.844 -21.266 -8.601 330 HB3 PRO 41 HB1 PRO 41 1.393 -20.770 -6.985 331 HG2 PRO 41 HG2 PRO 41 2.609 -22.713 -8.882 332 HG3 PRO 41 HG1 PRO 41 3.384 -21.561 -7.788 333 HD2 PRO 41 HD2 PRO 41 2.968 -24.318 -7.275 334 HD3 PRO 41 HD1 PRO 41 3.465 -23.086 -6.092 335 H GLY 42 H GLY 42 -1.638 -22.220 -8.420 336 HA2 GLY 42 HA2 GLY 42 -1.232 -24.193 -10.475 337 HA3 GLY 42 HA1 GLY 42 -2.503 -24.648 -9.344 338 H PHE 43 H PHE 43 -3.127 -24.252 -11.996 339 HA PHE 43 HA PHE 43 -4.014 -21.580 -12.521 340 HB2 PHE 43 HB2 PHE 43 -5.374 -23.786 -13.929 341 HB3 PHE 43 HB1 PHE 43 -4.553 -22.367 -14.580 342 HD1 PHE 43 HD1 PHE 43 -2.224 -22.424 -15.170 343 HD2 PHE 43 HD2 PHE 43 -4.062 -25.786 -13.228 344 HE1 PHE 43 HE1 PHE 43 -0.226 -23.805 -15.669 345 HE2 PHE 43 HE2 PHE 43 -2.063 -27.166 -13.727 346 HZ PHE 43 HZ PHE 43 -0.145 -26.176 -14.946 347 H PHE 44 H PHE 44 -5.911 -20.618 -12.021 348 HA PHE 44 HA PHE 44 -7.987 -20.280 -11.106 349 HB2 PHE 44 HB2 PHE 44 -8.745 -21.810 -12.836 350 HB3 PHE 44 HB1 PHE 44 -8.343 -23.195 -11.827 351 HD1 PHE 44 HD1 PHE 44 -10.186 -19.943 -11.396 352 HD2 PHE 44 HD2 PHE 44 -10.157 -24.195 -10.787 353 HE1 PHE 44 HE1 PHE 44 -12.410 -19.802 -10.309 354 HE2 PHE 44 HE2 PHE 44 -12.382 -24.054 -9.699 355 HZ PHE 44 HZ PHE 44 -13.508 -21.857 -9.461 356 H LYS 45 H LYS 45 -5.837 -20.899 -9.391 357 HA LYS 45 HA LYS 45 -6.856 -20.975 -6.919 358 HB2 LYS 45 HB2 LYS 45 -6.581 -23.422 -6.236 359 HB3 LYS 45 HB1 LYS 45 -8.042 -23.008 -7.120 360 HG2 LYS 45 HG2 LYS 45 -7.427 -24.231 -8.934 361 HG3 LYS 45 HG1 LYS 45 -5.736 -23.751 -8.809 362 HD2 LYS 45 HD2 LYS 45 -5.525 -25.292 -6.827 363 HD3 LYS 45 HD1 LYS 45 -7.157 -25.867 -7.169 364 HE2 LYS 45 HE2 LYS 45 -4.806 -25.993 -9.081 365 HE3 LYS 45 HE1 LYS 45 -5.469 -27.356 -8.179 366 HZ1 LYS 45 HZ1 LYS 45 -7.443 -25.887 -9.665 367 HZ2 LYS 45 HZ2 LYS 45 -7.160 -27.560 -9.593 368 HZ3 LYS 45 HZ3 LYS 45 -6.252 -26.587 -10.648 369 H CYS 46 H CYS 46 -5.326 -21.450 -5.229 370 HA CYS 46 HA CYS 46 -2.703 -22.426 -5.842 371 HB2 CYS 46 HB2 CYS 46 -3.191 -19.466 -5.713 372 HB3 CYS 46 HB1 CYS 46 -1.645 -20.144 -5.203 373 H THR 47 H THR 47 -1.979 -23.323 -4.032 374 HA THR 47 HA THR 47 -2.894 -22.191 -1.455 375 HB THR 47 HB THR 47 -2.601 -24.533 -0.565 376 HG1 THR 47 HG1 THR 47 -1.562 -25.729 -1.958 377 HG21 THR 47 HG21 THR 47 -4.835 -24.335 -0.772 378 HG22 THR 47 HG22 THR 47 -4.670 -25.220 -2.290 379 HG23 THR 47 HG23 THR 47 -4.687 -23.456 -2.294 380 H CYS 48 H CYS 48 -1.371 -21.515 -0.095 381 HA CYS 48 HA CYS 48 1.391 -22.492 -0.481 382 HB2 CYS 48 HB2 CYS 48 0.857 -19.723 0.524 383 HB3 CYS 48 HB1 CYS 48 2.282 -20.355 -0.295 384 H TYR 49 H TYR 49 2.772 -22.155 1.493 385 HA TYR 49 HA TYR 49 1.215 -22.162 3.994 386 HB2 TYR 49 HB2 TYR 49 3.341 -24.226 3.395 387 HB3 TYR 49 HB1 TYR 49 2.258 -24.166 4.785 388 HD1 TYR 49 HD1 TYR 49 -0.170 -24.624 4.513 389 HD2 TYR 49 HD2 TYR 49 2.596 -25.051 1.254 390 HE1 TYR 49 HE1 TYR 49 -1.861 -25.929 3.249 391 HE2 TYR 49 HE2 TYR 49 0.906 -26.356 -0.008 392 HH TYR 49 HH TYR 49 -2.348 -26.928 1.327 393 H PHE 50 H PHE 50 2.329 -21.344 5.762 394 HA PHE 50 HA PHE 50 4.861 -20.022 5.091 395 HB2 PHE 50 HB2 PHE 50 3.219 -18.502 5.929 396 HB3 PHE 50 HB1 PHE 50 2.830 -19.562 7.276 397 HD1 PHE 50 HD1 PHE 50 3.227 -17.575 8.761 398 HD2 PHE 50 HD2 PHE 50 6.371 -19.303 6.388 399 HE1 PHE 50 HE1 PHE 50 4.923 -16.431 10.161 400 HE2 PHE 50 HE2 PHE 50 8.054 -18.170 7.791 401 HZ PHE 50 HZ PHE 50 7.336 -16.730 9.677 402 H THR 51 H THR 51 6.453 -21.492 5.414 403 HA THR 51 HA THR 51 6.548 -23.477 7.390 404 HB THR 51 HB THR 51 8.985 -22.076 6.292 405 HG1 THR 51 HG1 THR 51 8.754 -23.525 4.531 406 HG21 THR 51 HG21 THR 51 9.198 -24.892 6.292 407 HG22 THR 51 HG22 THR 51 8.466 -24.456 7.837 408 HG23 THR 51 HG23 THR 51 10.015 -23.758 7.367 409 H THR 52 H THR 52 5.701 -22.303 9.224 410 HA THR 52 HA THR 52 7.782 -20.750 10.640 411 HB THR 52 HB THR 52 4.887 -20.624 11.390 412 HG1 THR 52 HG1 THR 52 4.716 -20.133 9.283 413 HG21 THR 52 HG21 THR 52 5.564 -18.832 12.603 414 HG22 THR 52 HG22 THR 52 6.577 -18.219 11.294 415 HG23 THR 52 HG23 THR 52 7.187 -19.480 12.367 416 H GLY 53 H GLY 53 5.718 -21.039 12.907 417 HA2 GLY 53 HA2 GLY 53 7.016 -23.245 14.213 418 HA3 GLY 53 HA1 GLY 53 5.711 -22.262 14.874 Start of MODEL 10 1 H1 GLU 1 H1 GLU 1 -0.205 -30.398 6.977 2 H2 GLU 1 H2 GLU 1 -0.332 -31.483 8.278 3 H3 GLU 1 H3 GLU 1 1.068 -30.540 8.088 4 HA GLU 1 HA GLU 1 -1.648 -29.500 8.685 5 HB2 GLU 1 HB2 GLU 1 0.841 -29.763 10.401 6 HB3 GLU 1 HB1 GLU 1 -0.640 -28.934 10.885 7 HG2 GLU 1 HG2 GLU 1 -0.785 -31.772 9.917 8 HG3 GLU 1 HG1 GLU 1 -0.276 -31.446 11.573 9 H VAL 2 H VAL 2 0.503 -27.694 10.250 10 HA VAL 2 HA VAL 2 1.342 -25.577 9.947 11 HB VAL 2 HB VAL 2 1.945 -26.478 7.127 12 HG11 VAL 2 HG11 VAL 2 3.840 -24.861 8.720 13 HG12 VAL 2 HG12 VAL 2 2.322 -24.054 8.328 14 HG13 VAL 2 HG13 VAL 2 3.345 -24.682 7.036 15 HG21 VAL 2 HG21 VAL 2 3.216 -28.111 8.030 16 HG22 VAL 2 HG22 VAL 2 2.861 -27.554 9.665 17 HG23 VAL 2 HG23 VAL 2 4.203 -26.848 8.764 18 H ILE 3 H ILE 3 -0.120 -23.988 9.950 19 HA ILE 3 HA ILE 3 -2.435 -23.662 8.620 20 HB ILE 3 HB ILE 3 -2.092 -21.902 10.048 21 HG12 ILE 3 HG12 ILE 3 -0.999 -20.650 7.508 22 HG13 ILE 3 HG11 ILE 3 -2.712 -20.976 7.785 23 HG21 ILE 3 HG21 ILE 3 0.738 -21.941 9.001 24 HG22 ILE 3 HG22 ILE 3 0.171 -22.250 10.640 25 HG23 ILE 3 HG23 ILE 3 0.146 -20.609 9.993 26 HD11 ILE 3 HD11 ILE 3 -2.700 -18.854 8.631 27 HD12 ILE 3 HD12 ILE 3 -0.969 -18.890 8.967 28 HD13 ILE 3 HD13 ILE 3 -2.099 -19.661 10.080 29 H LYS 4 H LYS 4 -3.111 -23.458 6.573 30 HA LYS 4 HA LYS 4 -1.081 -22.868 4.503 31 HB2 LYS 4 HB2 LYS 4 -2.150 -24.356 3.044 32 HB3 LYS 4 HB1 LYS 4 -2.238 -25.186 4.597 33 HG2 LYS 4 HG2 LYS 4 -4.522 -24.066 4.899 34 HG3 LYS 4 HG1 LYS 4 -4.423 -23.643 3.190 35 HD2 LYS 4 HD2 LYS 4 -4.320 -25.945 2.532 36 HD3 LYS 4 HD1 LYS 4 -4.078 -26.474 4.197 37 HE2 LYS 4 HE2 LYS 4 -6.332 -25.650 4.786 38 HE3 LYS 4 HE1 LYS 4 -6.575 -25.135 3.117 39 HZ1 LYS 4 HZ1 LYS 4 -7.053 -27.198 2.495 40 HZ2 LYS 4 HZ2 LYS 4 -7.160 -27.593 4.144 41 HZ3 LYS 4 HZ3 LYS 4 -5.710 -27.851 3.298 42 H LYS 5 H LYS 5 -1.405 -21.185 3.184 43 HA LYS 5 HA LYS 5 -4.050 -19.857 3.257 44 HB2 LYS 5 HB2 LYS 5 -1.357 -18.519 2.894 45 HB3 LYS 5 HB1 LYS 5 -2.924 -17.721 3.032 46 HG2 LYS 5 HG2 LYS 5 -2.036 -19.576 5.217 47 HG3 LYS 5 HG1 LYS 5 -1.374 -17.942 5.153 48 HD2 LYS 5 HD2 LYS 5 -4.300 -18.104 4.777 49 HD3 LYS 5 HD1 LYS 5 -3.733 -18.587 6.376 50 HE2 LYS 5 HE2 LYS 5 -2.930 -16.005 5.008 51 HE3 LYS 5 HE1 LYS 5 -4.232 -16.131 6.191 52 HZ1 LYS 5 HZ1 LYS 5 -2.141 -15.455 7.212 53 HZ2 LYS 5 HZ2 LYS 5 -1.401 -16.885 6.670 54 HZ3 LYS 5 HZ3 LYS 5 -2.660 -16.956 7.809 55 H ASP 6 H ASP 6 -4.977 -20.466 1.380 56 HA ASP 6 HA ASP 6 -3.360 -20.379 -1.080 57 HB2 ASP 6 HB2 ASP 6 -4.949 -21.858 -2.054 58 HB3 ASP 6 HB1 ASP 6 -4.661 -22.477 -0.428 59 H THR 7 H THR 7 -3.810 -19.001 -2.706 60 HA THR 7 HA THR 7 -5.969 -17.057 -2.220 61 HB THR 7 HB THR 7 -4.579 -15.455 -2.988 62 HG1 THR 7 HG1 THR 7 -3.177 -16.785 -4.897 63 HG21 THR 7 HG21 THR 7 -3.069 -16.812 -1.545 64 HG22 THR 7 HG22 THR 7 -2.197 -15.963 -2.822 65 HG23 THR 7 HG23 THR 7 -2.530 -17.688 -2.978 66 HA PRO 8 HA PRO 8 -7.873 -18.485 -5.979 67 HB2 PRO 8 HB2 PRO 8 -9.476 -16.428 -6.576 68 HB3 PRO 8 HB1 PRO 8 -9.640 -17.278 -5.025 69 HG2 PRO 8 HG2 PRO 8 -8.460 -14.623 -5.607 70 HG3 PRO 8 HG1 PRO 8 -9.308 -15.194 -4.161 71 HD2 PRO 8 HD2 PRO 8 -6.475 -15.032 -4.537 72 HD3 PRO 8 HD1 PRO 8 -7.341 -15.743 -3.159 73 H TYR 9 H TYR 9 -7.090 -18.736 -7.993 74 HA TYR 9 HA TYR 9 -5.554 -16.585 -9.246 75 HB2 TYR 9 HB2 TYR 9 -4.863 -19.094 -9.075 76 HB3 TYR 9 HB1 TYR 9 -5.960 -19.306 -10.439 77 HD1 TYR 9 HD1 TYR 9 -4.931 -19.276 -12.515 78 HD2 TYR 9 HD2 TYR 9 -3.383 -16.769 -9.389 79 HE1 TYR 9 HE1 TYR 9 -3.180 -18.434 -14.056 80 HE2 TYR 9 HE2 TYR 9 -1.633 -15.929 -10.928 81 HH TYR 9 HH TYR 9 -1.487 -17.027 -14.318 82 H LYS 10 H LYS 10 -8.143 -18.857 -10.226 83 HA LYS 10 HA LYS 10 -9.793 -18.651 -11.820 84 HB2 LYS 10 HB2 LYS 10 -9.676 -15.670 -11.621 85 HB3 LYS 10 HB1 LYS 10 -11.080 -16.735 -11.690 86 HG2 LYS 10 HG2 LYS 10 -9.964 -17.559 -9.354 87 HG3 LYS 10 HG1 LYS 10 -9.490 -15.860 -9.351 88 HD2 LYS 10 HD2 LYS 10 -12.321 -16.851 -9.790 89 HD3 LYS 10 HD1 LYS 10 -11.702 -16.236 -8.257 90 HE2 LYS 10 HE2 LYS 10 -11.698 -14.064 -8.975 91 HE3 LYS 10 HE1 LYS 10 -11.255 -14.503 -10.624 92 HZ1 LYS 10 HZ1 LYS 10 -13.866 -14.175 -9.443 93 HZ2 LYS 10 HZ2 LYS 10 -13.705 -15.581 -10.383 94 HZ3 LYS 10 HZ3 LYS 10 -13.386 -14.059 -11.067 95 H LYS 11 H LYS 11 -8.036 -15.623 -12.341 96 HA LYS 11 HA LYS 11 -7.641 -14.752 -14.547 97 HB2 LYS 11 HB2 LYS 11 -5.560 -16.416 -13.265 98 HB3 LYS 11 HB1 LYS 11 -5.281 -16.025 -14.966 99 HG2 LYS 11 HG2 LYS 11 -5.290 -13.704 -14.567 100 HG3 LYS 11 HG1 LYS 11 -6.126 -13.882 -13.024 101 HD2 LYS 11 HD2 LYS 11 -4.027 -15.193 -12.269 102 HD3 LYS 11 HD1 LYS 11 -3.241 -14.469 -13.672 103 HE2 LYS 11 HE2 LYS 11 -2.846 -12.669 -12.367 104 HE3 LYS 11 HE1 LYS 11 -4.573 -12.332 -12.479 105 HZ1 LYS 11 HZ1 LYS 11 -4.322 -14.298 -10.572 106 HZ2 LYS 11 HZ2 LYS 11 -4.666 -12.656 -10.305 107 HZ3 LYS 11 HZ3 LYS 11 -3.062 -13.213 -10.244 108 H ARG 12 H ARG 12 -5.944 -17.705 -15.175 109 HA ARG 12 HA ARG 12 -7.936 -18.903 -16.852 110 HB2 ARG 12 HB2 ARG 12 -6.907 -18.486 -19.006 111 HB3 ARG 12 HB1 ARG 12 -7.286 -16.941 -18.245 112 HG2 ARG 12 HG2 ARG 12 -5.126 -16.344 -18.411 113 HG3 ARG 12 HG1 ARG 12 -4.684 -17.697 -17.369 114 HD2 ARG 12 HD2 ARG 12 -3.552 -17.710 -19.626 115 HD3 ARG 12 HD1 ARG 12 -4.457 -19.175 -19.254 116 HE ARG 12 HE ARG 12 -5.788 -18.695 -21.078 117 HH11 ARG 12 HH11 ARG 12 -6.654 -17.364 -22.703 118 HH12 ARG 12 HH12 ARG 12 -6.302 -15.668 -22.705 119 HH21 ARG 12 HH21 ARG 12 -4.325 -15.806 -19.859 120 HH22 ARG 12 HH22 ARG 12 -4.982 -14.786 -21.094 121 H LYS 13 H LYS 13 -6.498 -20.391 -18.551 122 HA LYS 13 HA LYS 13 -5.218 -22.279 -16.844 123 HB2 LYS 13 HB2 LYS 13 -5.359 -22.071 -19.859 124 HB3 LYS 13 HB1 LYS 13 -4.668 -23.443 -18.995 125 HG2 LYS 13 HG2 LYS 13 -6.836 -23.761 -17.815 126 HG3 LYS 13 HG1 LYS 13 -7.520 -22.442 -18.766 127 HD2 LYS 13 HD2 LYS 13 -6.189 -24.761 -20.144 128 HD3 LYS 13 HD1 LYS 13 -7.860 -24.897 -19.597 129 HE2 LYS 13 HE2 LYS 13 -7.195 -22.411 -21.065 130 HE3 LYS 13 HE1 LYS 13 -7.165 -23.892 -22.022 131 HZ1 LYS 13 HZ1 LYS 13 -9.362 -23.874 -22.059 132 HZ2 LYS 13 HZ2 LYS 13 -9.390 -22.445 -21.138 133 HZ3 LYS 13 HZ3 LYS 13 -9.419 -23.958 -20.367 134 H PHE 14 H PHE 14 -3.071 -23.081 -18.586 135 HA PHE 14 HA PHE 14 -0.790 -22.801 -18.687 136 HB2 PHE 14 HB2 PHE 14 -1.903 -20.137 -19.502 137 HB3 PHE 14 HB1 PHE 14 -0.160 -20.344 -19.340 138 HD1 PHE 14 HD1 PHE 14 -2.927 -22.553 -20.591 139 HD2 PHE 14 HD2 PHE 14 0.839 -20.660 -21.420 140 HE1 PHE 14 HE1 PHE 14 -2.853 -23.670 -22.804 141 HE2 PHE 14 HE2 PHE 14 0.913 -21.778 -23.631 142 HZ PHE 14 HZ PHE 14 -0.932 -23.283 -24.324 143 HA PRO 15 HA PRO 15 -0.836 -21.342 -14.235 144 HB2 PRO 15 HB2 PRO 15 1.216 -23.508 -14.242 145 HB3 PRO 15 HB1 PRO 15 -0.077 -23.183 -13.074 146 HG2 PRO 15 HG2 PRO 15 -0.242 -25.180 -14.836 147 HG3 PRO 15 HG1 PRO 15 -1.664 -24.258 -14.324 148 HD2 PRO 15 HD2 PRO 15 -0.203 -24.166 -16.918 149 HD3 PRO 15 HD1 PRO 15 -1.914 -23.836 -16.572 150 H TYR 16 H TYR 16 0.400 -19.621 -13.731 151 HA TYR 16 HA TYR 16 2.974 -19.271 -15.099 152 HB2 TYR 16 HB2 TYR 16 0.890 -17.484 -14.099 153 HB3 TYR 16 HB1 TYR 16 2.507 -16.985 -13.601 154 HD1 TYR 16 HD1 TYR 16 3.631 -15.560 -15.050 155 HD2 TYR 16 HD2 TYR 16 0.852 -18.411 -16.661 156 HE1 TYR 16 HE1 TYR 16 4.074 -14.702 -17.336 157 HE2 TYR 16 HE2 TYR 16 1.294 -17.553 -18.945 158 HH TYR 16 HH TYR 16 3.879 -15.769 -19.768 159 H LYS 17 H LYS 17 1.772 -20.423 -12.207 160 HA LYS 17 HA LYS 17 2.749 -21.027 -10.227 161 HB2 LYS 17 HB2 LYS 17 4.540 -22.062 -11.293 162 HB3 LYS 17 HB1 LYS 17 5.151 -20.550 -11.962 163 HG2 LYS 17 HG2 LYS 17 5.966 -19.826 -9.834 164 HG3 LYS 17 HG1 LYS 17 5.100 -21.112 -8.991 165 HD2 LYS 17 HD2 LYS 17 6.863 -22.486 -9.241 166 HD3 LYS 17 HD1 LYS 17 6.767 -22.309 -10.993 167 HE2 LYS 17 HE2 LYS 17 8.222 -20.418 -10.981 168 HE3 LYS 17 HE1 LYS 17 8.089 -20.237 -9.232 169 HZ1 LYS 17 HZ1 LYS 17 9.600 -22.220 -10.786 170 HZ2 LYS 17 HZ2 LYS 17 9.038 -22.638 -9.238 171 HZ3 LYS 17 HZ3 LYS 17 10.085 -21.315 -9.436 172 H SER 18 H SER 18 4.630 -18.229 -11.440 173 HA SER 18 HA SER 18 4.839 -17.095 -8.805 174 HB2 SER 18 HB2 SER 18 6.122 -15.391 -9.810 175 HB3 SER 18 HB1 SER 18 6.495 -16.836 -10.748 176 HG SER 18 HG SER 18 5.468 -14.538 -11.586 177 H GLU 19 H GLU 19 3.372 -15.785 -11.789 178 HA GLU 19 HA GLU 19 2.032 -13.630 -10.934 179 HB2 GLU 19 HB2 GLU 19 1.823 -14.503 -13.217 180 HB3 GLU 19 HB1 GLU 19 0.826 -15.832 -12.632 181 HG2 GLU 19 HG2 GLU 19 -0.921 -14.463 -13.115 182 HG3 GLU 19 HG1 GLU 19 -0.503 -13.654 -11.608 183 H CYS 20 H CYS 20 1.299 -16.928 -10.062 184 HA CYS 20 HA CYS 20 -1.152 -16.174 -8.665 185 HB2 CYS 20 HB2 CYS 20 -0.699 -18.362 -10.008 186 HB3 CYS 20 HB1 CYS 20 0.133 -18.882 -8.543 187 H LEU 21 H LEU 21 2.014 -17.601 -7.869 188 HA LEU 21 HA LEU 21 1.619 -17.677 -5.073 189 HB2 LEU 21 HB2 LEU 21 3.416 -18.912 -6.260 190 HB3 LEU 21 HB1 LEU 21 4.223 -17.383 -6.597 191 HG LEU 21 HG LEU 21 4.016 -17.047 -3.988 192 HD11 LEU 21 HD11 LEU 21 4.479 -19.934 -3.739 193 HD12 LEU 21 HD12 LEU 21 2.831 -19.536 -4.226 194 HD13 LEU 21 HD13 LEU 21 3.497 -18.864 -2.737 195 HD21 LEU 21 HD21 LEU 21 6.243 -18.026 -3.739 196 HD22 LEU 21 HD22 LEU 21 6.120 -17.259 -5.323 197 HD23 LEU 21 HD23 LEU 21 5.998 -19.012 -5.180 198 H LYS 22 H LYS 22 2.563 -15.129 -7.265 199 HA LYS 22 HA LYS 22 3.791 -13.322 -5.544 200 HB2 LYS 22 HB2 LYS 22 3.068 -13.257 -8.154 201 HB3 LYS 22 HB1 LYS 22 1.861 -12.169 -7.467 202 HG2 LYS 22 HG2 LYS 22 4.834 -11.933 -6.933 203 HG3 LYS 22 HG1 LYS 22 3.984 -11.014 -8.177 204 HD2 LYS 22 HD2 LYS 22 2.371 -10.405 -6.166 205 HD3 LYS 22 HD1 LYS 22 3.789 -10.798 -5.194 206 HE2 LYS 22 HE2 LYS 22 3.714 -8.796 -7.470 207 HE3 LYS 22 HE1 LYS 22 3.753 -8.397 -5.752 208 HZ1 LYS 22 HZ1 LYS 22 5.961 -8.276 -6.524 209 HZ2 LYS 22 HZ2 LYS 22 5.845 -9.758 -7.348 210 HZ3 LYS 22 HZ3 LYS 22 5.859 -9.725 -5.649 211 H ALA 23 H ALA 23 0.323 -13.737 -6.237 212 HA ALA 23 HA ALA 23 -0.638 -11.683 -4.589 213 HB1 ALA 23 HB1 ALA 23 -1.824 -13.417 -6.271 214 HB2 ALA 23 HB2 ALA 23 -2.717 -12.517 -5.046 215 HB3 ALA 23 HB3 ALA 23 -2.232 -14.184 -4.736 216 H CYS 24 H CYS 24 0.023 -15.100 -3.877 217 HA CYS 24 HA CYS 24 -0.888 -15.085 -1.208 218 HB2 CYS 24 HB2 CYS 24 0.025 -17.014 -2.866 219 HB3 CYS 24 HB1 CYS 24 1.445 -16.793 -1.845 220 H ALA 25 H ALA 25 2.308 -14.406 -2.602 221 HA ALA 25 HA ALA 25 3.584 -14.016 -0.067 222 HB1 ALA 25 HB1 ALA 25 5.456 -13.141 -1.389 223 HB2 ALA 25 HB2 ALA 25 4.433 -13.101 -2.824 224 HB3 ALA 25 HB3 ALA 25 4.851 -14.645 -2.083 225 H THR 26 H THR 26 1.667 -12.043 -2.157 226 HA THR 26 HA THR 26 2.603 -9.525 -1.082 227 HB THR 26 HB THR 26 0.157 -10.124 -2.760 228 HG1 THR 26 HG1 THR 26 2.394 -8.905 -3.820 229 HG21 THR 26 HG21 THR 26 0.530 -7.659 -3.361 230 HG22 THR 26 HG22 THR 26 1.584 -7.590 -1.950 231 HG23 THR 26 HG23 THR 26 -0.123 -7.989 -1.757 232 H SER 27 H SER 27 0.421 -11.948 -0.111 233 HA SER 27 HA SER 27 -1.738 -10.851 1.048 234 HB2 SER 27 HB2 SER 27 -0.619 -13.221 1.366 235 HB3 SER 27 HB1 SER 27 -0.023 -12.502 2.860 236 HG SER 27 HG SER 27 -2.203 -11.965 3.350 237 H PHE 28 H PHE 28 1.577 -10.478 2.213 238 HA PHE 28 HA PHE 28 0.638 -8.281 3.954 239 HB2 PHE 28 HB2 PHE 28 1.553 -10.630 4.954 240 HB3 PHE 28 HB1 PHE 28 3.069 -9.740 4.802 241 HD1 PHE 28 HD1 PHE 28 -0.468 -9.155 5.928 242 HD2 PHE 28 HD2 PHE 28 3.707 -8.386 6.584 243 HE1 PHE 28 HE1 PHE 28 -1.027 -7.854 7.964 244 HE2 PHE 28 HE2 PHE 28 3.147 -7.083 8.619 245 HZ PHE 28 HZ PHE 28 0.780 -6.818 9.309 246 H THR 29 H THR 29 2.149 -6.566 4.269 247 HA THR 29 HA THR 29 4.154 -6.390 2.105 248 HB THR 29 HB THR 29 3.541 -4.234 1.744 249 HG1 THR 29 HG1 THR 29 2.919 -4.010 4.502 250 HG21 THR 29 HG21 THR 29 1.173 -5.187 3.380 251 HG22 THR 29 HG22 THR 29 1.411 -5.443 1.651 252 HG23 THR 29 HG23 THR 29 1.156 -3.814 2.274 253 H GLY 30 H GLY 30 6.192 -6.555 2.754 254 HA2 GLY 30 HA2 GLY 30 8.089 -5.766 3.944 255 HA3 GLY 30 HA1 GLY 30 7.024 -5.238 5.244 256 H GLY 31 H GLY 31 5.975 -8.225 4.325 257 HA2 GLY 31 HA2 GLY 31 7.496 -9.525 6.498 258 HA3 GLY 31 HA1 GLY 31 5.878 -9.988 5.979 259 H ASP 32 H ASP 32 6.178 -10.100 3.239 260 HA ASP 32 HA ASP 32 6.842 -11.512 1.554 261 HB2 ASP 32 HB2 ASP 32 9.067 -10.327 2.206 262 HB3 ASP 32 HB1 ASP 32 9.480 -11.873 2.944 263 H GLU 33 H GLU 33 9.138 -13.497 2.585 264 HA GLU 33 HA GLU 33 7.955 -15.879 2.508 265 HB2 GLU 33 HB2 GLU 33 10.004 -14.941 4.521 266 HB3 GLU 33 HB1 GLU 33 9.518 -16.630 4.387 267 HG2 GLU 33 HG2 GLU 33 9.998 -16.031 1.767 268 HG3 GLU 33 HG1 GLU 33 11.177 -14.994 2.565 269 H SER 34 H SER 34 7.861 -13.781 5.369 270 HA SER 34 HA SER 34 6.600 -15.340 7.213 271 HB2 SER 34 HB2 SER 34 7.233 -12.959 7.553 272 HB3 SER 34 HB1 SER 34 5.840 -12.477 6.589 273 HG SER 34 HG SER 34 4.998 -14.216 8.388 274 H ARG 35 H ARG 35 4.693 -16.310 7.455 275 HA ARG 35 HA ARG 35 2.493 -16.886 7.182 276 HB2 ARG 35 HB2 ARG 35 2.249 -14.671 5.143 277 HB3 ARG 35 HB1 ARG 35 0.961 -15.476 6.029 278 HG2 ARG 35 HG2 ARG 35 1.706 -14.535 8.125 279 HG3 ARG 35 HG1 ARG 35 3.147 -13.864 7.364 280 HD2 ARG 35 HD2 ARG 35 2.022 -12.027 6.723 281 HD3 ARG 35 HD1 ARG 35 0.789 -13.006 5.934 282 HE ARG 35 HE ARG 35 -0.541 -12.306 7.691 283 HH11 ARG 35 HH11 ARG 35 -1.031 -11.962 9.883 284 HH12 ARG 35 HH12 ARG 35 0.208 -12.143 11.080 285 HH21 ARG 35 HH21 ARG 35 2.672 -12.979 8.789 286 HH22 ARG 35 HH22 ARG 35 2.303 -12.718 10.461 287 H ILE 36 H ILE 36 4.901 -16.925 4.921 288 HA ILE 36 HA ILE 36 3.514 -19.008 3.412 289 HB ILE 36 HB ILE 36 5.090 -17.023 1.819 290 HG12 ILE 36 HG12 ILE 36 3.292 -15.805 3.196 291 HG13 ILE 36 HG11 ILE 36 3.183 -15.634 1.445 292 HG21 ILE 36 HG21 ILE 36 2.782 -18.909 1.298 293 HG22 ILE 36 HG22 ILE 36 4.449 -19.092 0.752 294 HG23 ILE 36 HG23 ILE 36 3.441 -17.804 0.092 295 HD11 ILE 36 HD11 ILE 36 1.758 -17.975 2.553 296 HD12 ILE 36 HD12 ILE 36 1.249 -16.829 1.315 297 HD13 ILE 36 HD13 ILE 36 1.095 -16.409 3.021 298 H GLN 37 H GLN 37 6.535 -17.231 2.823 299 HA GLN 37 HA GLN 37 8.729 -17.932 2.819 300 HB2 GLN 37 HB2 GLN 37 8.055 -18.711 5.172 301 HB3 GLN 37 HB1 GLN 37 7.874 -20.316 4.459 302 HG2 GLN 37 HG2 GLN 37 10.257 -19.871 3.481 303 HG3 GLN 37 HG1 GLN 37 10.356 -18.648 4.746 304 HE21 GLN 37 HE21 GLN 37 10.467 -19.372 6.967 305 HE22 GLN 37 HE22 GLN 37 10.687 -21.007 7.369 306 H GLU 38 H GLU 38 6.264 -20.387 2.330 307 HA GLU 38 HA GLU 38 7.455 -21.199 -0.161 308 HB2 GLU 38 HB2 GLU 38 8.748 -22.537 1.458 309 HB3 GLU 38 HB1 GLU 38 7.249 -23.219 2.082 310 HG2 GLU 38 HG2 GLU 38 6.917 -23.682 -0.571 311 HG3 GLU 38 HG1 GLU 38 8.674 -23.776 -0.460 312 H GLY 39 H GLY 39 5.960 -22.010 -1.507 313 HA2 GLY 39 HA2 GLY 39 3.464 -23.125 -0.522 314 HA3 GLY 39 HA1 GLY 39 3.312 -21.571 -1.337 315 H LYS 40 H LYS 40 2.053 -23.833 -2.321 316 HA LYS 40 HA LYS 40 3.677 -24.559 -4.671 317 HB2 LYS 40 HB2 LYS 40 1.691 -26.015 -3.035 318 HB3 LYS 40 HB1 LYS 40 1.569 -26.261 -4.779 319 HG2 LYS 40 HG2 LYS 40 3.880 -26.959 -4.909 320 HG3 LYS 40 HG1 LYS 40 4.151 -26.534 -3.218 321 HD2 LYS 40 HD2 LYS 40 3.831 -28.902 -3.248 322 HD3 LYS 40 HD1 LYS 40 2.320 -28.221 -2.644 323 HE2 LYS 40 HE2 LYS 40 1.252 -28.478 -4.777 324 HE3 LYS 40 HE1 LYS 40 2.781 -28.867 -5.565 325 HZ1 LYS 40 HZ1 LYS 40 1.411 -30.836 -5.088 326 HZ2 LYS 40 HZ2 LYS 40 1.525 -30.500 -3.427 327 HZ3 LYS 40 HZ3 LYS 40 2.919 -30.890 -4.316 328 HA PRO 41 HA PRO 41 0.548 -22.313 -6.948 329 HB2 PRO 41 HB2 PRO 41 1.443 -22.638 -9.412 330 HB3 PRO 41 HB1 PRO 41 2.502 -21.881 -8.200 331 HG2 PRO 41 HG2 PRO 41 2.527 -24.672 -9.249 332 HG3 PRO 41 HG1 PRO 41 3.877 -23.591 -8.884 333 HD2 PRO 41 HD2 PRO 41 2.873 -25.593 -7.162 334 HD3 PRO 41 HD1 PRO 41 3.963 -24.264 -6.704 335 H GLY 42 H GLY 42 -1.136 -22.572 -8.534 336 HA2 GLY 42 HA2 GLY 42 -1.753 -25.196 -9.601 337 HA3 GLY 42 HA1 GLY 42 -2.851 -24.643 -8.339 338 H PHE 43 H PHE 43 -3.647 -25.134 -11.015 339 HA PHE 43 HA PHE 43 -3.854 -22.580 -12.374 340 HB2 PHE 43 HB2 PHE 43 -3.831 -24.232 -13.971 341 HB3 PHE 43 HB1 PHE 43 -4.651 -25.397 -12.934 342 HD1 PHE 43 HD1 PHE 43 -6.648 -26.072 -13.924 343 HD2 PHE 43 HD2 PHE 43 -5.530 -21.928 -14.078 344 HE1 PHE 43 HE1 PHE 43 -8.807 -25.531 -15.018 345 HE2 PHE 43 HE2 PHE 43 -7.690 -21.386 -15.172 346 HZ PHE 43 HZ PHE 43 -9.328 -23.188 -15.642 347 H PHE 44 H PHE 44 -5.571 -21.201 -12.335 348 HA PHE 44 HA PHE 44 -7.543 -20.242 -11.644 349 HB2 PHE 44 HB2 PHE 44 -8.891 -21.767 -12.719 350 HB3 PHE 44 HB1 PHE 44 -8.212 -23.145 -11.859 351 HD1 PHE 44 HD1 PHE 44 -10.796 -20.591 -11.885 352 HD2 PHE 44 HD2 PHE 44 -8.852 -23.556 -9.461 353 HE1 PHE 44 HE1 PHE 44 -12.678 -20.507 -10.274 354 HE2 PHE 44 HE2 PHE 44 -10.736 -23.475 -7.850 355 HZ PHE 44 HZ PHE 44 -12.649 -21.949 -8.256 356 H LYS 45 H LYS 45 -5.454 -21.754 -9.742 357 HA LYS 45 HA LYS 45 -6.291 -20.540 -7.347 358 HB2 LYS 45 HB2 LYS 45 -6.987 -22.437 -6.026 359 HB3 LYS 45 HB1 LYS 45 -8.029 -22.330 -7.441 360 HG2 LYS 45 HG2 LYS 45 -6.808 -24.098 -8.554 361 HG3 LYS 45 HG1 LYS 45 -5.584 -24.117 -7.284 362 HD2 LYS 45 HD2 LYS 45 -7.930 -24.460 -5.863 363 HD3 LYS 45 HD1 LYS 45 -8.234 -25.378 -7.338 364 HE2 LYS 45 HE2 LYS 45 -6.097 -26.582 -7.027 365 HE3 LYS 45 HE1 LYS 45 -5.806 -25.674 -5.543 366 HZ1 LYS 45 HZ1 LYS 45 -6.992 -27.184 -4.469 367 HZ2 LYS 45 HZ2 LYS 45 -7.364 -27.992 -5.916 368 HZ3 LYS 45 HZ3 LYS 45 -8.365 -26.737 -5.360 369 H CYS 46 H CYS 46 -4.899 -21.127 -5.503 370 HA CYS 46 HA CYS 46 -2.607 -22.823 -6.004 371 HB2 CYS 46 HB2 CYS 46 -2.153 -19.859 -5.633 372 HB3 CYS 46 HB1 CYS 46 -0.929 -21.102 -5.890 373 H THR 47 H THR 47 -1.790 -23.576 -4.149 374 HA THR 47 HA THR 47 -2.814 -22.384 -1.647 375 HB THR 47 HB THR 47 -3.300 -24.850 -2.405 376 HG1 THR 47 HG1 THR 47 -2.508 -23.907 0.129 377 HG21 THR 47 HG21 THR 47 -1.648 -26.434 -1.901 378 HG22 THR 47 HG22 THR 47 -0.735 -25.301 -0.905 379 HG23 THR 47 HG23 THR 47 -0.725 -25.138 -2.660 380 H CYS 48 H CYS 48 -1.451 -21.783 -0.048 381 HA CYS 48 HA CYS 48 1.438 -22.278 -0.439 382 HB2 CYS 48 HB2 CYS 48 0.794 -19.791 0.962 383 HB3 CYS 48 HB1 CYS 48 1.922 -20.077 -0.364 384 H TYR 49 H TYR 49 2.706 -22.157 1.574 385 HA TYR 49 HA TYR 49 1.067 -22.742 3.970 386 HB2 TYR 49 HB2 TYR 49 3.657 -24.095 3.171 387 HB3 TYR 49 HB1 TYR 49 2.715 -24.424 4.627 388 HD1 TYR 49 HD1 TYR 49 0.457 -25.455 4.461 389 HD2 TYR 49 HD2 TYR 49 2.978 -24.938 1.021 390 HE1 TYR 49 HE1 TYR 49 -0.947 -27.057 3.191 391 HE2 TYR 49 HE2 TYR 49 1.574 -26.542 -0.248 392 HH TYR 49 HH TYR 49 -1.115 -27.292 0.085 393 H PHE 50 H PHE 50 1.855 -21.962 5.930 394 HA PHE 50 HA PHE 50 3.945 -19.914 5.659 395 HB2 PHE 50 HB2 PHE 50 1.973 -18.976 6.575 396 HB3 PHE 50 HB1 PHE 50 1.723 -20.347 7.648 397 HD1 PHE 50 HD1 PHE 50 5.094 -18.922 7.154 398 HD2 PHE 50 HD2 PHE 50 1.585 -18.933 9.639 399 HE1 PHE 50 HE1 PHE 50 6.354 -17.763 8.940 400 HE2 PHE 50 HE2 PHE 50 2.853 -17.773 11.424 401 HZ PHE 50 HZ PHE 50 5.236 -17.188 11.075 402 H THR 51 H THR 51 5.871 -20.949 5.927 403 HA THR 51 HA THR 51 6.461 -23.145 7.497 404 HB THR 51 HB THR 51 8.251 -20.763 6.962 405 HG1 THR 51 HG1 THR 51 7.221 -22.696 5.406 406 HG21 THR 51 HG21 THR 51 9.239 -22.075 8.700 407 HG22 THR 51 HG22 THR 51 10.039 -22.564 7.207 408 HG23 THR 51 HG23 THR 51 8.784 -23.584 7.909 409 H THR 52 H THR 52 5.689 -23.307 9.539 410 HA THR 52 HA THR 52 6.987 -21.833 11.617 411 HB THR 52 HB THR 52 4.317 -21.289 12.292 412 HG1 THR 52 HG1 THR 52 4.561 -19.868 10.010 413 HG21 THR 52 HG21 THR 52 6.468 -20.003 12.741 414 HG22 THR 52 HG22 THR 52 5.065 -19.017 12.326 415 HG23 THR 52 HG23 THR 52 6.306 -19.340 11.115 416 H GLY 53 H GLY 53 7.467 -23.668 12.698 417 HA2 GLY 53 HA2 GLY 53 5.425 -25.715 13.115 418 HA3 GLY 53 HA1 GLY 53 7.124 -25.830 13.558 Start of MODEL 11 1 H1 GLU 1 H1 GLU 1 0.894 -31.383 10.971 2 H2 GLU 1 H2 GLU 1 0.968 -30.295 9.669 3 H3 GLU 1 H3 GLU 1 -0.537 -30.820 10.255 4 HA GLU 1 HA GLU 1 -0.617 -29.167 11.698 5 HB2 GLU 1 HB2 GLU 1 2.128 -30.152 12.532 6 HB3 GLU 1 HB1 GLU 1 1.172 -28.971 13.429 7 HG2 GLU 1 HG2 GLU 1 0.017 -31.656 12.697 8 HG3 GLU 1 HG1 GLU 1 1.011 -31.463 14.140 9 H VAL 2 H VAL 2 -0.585 -27.691 9.908 10 HA VAL 2 HA VAL 2 1.469 -25.706 10.117 11 HB VAL 2 HB VAL 2 2.765 -27.103 8.691 12 HG11 VAL 2 HG11 VAL 2 0.114 -27.753 7.577 13 HG12 VAL 2 HG12 VAL 2 1.570 -28.744 7.672 14 HG13 VAL 2 HG13 VAL 2 1.383 -27.576 6.364 15 HG21 VAL 2 HG21 VAL 2 2.979 -25.741 6.713 16 HG22 VAL 2 HG22 VAL 2 2.496 -24.668 8.027 17 HG23 VAL 2 HG23 VAL 2 1.307 -25.197 6.838 18 H ILE 3 H ILE 3 0.783 -23.757 9.373 19 HA ILE 3 HA ILE 3 -1.998 -23.468 8.776 20 HB ILE 3 HB ILE 3 -1.288 -21.611 9.909 21 HG12 ILE 3 HG12 ILE 3 -0.549 -20.748 7.096 22 HG13 ILE 3 HG11 ILE 3 -2.206 -20.866 7.688 23 HG21 ILE 3 HG21 ILE 3 1.323 -22.055 8.471 24 HG22 ILE 3 HG22 ILE 3 1.003 -22.052 10.207 25 HG23 ILE 3 HG23 ILE 3 1.002 -20.536 9.307 26 HD11 ILE 3 HD11 ILE 3 -2.031 -18.841 8.651 27 HD12 ILE 3 HD12 ILE 3 -0.403 -18.690 7.991 28 HD13 ILE 3 HD13 ILE 3 -0.644 -19.389 9.592 29 H LYS 4 H LYS 4 -3.012 -23.207 6.874 30 HA LYS 4 HA LYS 4 -1.345 -23.113 4.428 31 HB2 LYS 4 HB2 LYS 4 -4.055 -24.427 4.690 32 HB3 LYS 4 HB1 LYS 4 -2.940 -24.526 3.327 33 HG2 LYS 4 HG2 LYS 4 -1.336 -25.378 5.361 34 HG3 LYS 4 HG1 LYS 4 -2.902 -25.978 5.902 35 HD2 LYS 4 HD2 LYS 4 -3.191 -26.885 3.512 36 HD3 LYS 4 HD1 LYS 4 -1.463 -26.587 3.318 37 HE2 LYS 4 HE2 LYS 4 -1.003 -28.508 4.389 38 HE3 LYS 4 HE1 LYS 4 -1.855 -27.923 5.818 39 HZ1 LYS 4 HZ1 LYS 4 -3.733 -29.026 5.268 40 HZ2 LYS 4 HZ2 LYS 4 -2.634 -30.047 4.468 41 HZ3 LYS 4 HZ3 LYS 4 -3.491 -28.865 3.597 42 H LYS 5 H LYS 5 -1.537 -21.168 3.503 43 HA LYS 5 HA LYS 5 -4.215 -19.908 3.488 44 HB2 LYS 5 HB2 LYS 5 -3.054 -17.724 3.416 45 HB3 LYS 5 HB1 LYS 5 -2.685 -18.622 4.889 46 HG2 LYS 5 HG2 LYS 5 -0.495 -18.488 4.400 47 HG3 LYS 5 HG1 LYS 5 -0.783 -19.421 2.931 48 HD2 LYS 5 HD2 LYS 5 0.189 -17.391 2.171 49 HD3 LYS 5 HD1 LYS 5 -1.540 -17.198 1.874 50 HE2 LYS 5 HE2 LYS 5 -1.823 -15.746 3.697 51 HE3 LYS 5 HE1 LYS 5 -0.337 -16.288 4.479 52 HZ1 LYS 5 HZ1 LYS 5 0.676 -14.587 3.517 53 HZ2 LYS 5 HZ2 LYS 5 -0.710 -14.185 2.619 54 HZ3 LYS 5 HZ3 LYS 5 0.406 -15.311 2.006 55 H ASP 6 H ASP 6 -4.983 -20.380 1.520 56 HA ASP 6 HA ASP 6 -3.243 -19.937 -0.826 57 HB2 ASP 6 HB2 ASP 6 -4.628 -21.465 -2.024 58 HB3 ASP 6 HB1 ASP 6 -4.298 -22.220 -0.465 59 H THR 7 H THR 7 -3.847 -18.466 -2.378 60 HA THR 7 HA THR 7 -6.308 -16.944 -1.791 61 HB THR 7 HB THR 7 -5.018 -15.117 -1.896 62 HG1 THR 7 HG1 THR 7 -3.800 -15.459 -4.279 63 HG21 THR 7 HG21 THR 7 -2.823 -16.985 -2.835 64 HG22 THR 7 HG22 THR 7 -3.153 -16.521 -1.165 65 HG23 THR 7 HG23 THR 7 -2.579 -15.316 -2.317 66 HA PRO 8 HA PRO 8 -7.594 -17.991 -5.937 67 HB2 PRO 8 HB2 PRO 8 -9.584 -16.255 -6.294 68 HB3 PRO 8 HB1 PRO 8 -9.636 -17.397 -4.934 69 HG2 PRO 8 HG2 PRO 8 -9.034 -14.492 -4.938 70 HG3 PRO 8 HG1 PRO 8 -9.831 -15.482 -3.705 71 HD2 PRO 8 HD2 PRO 8 -7.081 -14.691 -3.754 72 HD3 PRO 8 HD1 PRO 8 -7.862 -15.810 -2.616 73 H TYR 9 H TYR 9 -6.752 -17.602 -7.941 74 HA TYR 9 HA TYR 9 -6.798 -15.171 -9.308 75 HB2 TYR 9 HB2 TYR 9 -5.243 -14.238 -7.768 76 HB3 TYR 9 HB1 TYR 9 -4.243 -15.687 -7.784 77 HD1 TYR 9 HD1 TYR 9 -5.078 -12.578 -9.504 78 HD2 TYR 9 HD2 TYR 9 -2.934 -16.285 -9.805 79 HE1 TYR 9 HE1 TYR 9 -3.787 -11.675 -11.419 80 HE2 TYR 9 HE2 TYR 9 -1.650 -15.390 -11.719 81 HH TYR 9 HH TYR 9 -2.271 -13.356 -13.564 82 H LYS 10 H LYS 10 -5.251 -15.179 -11.224 83 HA LYS 10 HA LYS 10 -3.971 -16.320 -12.838 84 HB2 LYS 10 HB2 LYS 10 -3.502 -18.060 -10.971 85 HB3 LYS 10 HB1 LYS 10 -4.848 -18.943 -11.678 86 HG2 LYS 10 HG2 LYS 10 -3.203 -19.836 -12.993 87 HG3 LYS 10 HG1 LYS 10 -3.499 -18.376 -13.936 88 HD2 LYS 10 HD2 LYS 10 -1.304 -17.924 -13.665 89 HD3 LYS 10 HD1 LYS 10 -1.692 -17.537 -11.993 90 HE2 LYS 10 HE2 LYS 10 -0.722 -20.177 -13.096 91 HE3 LYS 10 HE1 LYS 10 0.069 -19.151 -11.901 92 HZ1 LYS 10 HZ1 LYS 10 -2.094 -21.044 -11.571 93 HZ2 LYS 10 HZ2 LYS 10 -2.308 -19.571 -10.753 94 HZ3 LYS 10 HZ3 LYS 10 -0.930 -20.520 -10.455 95 H LYS 11 H LYS 11 -6.750 -15.494 -12.791 96 HA LYS 11 HA LYS 11 -8.067 -17.521 -14.461 97 HB2 LYS 11 HB2 LYS 11 -10.100 -16.371 -14.041 98 HB3 LYS 11 HB1 LYS 11 -9.238 -16.384 -12.500 99 HG2 LYS 11 HG2 LYS 11 -8.259 -14.095 -13.370 100 HG3 LYS 11 HG1 LYS 11 -9.690 -14.103 -14.402 101 HD2 LYS 11 HD2 LYS 11 -10.661 -14.839 -11.887 102 HD3 LYS 11 HD1 LYS 11 -9.483 -13.572 -11.543 103 HE2 LYS 11 HE2 LYS 11 -11.945 -13.427 -13.277 104 HE3 LYS 11 HE1 LYS 11 -11.478 -12.376 -11.940 105 HZ1 LYS 11 HZ1 LYS 11 -9.534 -12.445 -14.045 106 HZ2 LYS 11 HZ2 LYS 11 -10.255 -11.112 -13.277 107 HZ3 LYS 11 HZ3 LYS 11 -11.043 -11.879 -14.573 108 H ARG 12 H ARG 12 -5.824 -15.451 -15.115 109 HA ARG 12 HA ARG 12 -7.060 -13.844 -17.192 110 HB2 ARG 12 HB2 ARG 12 -4.992 -13.244 -15.730 111 HB3 ARG 12 HB1 ARG 12 -4.098 -14.248 -16.873 112 HG2 ARG 12 HG2 ARG 12 -5.499 -12.777 -18.631 113 HG3 ARG 12 HG1 ARG 12 -5.434 -11.620 -17.301 114 HD2 ARG 12 HD2 ARG 12 -2.934 -12.043 -17.200 115 HD3 ARG 12 HD1 ARG 12 -3.102 -12.944 -18.705 116 HE ARG 12 HE ARG 12 -4.203 -10.664 -19.453 117 HH11 ARG 12 HH11 ARG 12 -3.174 -8.721 -20.019 118 HH12 ARG 12 HH12 ARG 12 -1.638 -8.325 -19.322 119 HH21 ARG 12 HH21 ARG 12 -1.456 -11.223 -17.426 120 HH22 ARG 12 HH22 ARG 12 -0.665 -9.742 -17.854 121 H LYS 13 H LYS 13 -4.258 -14.537 -18.560 122 HA LYS 13 HA LYS 13 -5.312 -16.841 -20.090 123 HB2 LYS 13 HB2 LYS 13 -3.945 -14.327 -21.034 124 HB3 LYS 13 HB1 LYS 13 -3.962 -15.794 -22.015 125 HG2 LYS 13 HG2 LYS 13 -6.412 -15.835 -21.961 126 HG3 LYS 13 HG1 LYS 13 -6.429 -14.411 -20.920 127 HD2 LYS 13 HD2 LYS 13 -5.160 -13.190 -22.747 128 HD3 LYS 13 HD1 LYS 13 -5.473 -14.581 -23.786 129 HE2 LYS 13 HE2 LYS 13 -7.607 -12.939 -22.390 130 HE3 LYS 13 HE1 LYS 13 -7.177 -12.803 -24.096 131 HZ1 LYS 13 HZ1 LYS 13 -9.127 -14.279 -23.541 132 HZ2 LYS 13 HZ2 LYS 13 -8.006 -15.367 -22.873 133 HZ3 LYS 13 HZ3 LYS 13 -7.927 -14.967 -24.522 134 H PHE 14 H PHE 14 -3.993 -18.542 -20.315 135 HA PHE 14 HA PHE 14 -2.158 -19.896 -20.106 136 HB2 PHE 14 HB2 PHE 14 -0.984 -17.259 -20.857 137 HB3 PHE 14 HB1 PHE 14 0.109 -18.523 -20.291 138 HD1 PHE 14 HD1 PHE 14 -2.633 -17.853 -22.742 139 HD2 PHE 14 HD2 PHE 14 0.757 -20.285 -21.719 140 HE1 PHE 14 HE1 PHE 14 -2.753 -18.954 -24.960 141 HE2 PHE 14 HE2 PHE 14 0.637 -21.387 -23.937 142 HZ PHE 14 HZ PHE 14 -1.119 -20.722 -25.558 143 HA PRO 15 HA PRO 15 -1.379 -19.406 -15.732 144 HB2 PRO 15 HB2 PRO 15 -0.146 -21.788 -15.296 145 HB3 PRO 15 HB1 PRO 15 -1.894 -21.652 -15.566 146 HG2 PRO 15 HG2 PRO 15 0.251 -22.487 -17.449 147 HG3 PRO 15 HG1 PRO 15 -1.393 -23.117 -17.256 148 HD2 PRO 15 HD2 PRO 15 -0.645 -21.355 -19.249 149 HD3 PRO 15 HD1 PRO 15 -2.305 -21.522 -18.639 150 H TYR 16 H TYR 16 0.397 -19.038 -14.306 151 HA TYR 16 HA TYR 16 3.064 -18.983 -15.571 152 HB2 TYR 16 HB2 TYR 16 1.497 -16.743 -14.494 153 HB3 TYR 16 HB1 TYR 16 3.145 -16.841 -13.875 154 HD1 TYR 16 HD1 TYR 16 4.992 -16.215 -15.211 155 HD2 TYR 16 HD2 TYR 16 1.145 -16.806 -17.026 156 HE1 TYR 16 HE1 TYR 16 5.857 -15.289 -17.342 157 HE2 TYR 16 HE2 TYR 16 2.010 -15.882 -19.159 158 HH TYR 16 HH TYR 16 4.378 -14.057 -19.543 159 H LYS 17 H LYS 17 1.172 -20.067 -13.063 160 HA LYS 17 HA LYS 17 1.642 -21.099 -11.065 161 HB2 LYS 17 HB2 LYS 17 4.545 -21.004 -11.892 162 HB3 LYS 17 HB1 LYS 17 3.752 -22.172 -10.834 163 HG2 LYS 17 HG2 LYS 17 2.364 -22.138 -13.344 164 HG3 LYS 17 HG1 LYS 17 4.089 -22.322 -13.660 165 HD2 LYS 17 HD2 LYS 17 4.056 -24.116 -11.807 166 HD3 LYS 17 HD1 LYS 17 2.300 -24.080 -11.982 167 HE2 LYS 17 HE2 LYS 17 3.268 -24.208 -14.608 168 HE3 LYS 17 HE1 LYS 17 4.291 -25.322 -13.701 169 HZ1 LYS 17 HZ1 LYS 17 1.945 -26.023 -14.662 170 HZ2 LYS 17 HZ2 LYS 17 1.425 -25.410 -13.164 171 HZ3 LYS 17 HZ3 LYS 17 2.559 -26.673 -13.221 172 H SER 18 H SER 18 4.530 -19.071 -11.603 173 HA SER 18 HA SER 18 4.743 -18.206 -8.933 174 HB2 SER 18 HB2 SER 18 6.466 -18.069 -10.867 175 HB3 SER 18 HB1 SER 18 5.672 -16.549 -11.265 176 HG SER 18 HG SER 18 6.253 -15.733 -9.318 177 H GLU 19 H GLU 19 3.438 -16.515 -11.791 178 HA GLU 19 HA GLU 19 2.659 -14.129 -10.756 179 HB2 GLU 19 HB2 GLU 19 2.252 -15.015 -13.103 180 HB3 GLU 19 HB1 GLU 19 0.795 -15.779 -12.466 181 HG2 GLU 19 HG2 GLU 19 0.079 -13.681 -13.318 182 HG3 GLU 19 HG1 GLU 19 0.161 -13.465 -11.570 183 H CYS 20 H CYS 20 1.297 -17.262 -10.032 184 HA CYS 20 HA CYS 20 -0.950 -16.101 -8.561 185 HB2 CYS 20 HB2 CYS 20 -0.882 -18.347 -9.966 186 HB3 CYS 20 HB1 CYS 20 -0.272 -19.010 -8.450 187 H LEU 21 H LEU 21 1.916 -18.101 -7.900 188 HA LEU 21 HA LEU 21 1.583 -18.174 -5.092 189 HB2 LEU 21 HB2 LEU 21 3.064 -19.758 -6.139 190 HB3 LEU 21 HB1 LEU 21 4.043 -18.466 -6.835 191 HG LEU 21 HG LEU 21 4.671 -17.719 -4.565 192 HD11 LEU 21 HD11 LEU 21 4.051 -19.686 -2.821 193 HD12 LEU 21 HD12 LEU 21 2.630 -19.762 -3.863 194 HD13 LEU 21 HD13 LEU 21 3.044 -18.255 -3.044 195 HD21 LEU 21 HD21 LEU 21 5.748 -19.767 -5.910 196 HD22 LEU 21 HD22 LEU 21 5.193 -20.661 -4.496 197 HD23 LEU 21 HD23 LEU 21 6.318 -19.317 -4.304 198 H LYS 22 H LYS 22 2.625 -15.698 -7.238 199 HA LYS 22 HA LYS 22 4.244 -14.227 -5.389 200 HB2 LYS 22 HB2 LYS 22 4.053 -14.043 -8.012 201 HB3 LYS 22 HB1 LYS 22 2.766 -12.898 -7.630 202 HG2 LYS 22 HG2 LYS 22 4.792 -12.162 -5.886 203 HG3 LYS 22 HG1 LYS 22 5.667 -12.593 -7.354 204 HD2 LYS 22 HD2 LYS 22 4.293 -11.071 -8.672 205 HD3 LYS 22 HD1 LYS 22 3.297 -10.705 -7.264 206 HE2 LYS 22 HE2 LYS 22 6.192 -10.314 -6.848 207 HE3 LYS 22 HE1 LYS 22 5.470 -9.228 -8.034 208 HZ1 LYS 22 HZ1 LYS 22 3.992 -9.635 -5.558 209 HZ2 LYS 22 HZ2 LYS 22 4.195 -8.226 -6.485 210 HZ3 LYS 22 HZ3 LYS 22 5.430 -8.743 -5.440 211 H ALA 23 H ALA 23 0.850 -14.181 -6.352 212 HA ALA 23 HA ALA 23 0.067 -11.883 -4.909 213 HB1 ALA 23 HB1 ALA 23 -2.023 -13.873 -4.967 214 HB2 ALA 23 HB2 ALA 23 -1.190 -13.825 -6.521 215 HB3 ALA 23 HB3 ALA 23 -1.910 -12.357 -5.860 216 H CYS 24 H CYS 24 0.876 -15.086 -3.957 217 HA CYS 24 HA CYS 24 -0.545 -15.254 -1.512 218 HB2 CYS 24 HB2 CYS 24 1.383 -16.801 -2.941 219 HB3 CYS 24 HB1 CYS 24 1.941 -16.618 -1.279 220 H ALA 25 H ALA 25 2.789 -14.235 -2.253 221 HA ALA 25 HA ALA 25 3.596 -13.630 0.351 222 HB1 ALA 25 HB1 ALA 25 4.931 -13.599 -1.894 223 HB2 ALA 25 HB2 ALA 25 5.393 -12.488 -0.606 224 HB3 ALA 25 HB3 ALA 25 4.429 -11.910 -1.964 225 H THR 26 H THR 26 1.531 -11.922 -1.863 226 HA THR 26 HA THR 26 1.469 -9.546 -0.148 227 HB THR 26 HB THR 26 0.038 -10.025 -2.767 228 HG1 THR 26 HG1 THR 26 2.233 -10.145 -3.117 229 HG21 THR 26 HG21 THR 26 0.770 -7.481 -1.294 230 HG22 THR 26 HG22 THR 26 -0.838 -8.207 -1.310 231 HG23 THR 26 HG23 THR 26 -0.131 -7.590 -2.805 232 H SER 27 H SER 27 -0.328 -12.429 -0.739 233 HA SER 27 HA SER 27 -2.954 -11.733 -0.337 234 HB2 SER 27 HB2 SER 27 -2.961 -13.983 -0.478 235 HB3 SER 27 HB1 SER 27 -1.340 -14.118 0.194 236 HG SER 27 HG SER 27 -2.175 -14.043 2.223 237 H PHE 28 H PHE 28 -0.491 -12.215 2.191 238 HA PHE 28 HA PHE 28 -2.274 -11.497 4.326 239 HB2 PHE 28 HB2 PHE 28 0.110 -12.805 4.224 240 HB3 PHE 28 HB1 PHE 28 0.631 -11.212 4.773 241 HD1 PHE 28 HD1 PHE 28 0.723 -10.938 7.077 242 HD2 PHE 28 HD2 PHE 28 -2.263 -13.531 5.399 243 HE1 PHE 28 HE1 PHE 28 -0.113 -11.449 9.355 244 HE2 PHE 28 HE2 PHE 28 -3.098 -14.042 7.678 245 HZ PHE 28 HZ PHE 28 -2.023 -13.002 9.655 246 H THR 29 H THR 29 0.499 -9.869 2.780 247 HA THR 29 HA THR 29 -0.748 -7.302 2.889 248 HB THR 29 HB THR 29 1.399 -7.926 4.925 249 HG1 THR 29 HG1 THR 29 -0.698 -6.468 5.735 250 HG21 THR 29 HG21 THR 29 1.148 -5.421 5.417 251 HG22 THR 29 HG22 THR 29 0.401 -5.297 3.824 252 HG23 THR 29 HG23 THR 29 2.068 -5.854 3.976 253 H GLY 30 H GLY 30 2.668 -7.964 3.484 254 HA2 GLY 30 HA2 GLY 30 3.587 -8.108 0.847 255 HA3 GLY 30 HA1 GLY 30 3.558 -6.405 1.298 256 H GLY 31 H GLY 31 5.457 -9.111 1.221 257 HA2 GLY 31 HA2 GLY 31 7.585 -7.887 2.677 258 HA3 GLY 31 HA1 GLY 31 6.875 -9.211 3.595 259 H ASP 32 H ASP 32 7.984 -11.038 3.371 260 HA ASP 32 HA ASP 32 8.506 -12.229 0.843 261 HB2 ASP 32 HB2 ASP 32 10.377 -10.328 1.433 262 HB3 ASP 32 HB1 ASP 32 11.115 -11.769 2.129 263 H GLU 33 H GLU 33 8.752 -14.385 1.093 264 HA GLU 33 HA GLU 33 8.858 -16.431 2.133 265 HB2 GLU 33 HB2 GLU 33 10.748 -14.909 3.946 266 HB3 GLU 33 HB1 GLU 33 10.549 -16.662 3.943 267 HG2 GLU 33 HG2 GLU 33 12.055 -16.791 2.280 268 HG3 GLU 33 HG1 GLU 33 10.937 -15.907 1.244 269 H SER 34 H SER 34 9.333 -14.586 5.108 270 HA SER 34 HA SER 34 7.802 -15.826 6.867 271 HB2 SER 34 HB2 SER 34 8.836 -13.372 6.896 272 HB3 SER 34 HB1 SER 34 7.150 -12.922 6.660 273 HG SER 34 HG SER 34 7.968 -13.223 8.906 274 H ARG 35 H ARG 35 5.731 -16.401 7.228 275 HA ARG 35 HA ARG 35 3.439 -16.489 7.036 276 HB2 ARG 35 HB2 ARG 35 3.554 -14.402 4.859 277 HB3 ARG 35 HB1 ARG 35 2.205 -14.830 5.903 278 HG2 ARG 35 HG2 ARG 35 2.915 -13.494 7.583 279 HG3 ARG 35 HG1 ARG 35 4.594 -13.993 7.393 280 HD2 ARG 35 HD2 ARG 35 4.927 -12.456 5.575 281 HD3 ARG 35 HD1 ARG 35 3.204 -12.103 5.481 282 HE ARG 35 HE ARG 35 3.743 -11.322 7.983 283 HH11 ARG 35 HH11 ARG 35 4.629 -9.330 8.609 284 HH12 ARG 35 HH12 ARG 35 5.661 -8.466 7.520 285 HH21 ARG 35 HH21 ARG 35 5.448 -10.848 5.009 286 HH22 ARG 35 HH22 ARG 35 6.126 -9.325 5.482 287 H ILE 36 H ILE 36 5.757 -16.974 4.679 288 HA ILE 36 HA ILE 36 4.013 -18.889 3.315 289 HB ILE 36 HB ILE 36 5.824 -17.368 1.528 290 HG12 ILE 36 HG12 ILE 36 4.666 -15.613 2.970 291 HG13 ILE 36 HG11 ILE 36 4.328 -15.505 1.244 292 HG21 ILE 36 HG21 ILE 36 3.885 -17.713 0.004 293 HG22 ILE 36 HG22 ILE 36 3.007 -18.463 1.337 294 HG23 ILE 36 HG23 ILE 36 4.472 -19.219 0.711 295 HD11 ILE 36 HD11 ILE 36 2.132 -15.811 1.596 296 HD12 ILE 36 HD12 ILE 36 2.444 -15.732 3.328 297 HD13 ILE 36 HD13 ILE 36 2.436 -17.291 2.504 298 H GLN 37 H GLN 37 7.250 -17.622 2.576 299 HA GLN 37 HA GLN 37 9.313 -18.624 2.587 300 HB2 GLN 37 HB2 GLN 37 8.439 -19.255 4.957 301 HB3 GLN 37 HB1 GLN 37 8.217 -20.861 4.263 302 HG2 GLN 37 HG2 GLN 37 10.828 -19.390 3.947 303 HG3 GLN 37 HG1 GLN 37 10.483 -20.327 5.396 304 HE21 GLN 37 HE21 GLN 37 12.563 -21.043 3.499 305 HE22 GLN 37 HE22 GLN 37 12.124 -22.529 2.805 306 H GLU 38 H GLU 38 6.623 -20.958 2.347 307 HA GLU 38 HA GLU 38 7.792 -21.960 -0.145 308 HB2 GLU 38 HB2 GLU 38 7.374 -24.321 0.609 309 HB3 GLU 38 HB1 GLU 38 8.694 -23.514 1.448 310 HG2 GLU 38 HG2 GLU 38 6.943 -22.857 3.215 311 HG3 GLU 38 HG1 GLU 38 5.904 -24.062 2.455 312 H GLY 39 H GLY 39 6.274 -22.473 -1.630 313 HA2 GLY 39 HA2 GLY 39 3.572 -23.137 -0.852 314 HA3 GLY 39 HA1 GLY 39 3.724 -21.546 -1.589 315 H LYS 40 H LYS 40 2.209 -23.675 -2.639 316 HA LYS 40 HA LYS 40 3.750 -24.451 -5.034 317 HB2 LYS 40 HB2 LYS 40 1.793 -25.840 -3.364 318 HB3 LYS 40 HB1 LYS 40 1.409 -25.922 -5.084 319 HG2 LYS 40 HG2 LYS 40 3.433 -26.984 -5.618 320 HG3 LYS 40 HG1 LYS 40 4.211 -26.458 -4.125 321 HD2 LYS 40 HD2 LYS 40 3.554 -28.331 -3.066 322 HD3 LYS 40 HD1 LYS 40 1.871 -28.023 -3.494 323 HE2 LYS 40 HE2 LYS 40 2.110 -29.149 -5.600 324 HE3 LYS 40 HE1 LYS 40 3.862 -29.241 -5.419 325 HZ1 LYS 40 HZ1 LYS 40 2.696 -30.390 -3.157 326 HZ2 LYS 40 HZ2 LYS 40 3.612 -31.154 -4.368 327 HZ3 LYS 40 HZ3 LYS 40 1.923 -31.051 -4.514 328 HA PRO 41 HA PRO 41 0.775 -22.076 -7.367 329 HB2 PRO 41 HB2 PRO 41 1.195 -22.992 -9.822 330 HB3 PRO 41 HB1 PRO 41 2.547 -22.304 -8.896 331 HG2 PRO 41 HG2 PRO 41 1.898 -25.148 -9.464 332 HG3 PRO 41 HG1 PRO 41 3.470 -24.348 -9.340 333 HD2 PRO 41 HD2 PRO 41 2.162 -25.828 -7.285 334 HD3 PRO 41 HD1 PRO 41 3.623 -24.829 -7.115 335 H GLY 42 H GLY 42 -1.119 -22.183 -8.819 336 HA2 GLY 42 HA2 GLY 42 -2.458 -24.713 -9.231 337 HA3 GLY 42 HA1 GLY 42 -3.213 -23.705 -7.999 338 H PHE 43 H PHE 43 -4.098 -24.563 -10.749 339 HA PHE 43 HA PHE 43 -4.121 -22.178 -12.363 340 HB2 PHE 43 HB2 PHE 43 -5.927 -23.501 -13.622 341 HB3 PHE 43 HB1 PHE 43 -4.309 -24.199 -13.576 342 HD1 PHE 43 HD1 PHE 43 -3.813 -26.160 -12.208 343 HD2 PHE 43 HD2 PHE 43 -7.752 -24.449 -12.292 344 HE1 PHE 43 HE1 PHE 43 -4.720 -28.196 -11.122 345 HE2 PHE 43 HE2 PHE 43 -8.659 -26.486 -11.205 346 HZ PHE 43 HZ PHE 43 -7.143 -28.359 -10.621 347 H PHE 44 H PHE 44 -5.257 -20.436 -11.821 348 HA PHE 44 HA PHE 44 -7.156 -19.161 -11.379 349 HB2 PHE 44 HB2 PHE 44 -8.275 -21.576 -12.063 350 HB3 PHE 44 HB1 PHE 44 -8.847 -21.360 -10.409 351 HD1 PHE 44 HD1 PHE 44 -10.084 -19.268 -9.780 352 HD2 PHE 44 HD2 PHE 44 -9.089 -20.213 -13.851 353 HE1 PHE 44 HE1 PHE 44 -11.759 -17.619 -10.572 354 HE2 PHE 44 HE2 PHE 44 -10.763 -18.565 -14.643 355 HZ PHE 44 HZ PHE 44 -12.099 -17.267 -13.004 356 H LYS 45 H LYS 45 -5.059 -20.044 -9.514 357 HA LYS 45 HA LYS 45 -5.679 -18.801 -7.195 358 HB2 LYS 45 HB2 LYS 45 -6.202 -20.853 -5.699 359 HB3 LYS 45 HB1 LYS 45 -7.525 -20.130 -6.611 360 HG2 LYS 45 HG2 LYS 45 -7.716 -21.937 -8.010 361 HG3 LYS 45 HG1 LYS 45 -5.980 -22.243 -8.015 362 HD2 LYS 45 HD2 LYS 45 -7.626 -22.733 -5.538 363 HD3 LYS 45 HD1 LYS 45 -7.518 -23.953 -6.807 364 HE2 LYS 45 HE2 LYS 45 -4.954 -23.612 -6.630 365 HE3 LYS 45 HE1 LYS 45 -5.309 -22.831 -5.088 366 HZ1 LYS 45 HZ1 LYS 45 -5.916 -25.614 -5.897 367 HZ2 LYS 45 HZ2 LYS 45 -6.612 -24.883 -4.530 368 HZ3 LYS 45 HZ3 LYS 45 -4.929 -25.092 -4.622 369 H CYS 46 H CYS 46 -4.348 -19.635 -5.267 370 HA CYS 46 HA CYS 46 -2.104 -21.334 -6.089 371 HB2 CYS 46 HB2 CYS 46 -0.984 -19.128 -4.678 372 HB3 CYS 46 HB1 CYS 46 -0.663 -19.640 -6.335 373 H THR 47 H THR 47 -1.491 -22.655 -4.477 374 HA THR 47 HA THR 47 -2.556 -22.105 -1.782 375 HB THR 47 HB THR 47 -1.894 -24.613 -1.489 376 HG1 THR 47 HG1 THR 47 -0.914 -25.180 -3.294 377 HG21 THR 47 HG21 THR 47 -4.103 -25.174 -2.838 378 HG22 THR 47 HG22 THR 47 -4.224 -23.417 -2.933 379 HG23 THR 47 HG23 THR 47 -4.166 -24.214 -1.359 380 H CYS 48 H CYS 48 -1.190 -21.435 -0.285 381 HA CYS 48 HA CYS 48 1.636 -22.251 -0.497 382 HB2 CYS 48 HB2 CYS 48 0.920 -19.557 0.578 383 HB3 CYS 48 HB1 CYS 48 2.415 -20.098 -0.190 384 H TYR 49 H TYR 49 2.832 -22.013 1.551 385 HA TYR 49 HA TYR 49 1.097 -22.281 3.930 386 HB2 TYR 49 HB2 TYR 49 3.549 -23.968 3.686 387 HB3 TYR 49 HB1 TYR 49 2.059 -24.279 4.570 388 HD1 TYR 49 HD1 TYR 49 3.904 -25.232 1.767 389 HD2 TYR 49 HD2 TYR 49 -0.124 -24.326 2.954 390 HE1 TYR 49 HE1 TYR 49 3.043 -26.537 -0.158 391 HE2 TYR 49 HE2 TYR 49 -0.985 -25.632 1.029 392 HH TYR 49 HH TYR 49 -0.361 -26.539 -1.002 393 H PHE 50 H PHE 50 2.057 -21.629 5.905 394 HA PHE 50 HA PHE 50 4.402 -19.882 5.542 395 HB2 PHE 50 HB2 PHE 50 2.680 -18.603 6.495 396 HB3 PHE 50 HB1 PHE 50 2.140 -19.921 7.524 397 HD1 PHE 50 HD1 PHE 50 2.276 -18.768 9.633 398 HD2 PHE 50 HD2 PHE 50 5.692 -18.973 7.035 399 HE1 PHE 50 HE1 PHE 50 3.721 -17.933 11.465 400 HE2 PHE 50 HE2 PHE 50 7.134 -18.140 8.868 401 HZ PHE 50 HZ PHE 50 6.151 -17.619 11.083 402 H THR 51 H THR 51 6.158 -21.190 5.801 403 HA THR 51 HA THR 51 6.656 -23.419 7.164 404 HB THR 51 HB THR 51 8.819 -22.028 8.063 405 HG1 THR 51 HG1 THR 51 7.591 -20.153 7.087 406 HG21 THR 51 HG21 THR 51 8.177 -23.038 5.284 407 HG22 THR 51 HG22 THR 51 8.988 -23.913 6.583 408 HG23 THR 51 HG23 THR 51 9.798 -22.561 5.790 409 H THR 52 H THR 52 5.338 -23.854 8.913 410 HA THR 52 HA THR 52 6.053 -22.437 11.400 411 HB THR 52 HB THR 52 3.512 -22.980 11.968 412 HG1 THR 52 HG1 THR 52 2.357 -23.356 10.274 413 HG21 THR 52 HG21 THR 52 3.042 -20.630 10.853 414 HG22 THR 52 HG22 THR 52 4.784 -20.653 10.579 415 HG23 THR 52 HG23 THR 52 4.148 -20.764 12.219 416 H GLY 53 H GLY 53 6.949 -23.876 12.719 417 HA2 GLY 53 HA2 GLY 53 7.186 -25.770 14.020 418 HA3 GLY 53 HA1 GLY 53 5.621 -26.317 13.425 Start of MODEL 12 1 H1 GLU 1 H1 GLU 1 -0.557 -29.898 12.541 2 H2 GLU 1 H2 GLU 1 0.935 -29.180 12.160 3 H3 GLU 1 H3 GLU 1 0.333 -30.452 11.208 4 HA GLU 1 HA GLU 1 -0.828 -29.084 9.934 5 HB2 GLU 1 HB2 GLU 1 -2.077 -27.140 11.417 6 HB3 GLU 1 HB1 GLU 1 -2.757 -28.733 11.083 7 HG2 GLU 1 HG2 GLU 1 -0.894 -28.412 13.410 8 HG3 GLU 1 HG1 GLU 1 -2.562 -27.867 13.571 9 H VAL 2 H VAL 2 1.011 -28.196 9.000 10 HA VAL 2 HA VAL 2 2.395 -25.970 10.222 11 HB VAL 2 HB VAL 2 3.454 -25.926 7.830 12 HG11 VAL 2 HG11 VAL 2 4.524 -28.318 8.616 13 HG12 VAL 2 HG12 VAL 2 3.776 -27.771 10.116 14 HG13 VAL 2 HG13 VAL 2 4.973 -26.759 9.308 15 HG21 VAL 2 HG21 VAL 2 1.444 -27.515 7.135 16 HG22 VAL 2 HG22 VAL 2 2.511 -28.771 7.761 17 HG23 VAL 2 HG23 VAL 2 3.047 -27.740 6.434 18 H ILE 3 H ILE 3 -0.415 -25.543 9.818 19 HA ILE 3 HA ILE 3 -1.863 -23.929 9.044 20 HB ILE 3 HB ILE 3 0.613 -22.410 8.250 21 HG12 ILE 3 HG12 ILE 3 -0.538 -23.022 10.961 22 HG13 ILE 3 HG11 ILE 3 1.151 -23.026 10.451 23 HG21 ILE 3 HG21 ILE 3 -0.730 -20.459 8.713 24 HG22 ILE 3 HG22 ILE 3 -2.026 -21.454 9.380 25 HG23 ILE 3 HG23 ILE 3 -1.667 -21.515 7.654 26 HD11 ILE 3 HD11 ILE 3 1.153 -21.005 11.540 27 HD12 ILE 3 HD12 ILE 3 -0.572 -20.745 11.281 28 HD13 ILE 3 HD13 ILE 3 0.572 -20.440 9.975 29 H LYS 4 H LYS 4 -2.932 -23.366 7.154 30 HA LYS 4 HA LYS 4 -1.583 -24.091 4.621 31 HB2 LYS 4 HB2 LYS 4 -4.490 -24.423 4.624 32 HB3 LYS 4 HB1 LYS 4 -3.231 -25.522 4.059 33 HG2 LYS 4 HG2 LYS 4 -4.302 -26.619 5.900 34 HG3 LYS 4 HG1 LYS 4 -2.750 -26.036 6.504 35 HD2 LYS 4 HD2 LYS 4 -3.767 -24.732 8.033 36 HD3 LYS 4 HD1 LYS 4 -4.769 -23.982 6.790 37 HE2 LYS 4 HE2 LYS 4 -5.326 -26.592 8.226 38 HE3 LYS 4 HE1 LYS 4 -6.224 -25.083 8.397 39 HZ1 LYS 4 HZ1 LYS 4 -6.109 -26.909 6.082 40 HZ2 LYS 4 HZ2 LYS 4 -6.569 -25.285 5.890 41 HZ3 LYS 4 HZ3 LYS 4 -7.472 -26.313 6.897 42 H LYS 5 H LYS 5 -1.655 -22.591 3.067 43 HA LYS 5 HA LYS 5 -3.561 -20.349 3.389 44 HB2 LYS 5 HB2 LYS 5 -0.768 -20.241 3.424 45 HB3 LYS 5 HB1 LYS 5 -1.214 -19.699 1.806 46 HG2 LYS 5 HG2 LYS 5 -2.555 -18.628 4.296 47 HG3 LYS 5 HG1 LYS 5 -1.116 -17.881 3.600 48 HD2 LYS 5 HD2 LYS 5 -2.238 -17.331 1.588 49 HD3 LYS 5 HD1 LYS 5 -3.566 -18.440 1.926 50 HE2 LYS 5 HE2 LYS 5 -4.401 -16.247 2.394 51 HE3 LYS 5 HE1 LYS 5 -4.086 -16.992 3.961 52 HZ1 LYS 5 HZ1 LYS 5 -2.016 -15.834 4.112 53 HZ2 LYS 5 HZ2 LYS 5 -3.231 -14.699 3.763 54 HZ3 LYS 5 HZ3 LYS 5 -2.175 -15.220 2.538 55 H ASP 6 H ASP 6 -4.866 -19.935 1.710 56 HA ASP 6 HA ASP 6 -4.155 -20.980 -0.946 57 HB2 ASP 6 HB2 ASP 6 -7.001 -21.169 -0.102 58 HB3 ASP 6 HB1 ASP 6 -6.086 -22.188 -1.212 59 H THR 7 H THR 7 -4.203 -19.383 -2.374 60 HA THR 7 HA THR 7 -6.056 -17.135 -1.906 61 HB THR 7 HB THR 7 -4.495 -15.673 -2.906 62 HG1 THR 7 HG1 THR 7 -2.767 -17.742 -3.641 63 HG21 THR 7 HG21 THR 7 -3.815 -16.530 -0.655 64 HG22 THR 7 HG22 THR 7 -2.448 -16.017 -1.645 65 HG23 THR 7 HG23 THR 7 -2.809 -17.733 -1.460 66 HA PRO 8 HA PRO 8 -7.670 -18.134 -5.944 67 HB2 PRO 8 HB2 PRO 8 -9.035 -15.903 -6.510 68 HB3 PRO 8 HB1 PRO 8 -9.420 -16.848 -5.058 69 HG2 PRO 8 HG2 PRO 8 -8.002 -14.264 -5.304 70 HG3 PRO 8 HG1 PRO 8 -8.996 -14.888 -3.979 71 HD2 PRO 8 HD2 PRO 8 -6.126 -14.931 -4.171 72 HD3 PRO 8 HD1 PRO 8 -7.141 -15.619 -2.885 73 H TYR 9 H TYR 9 -7.650 -17.633 -8.241 74 HA TYR 9 HA TYR 9 -6.331 -15.464 -9.435 75 HB2 TYR 9 HB2 TYR 9 -4.330 -16.434 -8.313 76 HB3 TYR 9 HB1 TYR 9 -4.591 -17.930 -9.211 77 HD1 TYR 9 HD1 TYR 9 -4.053 -18.102 -11.550 78 HD2 TYR 9 HD2 TYR 9 -3.757 -14.333 -9.513 79 HE1 TYR 9 HE1 TYR 9 -2.834 -17.150 -13.489 80 HE2 TYR 9 HE2 TYR 9 -2.540 -13.379 -11.451 81 HH TYR 9 HH TYR 9 -1.112 -15.165 -13.780 82 H LYS 10 H LYS 10 -8.311 -15.919 -10.642 83 HA LYS 10 HA LYS 10 -8.520 -18.340 -12.181 84 HB2 LYS 10 HB2 LYS 10 -10.392 -16.672 -11.379 85 HB3 LYS 10 HB1 LYS 10 -10.018 -15.853 -12.897 86 HG2 LYS 10 HG2 LYS 10 -10.130 -18.426 -13.758 87 HG3 LYS 10 HG1 LYS 10 -11.302 -18.485 -12.439 88 HD2 LYS 10 HD2 LYS 10 -12.159 -16.232 -13.531 89 HD3 LYS 10 HD1 LYS 10 -11.376 -16.885 -14.971 90 HE2 LYS 10 HE2 LYS 10 -12.706 -18.904 -14.858 91 HE3 LYS 10 HE1 LYS 10 -13.383 -18.424 -13.301 92 HZ1 LYS 10 HZ1 LYS 10 -14.766 -17.996 -15.380 93 HZ2 LYS 10 HZ2 LYS 10 -13.685 -16.725 -15.698 94 HZ3 LYS 10 HZ3 LYS 10 -14.607 -16.723 -14.271 95 H LYS 11 H LYS 11 -6.550 -18.429 -13.311 96 HA LYS 11 HA LYS 11 -4.913 -17.599 -14.826 97 HB2 LYS 11 HB2 LYS 11 -6.354 -19.334 -15.867 98 HB3 LYS 11 HB1 LYS 11 -7.399 -18.057 -16.489 99 HG2 LYS 11 HG2 LYS 11 -6.043 -17.992 -18.291 100 HG3 LYS 11 HG1 LYS 11 -4.838 -17.249 -17.238 101 HD2 LYS 11 HD2 LYS 11 -3.666 -19.088 -18.079 102 HD3 LYS 11 HD1 LYS 11 -4.299 -19.725 -16.561 103 HE2 LYS 11 HE2 LYS 11 -5.145 -21.399 -17.837 104 HE3 LYS 11 HE1 LYS 11 -6.375 -20.222 -18.298 105 HZ1 LYS 11 HZ1 LYS 11 -4.722 -19.517 -20.074 106 HZ2 LYS 11 HZ2 LYS 11 -5.517 -21.002 -20.302 107 HZ3 LYS 11 HZ3 LYS 11 -3.911 -20.971 -19.749 108 H ARG 12 H ARG 12 -4.586 -15.393 -14.267 109 HA ARG 12 HA ARG 12 -6.197 -13.233 -14.959 110 HB2 ARG 12 HB2 ARG 12 -3.962 -13.346 -13.598 111 HB3 ARG 12 HB1 ARG 12 -3.211 -13.019 -15.161 112 HG2 ARG 12 HG2 ARG 12 -5.328 -11.214 -15.059 113 HG3 ARG 12 HG1 ARG 12 -4.700 -11.215 -13.411 114 HD2 ARG 12 HD2 ARG 12 -2.471 -10.699 -14.188 115 HD3 ARG 12 HD1 ARG 12 -2.957 -10.909 -15.868 116 HE ARG 12 HE ARG 12 -3.813 -8.754 -15.823 117 HH11 ARG 12 HH11 ARG 12 -4.322 -6.781 -14.820 118 HH12 ARG 12 HH12 ARG 12 -4.294 -6.663 -13.092 119 HH21 ARG 12 HH21 ARG 12 -3.366 -9.970 -12.616 120 HH22 ARG 12 HH22 ARG 12 -3.752 -8.468 -11.843 121 H LYS 13 H LYS 13 -3.406 -14.504 -16.789 122 HA LYS 13 HA LYS 13 -4.757 -13.762 -19.287 123 HB2 LYS 13 HB2 LYS 13 -3.310 -11.846 -18.695 124 HB3 LYS 13 HB1 LYS 13 -1.923 -12.931 -18.615 125 HG2 LYS 13 HG2 LYS 13 -1.630 -12.610 -20.825 126 HG3 LYS 13 HG1 LYS 13 -3.150 -13.464 -21.095 127 HD2 LYS 13 HD2 LYS 13 -3.482 -11.378 -22.154 128 HD3 LYS 13 HD1 LYS 13 -4.285 -11.193 -20.595 129 HE2 LYS 13 HE2 LYS 13 -1.999 -10.284 -19.768 130 HE3 LYS 13 HE1 LYS 13 -1.624 -10.089 -21.480 131 HZ1 LYS 13 HZ1 LYS 13 -4.156 -9.076 -21.171 132 HZ2 LYS 13 HZ2 LYS 13 -2.725 -8.184 -21.379 133 HZ3 LYS 13 HZ3 LYS 13 -3.306 -8.510 -19.817 134 H PHE 14 H PHE 14 -1.356 -14.483 -19.062 135 HA PHE 14 HA PHE 14 -1.861 -17.065 -20.389 136 HB2 PHE 14 HB2 PHE 14 -0.041 -14.975 -20.916 137 HB3 PHE 14 HB1 PHE 14 0.927 -16.309 -20.285 138 HD1 PHE 14 HD1 PHE 14 0.561 -18.645 -21.301 139 HD2 PHE 14 HD2 PHE 14 -0.854 -15.026 -23.130 140 HE1 PHE 14 HE1 PHE 14 0.363 -19.822 -23.475 141 HE2 PHE 14 HE2 PHE 14 -1.053 -16.202 -25.303 142 HZ PHE 14 HZ PHE 14 -0.444 -18.600 -25.476 143 HA PRO 15 HA PRO 15 1.362 -17.916 -16.795 144 HB2 PRO 15 HB2 PRO 15 0.529 -15.777 -14.914 145 HB3 PRO 15 HB1 PRO 15 2.157 -16.340 -15.331 146 HG2 PRO 15 HG2 PRO 15 1.209 -13.993 -16.188 147 HG3 PRO 15 HG1 PRO 15 2.303 -14.982 -17.168 148 HD2 PRO 15 HD2 PRO 15 -0.650 -14.592 -17.458 149 HD3 PRO 15 HD1 PRO 15 0.588 -14.817 -18.713 150 H TYR 16 H TYR 16 0.879 -19.244 -15.003 151 HA TYR 16 HA TYR 16 -1.747 -19.082 -13.758 152 HB2 TYR 16 HB2 TYR 16 -2.011 -21.627 -14.318 153 HB3 TYR 16 HB1 TYR 16 -2.507 -20.419 -15.503 154 HD1 TYR 16 HD1 TYR 16 0.394 -22.549 -14.488 155 HD2 TYR 16 HD2 TYR 16 -1.545 -20.383 -17.651 156 HE1 TYR 16 HE1 TYR 16 2.015 -23.480 -16.119 157 HE2 TYR 16 HE2 TYR 16 0.075 -21.315 -19.281 158 HH TYR 16 HH TYR 16 2.911 -23.012 -18.287 159 H LYS 17 H LYS 17 0.718 -18.669 -12.609 160 HA LYS 17 HA LYS 17 0.687 -20.547 -10.475 161 HB2 LYS 17 HB2 LYS 17 3.156 -21.261 -10.936 162 HB3 LYS 17 HB1 LYS 17 1.849 -22.111 -11.763 163 HG2 LYS 17 HG2 LYS 17 2.446 -21.300 -13.800 164 HG3 LYS 17 HG1 LYS 17 2.790 -19.692 -13.162 165 HD2 LYS 17 HD2 LYS 17 4.988 -20.206 -12.661 166 HD3 LYS 17 HD1 LYS 17 4.645 -21.920 -12.425 167 HE2 LYS 17 HE2 LYS 17 4.313 -20.721 -15.157 168 HE3 LYS 17 HE1 LYS 17 5.930 -21.128 -14.586 169 HZ1 LYS 17 HZ1 LYS 17 5.365 -23.362 -14.356 170 HZ2 LYS 17 HZ2 LYS 17 4.648 -22.911 -15.828 171 HZ3 LYS 17 HZ3 LYS 17 3.699 -23.058 -14.427 172 H SER 18 H SER 18 3.722 -19.299 -11.653 173 HA SER 18 HA SER 18 4.556 -18.022 -9.397 174 HB2 SER 18 HB2 SER 18 5.700 -18.336 -11.738 175 HB3 SER 18 HB1 SER 18 5.102 -16.704 -12.030 176 HG SER 18 HG SER 18 6.895 -17.639 -10.058 177 H GLU 19 H GLU 19 2.027 -16.983 -11.502 178 HA GLU 19 HA GLU 19 2.104 -14.231 -10.537 179 HB2 GLU 19 HB2 GLU 19 0.484 -15.721 -12.572 180 HB3 GLU 19 HB1 GLU 19 -0.100 -14.179 -11.945 181 HG2 GLU 19 HG2 GLU 19 2.632 -14.636 -13.181 182 HG3 GLU 19 HG1 GLU 19 1.263 -13.882 -13.997 183 H CYS 20 H CYS 20 0.433 -17.212 -9.882 184 HA CYS 20 HA CYS 20 -1.665 -15.907 -8.340 185 HB2 CYS 20 HB2 CYS 20 -2.165 -17.966 -9.599 186 HB3 CYS 20 HB1 CYS 20 -0.979 -18.841 -8.632 187 H LEU 21 H LEU 21 1.162 -17.973 -7.728 188 HA LEU 21 HA LEU 21 0.902 -18.077 -4.923 189 HB2 LEU 21 HB2 LEU 21 2.417 -19.501 -6.385 190 HB3 LEU 21 HB1 LEU 21 3.514 -18.121 -6.437 191 HG LEU 21 HG LEU 21 2.533 -18.940 -3.749 192 HD11 LEU 21 HD11 LEU 21 3.029 -21.130 -4.345 193 HD12 LEU 21 HD12 LEU 21 4.615 -20.571 -3.815 194 HD13 LEU 21 HD13 LEU 21 4.234 -20.641 -5.536 195 HD21 LEU 21 HD21 LEU 21 4.960 -18.434 -3.244 196 HD22 LEU 21 HD22 LEU 21 4.063 -17.078 -3.929 197 HD23 LEU 21 HD23 LEU 21 5.160 -18.013 -4.943 198 H LYS 22 H LYS 22 2.490 -15.769 -7.078 199 HA LYS 22 HA LYS 22 3.907 -14.247 -5.234 200 HB2 LYS 22 HB2 LYS 22 3.971 -13.928 -7.707 201 HB3 LYS 22 HB1 LYS 22 2.373 -13.187 -7.620 202 HG2 LYS 22 HG2 LYS 22 3.554 -11.690 -5.762 203 HG3 LYS 22 HG1 LYS 22 5.004 -12.137 -6.661 204 HD2 LYS 22 HD2 LYS 22 3.520 -11.472 -8.752 205 HD3 LYS 22 HD1 LYS 22 2.649 -10.517 -7.551 206 HE2 LYS 22 HE2 LYS 22 4.306 -9.032 -8.316 207 HE3 LYS 22 HE1 LYS 22 5.002 -9.683 -6.831 208 HZ1 LYS 22 HZ1 LYS 22 6.190 -11.324 -8.178 209 HZ2 LYS 22 HZ2 LYS 22 6.617 -9.735 -8.600 210 HZ3 LYS 22 HZ3 LYS 22 5.562 -10.626 -9.592 211 H ALA 23 H ALA 23 0.556 -13.758 -6.356 212 HA ALA 23 HA ALA 23 -0.193 -11.590 -4.857 213 HB1 ALA 23 HB1 ALA 23 -1.993 -12.236 -6.085 214 HB2 ALA 23 HB2 ALA 23 -2.427 -13.134 -4.630 215 HB3 ALA 23 HB3 ALA 23 -1.592 -13.948 -5.954 216 H CYS 24 H CYS 24 0.265 -14.906 -3.800 217 HA CYS 24 HA CYS 24 -0.848 -14.568 -1.190 218 HB2 CYS 24 HB2 CYS 24 -0.283 -16.748 -2.563 219 HB3 CYS 24 HB1 CYS 24 1.278 -16.595 -1.758 220 H ALA 25 H ALA 25 2.357 -14.169 -2.588 221 HA ALA 25 HA ALA 25 3.661 -13.784 -0.037 222 HB1 ALA 25 HB1 ALA 25 4.825 -12.903 -2.658 223 HB2 ALA 25 HB2 ALA 25 4.674 -14.623 -2.300 224 HB3 ALA 25 HB3 ALA 25 5.639 -13.586 -1.250 225 H THR 26 H THR 26 1.877 -11.853 -2.234 226 HA THR 26 HA THR 26 3.033 -9.345 -1.254 227 HB THR 26 HB THR 26 0.752 -9.651 -3.206 228 HG1 THR 26 HG1 THR 26 2.215 -9.896 -4.786 229 HG21 THR 26 HG21 THR 26 1.660 -7.478 -4.017 230 HG22 THR 26 HG22 THR 26 2.847 -7.517 -2.712 231 HG23 THR 26 HG23 THR 26 1.127 -7.402 -2.337 232 H SER 27 H SER 27 0.385 -11.449 -0.684 233 HA SER 27 HA SER 27 -1.705 -9.898 0.126 234 HB2 SER 27 HB2 SER 27 -0.550 -12.390 1.365 235 HB3 SER 27 HB1 SER 27 -2.026 -11.646 1.975 236 HG SER 27 HG SER 27 -2.207 -11.758 -0.661 237 H PHE 28 H PHE 28 1.454 -9.886 1.433 238 HA PHE 28 HA PHE 28 0.551 -8.078 3.582 239 HB2 PHE 28 HB2 PHE 28 1.498 -10.612 4.077 240 HB3 PHE 28 HB1 PHE 28 2.957 -9.631 4.220 241 HD1 PHE 28 HD1 PHE 28 3.418 -8.745 6.318 242 HD2 PHE 28 HD2 PHE 28 -0.670 -9.419 5.184 243 HE1 PHE 28 HE1 PHE 28 2.670 -7.951 8.545 244 HE2 PHE 28 HE2 PHE 28 -1.417 -8.625 7.412 245 HZ PHE 28 HZ PHE 28 0.251 -7.890 9.092 246 H THR 29 H THR 29 2.441 -6.789 4.462 247 HA THR 29 HA THR 29 3.501 -5.027 2.772 248 HB THR 29 HB THR 29 5.536 -4.896 4.281 249 HG1 THR 29 HG1 THR 29 5.928 -6.584 5.433 250 HG21 THR 29 HG21 THR 29 3.765 -4.782 6.384 251 HG22 THR 29 HG22 THR 29 2.695 -4.648 4.989 252 HG23 THR 29 HG23 THR 29 4.012 -3.495 5.204 253 H GLY 30 H GLY 30 5.979 -7.267 3.861 254 HA2 GLY 30 HA2 GLY 30 6.755 -7.693 1.033 255 HA3 GLY 30 HA1 GLY 30 7.928 -7.435 2.321 256 H GLY 31 H GLY 31 5.217 -9.272 3.256 257 HA2 GLY 31 HA2 GLY 31 4.840 -11.557 3.473 258 HA3 GLY 31 HA1 GLY 31 6.260 -11.857 2.476 259 H ASP 32 H ASP 32 8.171 -10.421 3.952 260 HA ASP 32 HA ASP 32 9.757 -11.067 5.531 261 HB2 ASP 32 HB2 ASP 32 7.270 -10.358 7.086 262 HB3 ASP 32 HB1 ASP 32 8.812 -10.687 7.874 263 H GLU 33 H GLU 33 8.692 -13.353 4.364 264 HA GLU 33 HA GLU 33 8.451 -15.617 4.686 265 HB2 GLU 33 HB2 GLU 33 9.927 -14.855 7.214 266 HB3 GLU 33 HB1 GLU 33 9.600 -16.523 6.745 267 HG2 GLU 33 HG2 GLU 33 10.988 -16.405 4.863 268 HG3 GLU 33 HG1 GLU 33 10.911 -14.644 4.797 269 H SER 34 H SER 34 8.286 -15.029 8.144 270 HA SER 34 HA SER 34 6.187 -16.557 8.810 271 HB2 SER 34 HB2 SER 34 5.566 -14.402 10.353 272 HB3 SER 34 HB1 SER 34 6.882 -15.517 10.707 273 HG SER 34 HG SER 34 7.830 -13.826 8.958 274 H ARG 35 H ARG 35 4.586 -16.828 7.368 275 HA ARG 35 HA ARG 35 2.200 -15.676 7.378 276 HB2 ARG 35 HB2 ARG 35 4.090 -13.848 5.987 277 HB3 ARG 35 HB1 ARG 35 2.542 -14.124 5.195 278 HG2 ARG 35 HG2 ARG 35 1.329 -13.139 6.891 279 HG3 ARG 35 HG1 ARG 35 2.509 -13.564 8.129 280 HD2 ARG 35 HD2 ARG 35 4.072 -11.876 7.178 281 HD3 ARG 35 HD1 ARG 35 2.837 -11.422 6.008 282 HE ARG 35 HE ARG 35 1.745 -10.252 7.692 283 HH11 ARG 35 HH11 ARG 35 1.556 -9.454 9.808 284 HH12 ARG 35 HH12 ARG 35 2.515 -10.142 11.076 285 HH21 ARG 35 HH21 ARG 35 4.086 -12.436 9.005 286 HH22 ARG 35 HH22 ARG 35 3.947 -11.831 10.622 287 H ILE 36 H ILE 36 4.788 -16.349 5.093 288 HA ILE 36 HA ILE 36 3.103 -18.375 3.798 289 HB ILE 36 HB ILE 36 4.898 -16.717 2.080 290 HG12 ILE 36 HG12 ILE 36 3.540 -15.068 3.353 291 HG13 ILE 36 HG11 ILE 36 3.089 -15.113 1.650 292 HG21 ILE 36 HG21 ILE 36 2.186 -17.599 1.251 293 HG22 ILE 36 HG22 ILE 36 3.337 -18.883 1.618 294 HG23 ILE 36 HG23 ILE 36 3.717 -17.684 0.382 295 HD11 ILE 36 HD11 ILE 36 1.536 -17.054 3.123 296 HD12 ILE 36 HD12 ILE 36 0.977 -15.677 2.177 297 HD13 ILE 36 HD13 ILE 36 1.388 -15.466 3.877 298 H GLN 37 H GLN 37 6.375 -16.925 3.743 299 HA GLN 37 HA GLN 37 8.453 -17.912 3.789 300 HB2 GLN 37 HB2 GLN 37 7.258 -20.468 4.791 301 HB3 GLN 37 HB1 GLN 37 8.757 -19.668 5.269 302 HG2 GLN 37 HG2 GLN 37 7.006 -17.767 6.019 303 HG3 GLN 37 HG1 GLN 37 5.970 -19.183 6.196 304 HE21 GLN 37 HE21 GLN 37 6.076 -20.048 8.265 305 HE22 GLN 37 HE22 GLN 37 7.448 -20.023 9.264 306 H GLU 38 H GLU 38 6.096 -20.486 2.952 307 HA GLU 38 HA GLU 38 7.367 -20.771 0.336 308 HB2 GLU 38 HB2 GLU 38 8.530 -22.353 1.875 309 HB3 GLU 38 HB1 GLU 38 6.982 -23.132 2.188 310 HG2 GLU 38 HG2 GLU 38 6.780 -23.421 -0.344 311 HG3 GLU 38 HG1 GLU 38 8.481 -22.965 -0.432 312 H GLY 39 H GLY 39 6.015 -21.653 -1.218 313 HA2 GLY 39 HA2 GLY 39 3.409 -22.698 -0.487 314 HA3 GLY 39 HA1 GLY 39 3.371 -21.121 -1.271 315 H LYS 40 H LYS 40 2.135 -23.305 -2.432 316 HA LYS 40 HA LYS 40 3.932 -23.952 -4.682 317 HB2 LYS 40 HB2 LYS 40 1.682 -25.509 -3.421 318 HB3 LYS 40 HB1 LYS 40 2.263 -25.872 -5.046 319 HG2 LYS 40 HG2 LYS 40 4.333 -25.576 -2.930 320 HG3 LYS 40 HG1 LYS 40 3.316 -27.015 -2.844 321 HD2 LYS 40 HD2 LYS 40 4.161 -27.897 -4.784 322 HD3 LYS 40 HD1 LYS 40 4.380 -26.313 -5.529 323 HE2 LYS 40 HE2 LYS 40 6.500 -27.658 -4.820 324 HE3 LYS 40 HE1 LYS 40 6.423 -25.937 -4.436 325 HZ1 LYS 40 HZ1 LYS 40 5.757 -26.427 -2.225 326 HZ2 LYS 40 HZ2 LYS 40 7.119 -27.385 -2.558 327 HZ3 LYS 40 HZ3 LYS 40 5.567 -28.076 -2.569 328 HA PRO 41 HA PRO 41 0.791 -21.881 -7.098 329 HB2 PRO 41 HB2 PRO 41 1.731 -22.281 -9.541 330 HB3 PRO 41 HB1 PRO 41 2.746 -21.448 -8.344 331 HG2 PRO 41 HG2 PRO 41 2.883 -24.264 -9.304 332 HG3 PRO 41 HG1 PRO 41 4.190 -23.138 -8.913 333 HD2 PRO 41 HD2 PRO 41 3.153 -25.130 -7.187 334 HD3 PRO 41 HD1 PRO 41 4.227 -23.789 -6.730 335 H GLY 42 H GLY 42 -0.821 -22.245 -8.803 336 HA2 GLY 42 HA2 GLY 42 -1.375 -24.951 -9.678 337 HA3 GLY 42 HA1 GLY 42 -2.524 -24.323 -8.499 338 H PHE 43 H PHE 43 -3.348 -25.031 -11.045 339 HA PHE 43 HA PHE 43 -3.454 -22.703 -12.753 340 HB2 PHE 43 HB2 PHE 43 -5.443 -24.457 -13.592 341 HB3 PHE 43 HB1 PHE 43 -3.790 -24.387 -14.205 342 HD1 PHE 43 HD1 PHE 43 -5.959 -25.970 -11.621 343 HD2 PHE 43 HD2 PHE 43 -2.232 -26.121 -13.751 344 HE1 PHE 43 HE1 PHE 43 -5.507 -28.216 -10.673 345 HE2 PHE 43 HE2 PHE 43 -1.782 -28.368 -12.803 346 HZ PHE 43 HZ PHE 43 -3.419 -29.415 -11.263 347 H PHE 44 H PHE 44 -5.009 -21.183 -12.856 348 HA PHE 44 HA PHE 44 -6.887 -19.966 -12.330 349 HB2 PHE 44 HB2 PHE 44 -8.247 -22.409 -11.260 350 HB3 PHE 44 HB1 PHE 44 -8.915 -21.080 -12.208 351 HD1 PHE 44 HD1 PHE 44 -7.215 -20.829 -14.504 352 HD2 PHE 44 HD2 PHE 44 -8.448 -24.400 -12.462 353 HE1 PHE 44 HE1 PHE 44 -6.872 -22.136 -16.585 354 HE2 PHE 44 HE2 PHE 44 -8.104 -25.708 -14.542 355 HZ PHE 44 HZ PHE 44 -7.317 -24.575 -16.603 356 H LYS 45 H LYS 45 -4.919 -21.394 -10.178 357 HA LYS 45 HA LYS 45 -5.446 -19.666 -8.058 358 HB2 LYS 45 HB2 LYS 45 -6.384 -21.385 -6.423 359 HB3 LYS 45 HB1 LYS 45 -7.515 -20.750 -7.619 360 HG2 LYS 45 HG2 LYS 45 -7.300 -22.715 -8.987 361 HG3 LYS 45 HG1 LYS 45 -5.948 -23.309 -8.023 362 HD2 LYS 45 HD2 LYS 45 -8.357 -22.761 -6.435 363 HD3 LYS 45 HD1 LYS 45 -8.590 -24.017 -7.652 364 HE2 LYS 45 HE2 LYS 45 -6.153 -24.041 -5.882 365 HE3 LYS 45 HE1 LYS 45 -7.680 -24.714 -5.311 366 HZ1 LYS 45 HZ1 LYS 45 -6.496 -26.470 -6.316 367 HZ2 LYS 45 HZ2 LYS 45 -6.106 -25.539 -7.683 368 HZ3 LYS 45 HZ3 LYS 45 -7.708 -26.039 -7.421 369 H CYS 46 H CYS 46 -4.392 -20.494 -5.956 370 HA CYS 46 HA CYS 46 -2.365 -22.555 -6.368 371 HB2 CYS 46 HB2 CYS 46 -0.553 -20.950 -5.628 372 HB3 CYS 46 HB1 CYS 46 -1.165 -20.688 -7.262 373 H THR 47 H THR 47 -1.147 -22.995 -4.357 374 HA THR 47 HA THR 47 -2.661 -22.149 -1.966 375 HB THR 47 HB THR 47 -2.054 -24.504 -1.091 376 HG1 THR 47 HG1 THR 47 -1.063 -24.583 -3.549 377 HG21 THR 47 HG21 THR 47 -4.309 -24.390 -1.306 378 HG22 THR 47 HG22 THR 47 -4.049 -25.330 -2.776 379 HG23 THR 47 HG23 THR 47 -4.213 -23.577 -2.868 380 H CYS 48 H CYS 48 -1.479 -21.272 -0.421 381 HA CYS 48 HA CYS 48 1.439 -21.749 -0.432 382 HB2 CYS 48 HB2 CYS 48 0.923 -19.439 1.067 383 HB3 CYS 48 HB1 CYS 48 1.612 -19.514 -0.554 384 H TYR 49 H TYR 49 2.492 -21.913 1.634 385 HA TYR 49 HA TYR 49 0.665 -22.456 3.897 386 HB2 TYR 49 HB2 TYR 49 3.065 -24.131 3.111 387 HB3 TYR 49 HB1 TYR 49 2.035 -24.392 4.518 388 HD1 TYR 49 HD1 TYR 49 0.163 -25.787 4.342 389 HD2 TYR 49 HD2 TYR 49 1.855 -24.065 0.788 390 HE1 TYR 49 HE1 TYR 49 -1.398 -27.120 2.950 391 HE2 TYR 49 HE2 TYR 49 0.292 -25.398 -0.602 392 HH TYR 49 HH TYR 49 -1.427 -28.010 0.556 393 H PHE 50 H PHE 50 1.764 -22.317 6.009 394 HA PHE 50 HA PHE 50 3.875 -20.263 5.922 395 HB2 PHE 50 HB2 PHE 50 2.344 -21.176 8.359 396 HB3 PHE 50 HB1 PHE 50 3.300 -19.718 8.176 397 HD1 PHE 50 HD1 PHE 50 2.106 -17.774 7.987 398 HD2 PHE 50 HD2 PHE 50 0.433 -21.368 6.332 399 HE1 PHE 50 HE1 PHE 50 0.094 -16.514 7.278 400 HE2 PHE 50 HE2 PHE 50 -1.570 -20.105 5.615 401 HZ PHE 50 HZ PHE 50 -1.743 -17.678 6.093 402 H THR 51 H THR 51 5.793 -21.336 5.721 403 HA THR 51 HA THR 51 6.446 -23.847 6.740 404 HB THR 51 HB THR 51 8.323 -21.496 6.407 405 HG1 THR 51 HG1 THR 51 8.522 -23.078 4.388 406 HG21 THR 51 HG21 THR 51 9.883 -23.492 5.844 407 HG22 THR 51 HG22 THR 51 8.683 -24.471 6.688 408 HG23 THR 51 HG23 THR 51 9.519 -23.172 7.540 409 H THR 52 H THR 52 5.221 -23.564 8.846 410 HA THR 52 HA THR 52 6.928 -22.328 10.914 411 HB THR 52 HB THR 52 4.438 -23.111 12.007 412 HG1 THR 52 HG1 THR 52 3.017 -22.088 10.613 413 HG21 THR 52 HG21 THR 52 4.225 -20.774 12.476 414 HG22 THR 52 HG22 THR 52 5.257 -20.341 11.114 415 HG23 THR 52 HG23 THR 52 5.951 -21.130 12.530 416 H GLY 53 H GLY 53 6.997 -25.062 9.540 417 HA2 GLY 53 HA2 GLY 53 6.286 -27.106 11.304 418 HA3 GLY 53 HA1 GLY 53 7.601 -27.202 10.137 Start of MODEL 13 1 H1 GLU 1 H1 GLU 1 -2.695 -29.139 10.348 2 H2 GLU 1 H2 GLU 1 -1.732 -28.377 11.523 3 H3 GLU 1 H3 GLU 1 -1.799 -30.073 11.445 4 HA GLU 1 HA GLU 1 0.001 -30.025 10.179 5 HB2 GLU 1 HB2 GLU 1 -2.059 -28.754 8.381 6 HB3 GLU 1 HB1 GLU 1 -0.410 -29.028 7.816 7 HG2 GLU 1 HG2 GLU 1 -1.626 -30.978 7.184 8 HG3 GLU 1 HG1 GLU 1 -0.697 -31.445 8.608 9 H VAL 2 H VAL 2 1.409 -28.460 8.661 10 HA VAL 2 HA VAL 2 2.245 -26.321 10.358 11 HB VAL 2 HB VAL 2 3.776 -25.797 8.396 12 HG11 VAL 2 HG11 VAL 2 3.749 -27.964 10.245 13 HG12 VAL 2 HG12 VAL 2 5.149 -27.200 9.494 14 HG13 VAL 2 HG13 VAL 2 4.379 -28.585 8.720 15 HG21 VAL 2 HG21 VAL 2 2.086 -26.847 6.756 16 HG22 VAL 2 HG22 VAL 2 2.715 -28.404 7.294 17 HG23 VAL 2 HG23 VAL 2 3.786 -27.243 6.510 18 H ILE 3 H ILE 3 -0.402 -25.829 9.801 19 HA ILE 3 HA ILE 3 -1.839 -24.181 9.084 20 HB ILE 3 HB ILE 3 0.662 -22.560 8.607 21 HG12 ILE 3 HG12 ILE 3 -0.834 -22.964 11.213 22 HG13 ILE 3 HG11 ILE 3 0.707 -23.729 10.824 23 HG21 ILE 3 HG21 ILE 3 -0.729 -20.675 9.021 24 HG22 ILE 3 HG22 ILE 3 -2.021 -21.681 9.680 25 HG23 ILE 3 HG23 ILE 3 -1.673 -21.714 7.952 26 HD11 ILE 3 HD11 ILE 3 1.004 -20.965 10.248 27 HD12 ILE 3 HD12 ILE 3 1.771 -21.883 11.543 28 HD13 ILE 3 HD13 ILE 3 0.229 -21.076 11.829 29 H LYS 4 H LYS 4 -2.889 -23.725 7.218 30 HA LYS 4 HA LYS 4 -1.365 -23.942 4.688 31 HB2 LYS 4 HB2 LYS 4 -2.612 -25.965 4.851 32 HB3 LYS 4 HB1 LYS 4 -4.056 -25.114 5.399 33 HG2 LYS 4 HG2 LYS 4 -2.912 -24.286 2.773 34 HG3 LYS 4 HG1 LYS 4 -3.724 -25.850 2.838 35 HD2 LYS 4 HD2 LYS 4 -5.155 -23.647 4.197 36 HD3 LYS 4 HD1 LYS 4 -5.021 -23.482 2.447 37 HE2 LYS 4 HE2 LYS 4 -5.947 -25.752 2.160 38 HE3 LYS 4 HE1 LYS 4 -6.091 -25.913 3.910 39 HZ1 LYS 4 HZ1 LYS 4 -7.483 -23.942 2.183 40 HZ2 LYS 4 HZ2 LYS 4 -7.531 -23.926 3.881 41 HZ3 LYS 4 HZ3 LYS 4 -8.188 -25.236 3.023 42 H LYS 5 H LYS 5 -1.756 -22.405 3.179 43 HA LYS 5 HA LYS 5 -4.092 -20.656 3.472 44 HB2 LYS 5 HB2 LYS 5 -2.763 -19.187 4.586 45 HB3 LYS 5 HB1 LYS 5 -1.276 -19.883 3.955 46 HG2 LYS 5 HG2 LYS 5 -1.627 -17.592 3.106 47 HG3 LYS 5 HG1 LYS 5 -1.659 -18.761 1.791 48 HD2 LYS 5 HD2 LYS 5 -3.585 -17.632 1.252 49 HD3 LYS 5 HD1 LYS 5 -4.287 -18.744 2.427 50 HE2 LYS 5 HE2 LYS 5 -3.643 -16.939 4.185 51 HE3 LYS 5 HE1 LYS 5 -3.513 -15.857 2.799 52 HZ1 LYS 5 HZ1 LYS 5 -5.791 -16.531 2.179 53 HZ2 LYS 5 HZ2 LYS 5 -5.716 -15.731 3.677 54 HZ3 LYS 5 HZ3 LYS 5 -5.899 -17.420 3.620 55 H ASP 6 H ASP 6 -5.036 -20.555 1.547 56 HA ASP 6 HA ASP 6 -3.327 -20.606 -0.862 57 HB2 ASP 6 HB2 ASP 6 -4.982 -21.889 -2.012 58 HB3 ASP 6 HB1 ASP 6 -4.718 -22.690 -0.463 59 H THR 7 H THR 7 -3.728 -19.137 -2.440 60 HA THR 7 HA THR 7 -5.763 -17.099 -1.831 61 HB THR 7 HB THR 7 -3.166 -16.650 -2.216 62 HG1 THR 7 HG1 THR 7 -3.767 -14.583 -2.790 63 HG21 THR 7 HG21 THR 7 -3.376 -17.777 -4.513 64 HG22 THR 7 HG22 THR 7 -2.575 -16.205 -4.472 65 HG23 THR 7 HG23 THR 7 -4.248 -16.329 -5.016 66 HA PRO 8 HA PRO 8 -7.734 -18.273 -5.655 67 HB2 PRO 8 HB2 PRO 8 -9.316 -16.166 -6.087 68 HB3 PRO 8 HB1 PRO 8 -9.463 -17.111 -4.591 69 HG2 PRO 8 HG2 PRO 8 -8.272 -14.434 -5.021 70 HG3 PRO 8 HG1 PRO 8 -9.082 -15.096 -3.594 71 HD2 PRO 8 HD2 PRO 8 -6.256 -14.937 -4.062 72 HD3 PRO 8 HD1 PRO 8 -7.085 -15.694 -2.686 73 H TYR 9 H TYR 9 -7.175 -18.339 -7.783 74 HA TYR 9 HA TYR 9 -6.323 -15.884 -9.136 75 HB2 TYR 9 HB2 TYR 9 -4.310 -17.219 -8.203 76 HB3 TYR 9 HB1 TYR 9 -4.681 -18.374 -9.486 77 HD1 TYR 9 HD1 TYR 9 -3.867 -14.802 -8.813 78 HD2 TYR 9 HD2 TYR 9 -4.144 -17.919 -11.756 79 HE1 TYR 9 HE1 TYR 9 -2.743 -13.340 -10.468 80 HE2 TYR 9 HE2 TYR 9 -3.018 -16.456 -13.410 81 HH TYR 9 HH TYR 9 -2.754 -13.911 -13.734 82 H LYS 10 H LYS 10 -8.672 -16.632 -9.729 83 HA LYS 10 HA LYS 10 -8.825 -18.740 -11.700 84 HB2 LYS 10 HB2 LYS 10 -10.822 -16.569 -11.002 85 HB3 LYS 10 HB1 LYS 10 -11.146 -18.001 -11.981 86 HG2 LYS 10 HG2 LYS 10 -11.702 -19.052 -10.063 87 HG3 LYS 10 HG1 LYS 10 -9.988 -19.014 -9.649 88 HD2 LYS 10 HD2 LYS 10 -10.263 -16.870 -8.521 89 HD3 LYS 10 HD1 LYS 10 -11.955 -16.797 -9.014 90 HE2 LYS 10 HE2 LYS 10 -11.760 -17.582 -6.686 91 HE3 LYS 10 HE1 LYS 10 -12.420 -18.850 -7.721 92 HZ1 LYS 10 HZ1 LYS 10 -10.012 -19.593 -7.961 93 HZ2 LYS 10 HZ2 LYS 10 -10.782 -19.907 -6.480 94 HZ3 LYS 10 HZ3 LYS 10 -9.692 -18.611 -6.615 95 H LYS 11 H LYS 11 -7.466 -15.789 -11.707 96 HA LYS 11 HA LYS 11 -8.069 -14.141 -13.647 97 HB2 LYS 11 HB2 LYS 11 -5.483 -15.473 -13.025 98 HB3 LYS 11 HB1 LYS 11 -5.567 -14.525 -14.513 99 HG2 LYS 11 HG2 LYS 11 -6.667 -13.346 -11.986 100 HG3 LYS 11 HG1 LYS 11 -4.920 -13.359 -12.229 101 HD2 LYS 11 HD2 LYS 11 -6.692 -12.409 -14.455 102 HD3 LYS 11 HD1 LYS 11 -6.356 -11.325 -13.105 103 HE2 LYS 11 HE2 LYS 11 -3.965 -11.512 -13.476 104 HE3 LYS 11 HE1 LYS 11 -4.213 -12.745 -14.712 105 HZ1 LYS 11 HZ1 LYS 11 -5.775 -10.702 -15.555 106 HZ2 LYS 11 HZ2 LYS 11 -4.213 -11.044 -16.130 107 HZ3 LYS 11 HZ3 LYS 11 -4.436 -9.887 -14.907 108 H ARG 12 H ARG 12 -5.754 -16.191 -15.141 109 HA ARG 12 HA ARG 12 -7.637 -16.666 -17.361 110 HB2 ARG 12 HB2 ARG 12 -4.815 -15.951 -17.193 111 HB3 ARG 12 HB1 ARG 12 -5.096 -17.331 -18.256 112 HG2 ARG 12 HG2 ARG 12 -5.289 -15.266 -19.547 113 HG3 ARG 12 HG1 ARG 12 -6.876 -16.025 -19.418 114 HD2 ARG 12 HD2 ARG 12 -7.712 -14.221 -18.373 115 HD3 ARG 12 HD1 ARG 12 -6.439 -14.286 -17.157 116 HE ARG 12 HE ARG 12 -5.265 -12.661 -18.356 117 HH11 ARG 12 HH11 ARG 12 -5.133 -11.085 -19.987 118 HH12 ARG 12 HH12 ARG 12 -6.254 -11.117 -21.307 119 HH21 ARG 12 HH21 ARG 12 -7.933 -13.925 -20.158 120 HH22 ARG 12 HH22 ARG 12 -7.839 -12.726 -21.405 121 H LYS 13 H LYS 13 -6.994 -18.700 -18.673 122 HA LYS 13 HA LYS 13 -7.335 -20.959 -16.922 123 HB2 LYS 13 HB2 LYS 13 -6.790 -21.077 -19.886 124 HB3 LYS 13 HB1 LYS 13 -7.680 -22.230 -18.892 125 HG2 LYS 13 HG2 LYS 13 -9.523 -20.753 -18.634 126 HG3 LYS 13 HG1 LYS 13 -8.593 -19.369 -19.210 127 HD2 LYS 13 HD2 LYS 13 -10.210 -20.320 -20.906 128 HD3 LYS 13 HD1 LYS 13 -8.535 -20.247 -21.454 129 HE2 LYS 13 HE2 LYS 13 -9.687 -22.436 -21.953 130 HE3 LYS 13 HE1 LYS 13 -8.210 -22.596 -21.002 131 HZ1 LYS 13 HZ1 LYS 13 -10.057 -23.917 -20.114 132 HZ2 LYS 13 HZ2 LYS 13 -10.953 -22.493 -19.870 133 HZ3 LYS 13 HZ3 LYS 13 -9.512 -22.754 -19.006 134 H PHE 14 H PHE 14 -4.684 -19.355 -18.400 135 HA PHE 14 HA PHE 14 -2.900 -21.559 -17.563 136 HB2 PHE 14 HB2 PHE 14 -3.269 -20.923 -20.160 137 HB3 PHE 14 HB1 PHE 14 -1.981 -19.787 -19.755 138 HD1 PHE 14 HD1 PHE 14 -2.880 -23.303 -20.199 139 HD2 PHE 14 HD2 PHE 14 0.195 -20.606 -18.887 140 HE1 PHE 14 HE1 PHE 14 -1.222 -25.146 -20.296 141 HE2 PHE 14 HE2 PHE 14 1.852 -22.449 -18.985 142 HZ PHE 14 HZ PHE 14 1.143 -24.719 -19.688 143 HA PRO 15 HA PRO 15 -2.112 -17.633 -15.118 144 HB2 PRO 15 HB2 PRO 15 -1.000 -19.864 -13.456 145 HB3 PRO 15 HB1 PRO 15 -1.920 -18.434 -12.950 146 HG2 PRO 15 HG2 PRO 15 -3.057 -20.833 -13.101 147 HG3 PRO 15 HG1 PRO 15 -3.937 -19.359 -13.537 148 HD2 PRO 15 HD2 PRO 15 -2.860 -21.494 -15.310 149 HD3 PRO 15 HD1 PRO 15 -4.235 -20.396 -15.568 150 H TYR 16 H TYR 16 0.373 -18.945 -13.557 151 HA TYR 16 HA TYR 16 2.420 -19.286 -15.467 152 HB2 TYR 16 HB2 TYR 16 1.620 -16.567 -15.077 153 HB3 TYR 16 HB1 TYR 16 3.230 -16.776 -14.390 154 HD1 TYR 16 HD1 TYR 16 4.791 -18.404 -15.920 155 HD2 TYR 16 HD2 TYR 16 1.541 -15.971 -17.324 156 HE1 TYR 16 HE1 TYR 16 5.767 -18.416 -18.199 157 HE2 TYR 16 HE2 TYR 16 2.517 -15.984 -19.605 158 HH TYR 16 HH TYR 16 5.700 -17.129 -20.235 159 H LYS 17 H LYS 17 1.466 -20.263 -12.860 160 HA LYS 17 HA LYS 17 2.340 -21.037 -10.883 161 HB2 LYS 17 HB2 LYS 17 5.037 -20.292 -12.025 162 HB3 LYS 17 HB1 LYS 17 4.675 -21.536 -10.828 163 HG2 LYS 17 HG2 LYS 17 3.594 -21.567 -13.658 164 HG3 LYS 17 HG1 LYS 17 5.051 -22.426 -13.158 165 HD2 LYS 17 HD2 LYS 17 3.570 -23.475 -11.318 166 HD3 LYS 17 HD1 LYS 17 2.205 -22.896 -12.274 167 HE2 LYS 17 HE2 LYS 17 2.408 -24.689 -13.615 168 HE3 LYS 17 HE1 LYS 17 4.020 -24.142 -14.077 169 HZ1 LYS 17 HZ1 LYS 17 3.546 -25.611 -11.557 170 HZ2 LYS 17 HZ2 LYS 17 5.007 -25.391 -12.397 171 HZ3 LYS 17 HZ3 LYS 17 3.814 -26.428 -13.019 172 H SER 18 H SER 18 4.854 -18.609 -11.513 173 HA SER 18 HA SER 18 4.895 -17.570 -8.923 174 HB2 SER 18 HB2 SER 18 6.207 -15.773 -9.812 175 HB3 SER 18 HB1 SER 18 6.621 -17.214 -10.738 176 HG SER 18 HG SER 18 4.580 -15.428 -11.545 177 H GLU 19 H GLU 19 3.284 -16.263 -11.818 178 HA GLU 19 HA GLU 19 2.101 -14.016 -10.764 179 HB2 GLU 19 HB2 GLU 19 1.994 -15.153 -13.160 180 HB3 GLU 19 HB1 GLU 19 0.448 -15.743 -12.551 181 HG2 GLU 19 HG2 GLU 19 0.069 -13.626 -13.673 182 HG3 GLU 19 HG1 GLU 19 -0.149 -13.388 -11.940 183 H CYS 20 H CYS 20 1.448 -17.306 -10.011 184 HA CYS 20 HA CYS 20 -1.146 -16.677 -8.791 185 HB2 CYS 20 HB2 CYS 20 -0.333 -18.873 -10.155 186 HB3 CYS 20 HB1 CYS 20 0.006 -19.385 -8.502 187 H LEU 21 H LEU 21 2.128 -17.657 -7.937 188 HA LEU 21 HA LEU 21 1.531 -17.963 -5.131 189 HB2 LEU 21 HB2 LEU 21 3.524 -18.884 -6.738 190 HB3 LEU 21 HB1 LEU 21 4.334 -17.526 -5.956 191 HG LEU 21 HG LEU 21 3.320 -18.495 -3.758 192 HD11 LEU 21 HD11 LEU 21 3.534 -21.146 -5.080 193 HD12 LEU 21 HD12 LEU 21 2.078 -20.214 -5.436 194 HD13 LEU 21 HD13 LEU 21 2.477 -20.624 -3.767 195 HD21 LEU 21 HD21 LEU 21 5.257 -20.165 -3.653 196 HD22 LEU 21 HD22 LEU 21 5.689 -18.510 -4.071 197 HD23 LEU 21 HD23 LEU 21 5.585 -19.737 -5.332 198 H LYS 22 H LYS 22 2.790 -15.444 -7.231 199 HA LYS 22 HA LYS 22 3.874 -13.705 -5.334 200 HB2 LYS 22 HB2 LYS 22 4.035 -13.439 -7.815 201 HB3 LYS 22 HB1 LYS 22 2.351 -12.912 -7.825 202 HG2 LYS 22 HG2 LYS 22 2.839 -10.881 -6.888 203 HG3 LYS 22 HG1 LYS 22 4.133 -11.539 -5.887 204 HD2 LYS 22 HD2 LYS 22 5.641 -11.626 -7.781 205 HD3 LYS 22 HD1 LYS 22 4.346 -11.168 -8.887 206 HE2 LYS 22 HE2 LYS 22 4.106 -9.029 -7.528 207 HE3 LYS 22 HE1 LYS 22 5.612 -9.472 -6.726 208 HZ1 LYS 22 HZ1 LYS 22 6.823 -9.045 -8.557 209 HZ2 LYS 22 HZ2 LYS 22 5.517 -8.031 -8.947 210 HZ3 LYS 22 HZ3 LYS 22 5.624 -9.584 -9.630 211 H ALA 23 H ALA 23 0.525 -14.021 -6.475 212 HA ALA 23 HA ALA 23 -0.587 -11.849 -5.110 213 HB1 ALA 23 HB1 ALA 23 -2.196 -12.711 -6.459 214 HB2 ALA 23 HB2 ALA 23 -2.608 -13.669 -5.038 215 HB3 ALA 23 HB3 ALA 23 -1.587 -14.359 -6.301 216 H CYS 24 H CYS 24 -0.245 -15.239 -4.045 217 HA CYS 24 HA CYS 24 -1.389 -14.873 -1.496 218 HB2 CYS 24 HB2 CYS 24 -0.684 -17.054 -2.785 219 HB3 CYS 24 HB1 CYS 24 0.840 -16.826 -1.927 220 H ALA 25 H ALA 25 1.965 -14.655 -2.637 221 HA ALA 25 HA ALA 25 3.077 -14.080 -0.074 222 HB1 ALA 25 HB1 ALA 25 4.760 -14.766 -1.464 223 HB2 ALA 25 HB2 ALA 25 4.904 -13.030 -1.744 224 HB3 ALA 25 HB3 ALA 25 4.021 -14.038 -2.892 225 H THR 26 H THR 26 1.457 -12.207 -2.493 226 HA THR 26 HA THR 26 2.431 -9.638 -1.975 227 HB THR 26 HB THR 26 -0.452 -10.326 -2.586 228 HG1 THR 26 HG1 THR 26 1.472 -9.747 -4.534 229 HG21 THR 26 HG21 THR 26 1.000 -7.881 -2.273 230 HG22 THR 26 HG22 THR 26 -0.689 -8.100 -2.728 231 HG23 THR 26 HG23 THR 26 0.560 -8.051 -3.972 232 H SER 27 H SER 27 0.315 -11.697 -0.137 233 HA SER 27 HA SER 27 -1.142 -10.074 1.470 234 HB2 SER 27 HB2 SER 27 -0.479 -12.685 1.612 235 HB3 SER 27 HB1 SER 27 0.468 -12.068 2.963 236 HG SER 27 HG SER 27 -1.723 -10.882 3.323 237 H PHE 28 H PHE 28 2.240 -9.991 1.123 238 HA PHE 28 HA PHE 28 3.551 -9.294 3.280 239 HB2 PHE 28 HB2 PHE 28 4.312 -8.780 0.963 240 HB3 PHE 28 HB1 PHE 28 3.305 -7.333 0.987 241 HD1 PHE 28 HD1 PHE 28 5.983 -9.042 2.981 242 HD2 PHE 28 HD2 PHE 28 4.205 -5.323 1.773 243 HE1 PHE 28 HE1 PHE 28 7.794 -7.800 4.135 244 HE2 PHE 28 HE2 PHE 28 6.014 -4.083 2.929 245 HZ PHE 28 HZ PHE 28 7.809 -5.321 4.110 246 H THR 29 H THR 29 2.718 -8.552 5.149 247 HA THR 29 HA THR 29 1.807 -5.804 5.267 248 HB THR 29 HB THR 29 -0.047 -8.052 6.093 249 HG1 THR 29 HG1 THR 29 -0.592 -7.810 4.081 250 HG21 THR 29 HG21 THR 29 0.232 -5.409 7.096 251 HG22 THR 29 HG22 THR 29 -1.055 -6.564 7.440 252 HG23 THR 29 HG23 THR 29 -1.221 -5.433 6.098 253 H GLY 30 H GLY 30 2.735 -4.946 7.000 254 HA2 GLY 30 HA2 GLY 30 3.950 -4.825 8.967 255 HA3 GLY 30 HA1 GLY 30 2.559 -5.687 9.615 256 H GLY 31 H GLY 31 5.633 -6.226 7.906 257 HA2 GLY 31 HA2 GLY 31 7.255 -7.719 9.019 258 HA3 GLY 31 HA1 GLY 31 5.898 -8.783 9.379 259 H ASP 32 H ASP 32 8.007 -9.897 8.131 260 HA ASP 32 HA ASP 32 7.023 -10.290 5.371 261 HB2 ASP 32 HB2 ASP 32 9.334 -9.035 5.818 262 HB3 ASP 32 HB1 ASP 32 9.916 -10.693 5.960 263 H GLU 33 H GLU 33 7.846 -12.417 4.454 264 HA GLU 33 HA GLU 33 7.803 -14.718 4.558 265 HB2 GLU 33 HB2 GLU 33 9.533 -13.840 6.804 266 HB3 GLU 33 HB1 GLU 33 8.960 -15.507 6.868 267 HG2 GLU 33 HG2 GLU 33 10.048 -16.101 4.899 268 HG3 GLU 33 HG1 GLU 33 10.060 -14.447 4.287 269 H SER 34 H SER 34 7.646 -14.290 8.061 270 HA SER 34 HA SER 34 5.789 -16.089 8.741 271 HB2 SER 34 HB2 SER 34 4.882 -14.245 10.387 272 HB3 SER 34 HB1 SER 34 6.532 -14.838 10.552 273 HG SER 34 HG SER 34 7.283 -12.990 9.796 274 H ARG 35 H ARG 35 4.182 -16.621 7.375 275 HA ARG 35 HA ARG 35 1.678 -15.748 7.393 276 HB2 ARG 35 HB2 ARG 35 3.314 -13.770 5.895 277 HB3 ARG 35 HB1 ARG 35 1.800 -14.259 5.141 278 HG2 ARG 35 HG2 ARG 35 0.497 -13.364 6.820 279 HG3 ARG 35 HG1 ARG 35 1.737 -13.595 8.053 280 HD2 ARG 35 HD2 ARG 35 2.943 -11.685 7.363 281 HD3 ARG 35 HD1 ARG 35 2.133 -11.631 5.801 282 HE ARG 35 HE ARG 35 0.288 -10.596 6.832 283 HH11 ARG 35 HH11 ARG 35 -0.586 -9.408 8.559 284 HH12 ARG 35 HH12 ARG 35 0.183 -9.453 10.111 285 HH21 ARG 35 HH21 ARG 35 2.709 -11.598 9.090 286 HH22 ARG 35 HH22 ARG 35 2.050 -10.694 10.412 287 H ILE 36 H ILE 36 4.336 -16.368 5.214 288 HA ILE 36 HA ILE 36 2.857 -18.570 3.990 289 HB ILE 36 HB ILE 36 4.387 -16.652 2.239 290 HG12 ILE 36 HG12 ILE 36 2.466 -15.476 3.422 291 HG13 ILE 36 HG11 ILE 36 2.349 -15.509 1.662 292 HG21 ILE 36 HG21 ILE 36 4.049 -18.644 1.083 293 HG22 ILE 36 HG22 ILE 36 2.614 -17.730 0.618 294 HG23 ILE 36 HG23 ILE 36 2.505 -18.965 1.872 295 HD11 ILE 36 HD11 ILE 36 1.123 -17.856 2.917 296 HD12 ILE 36 HD12 ILE 36 0.467 -16.757 1.706 297 HD13 ILE 36 HD13 ILE 36 0.373 -16.341 3.417 298 H GLN 37 H GLN 37 5.929 -16.762 3.715 299 HA GLN 37 HA GLN 37 8.110 -17.481 3.831 300 HB2 GLN 37 HB2 GLN 37 6.633 -19.322 5.524 301 HB3 GLN 37 HB1 GLN 37 7.982 -20.124 4.727 302 HG2 GLN 37 HG2 GLN 37 8.357 -17.440 6.031 303 HG3 GLN 37 HG1 GLN 37 8.425 -18.916 6.988 304 HE21 GLN 37 HE21 GLN 37 10.743 -17.273 6.662 305 HE22 GLN 37 HE22 GLN 37 11.875 -18.122 5.725 306 H GLU 38 H GLU 38 5.848 -20.033 2.812 307 HA GLU 38 HA GLU 38 7.242 -20.264 0.271 308 HB2 GLU 38 HB2 GLU 38 8.325 -21.881 1.918 309 HB3 GLU 38 HB1 GLU 38 6.794 -22.748 1.926 310 HG2 GLU 38 HG2 GLU 38 7.163 -23.639 -0.121 311 HG3 GLU 38 HG1 GLU 38 7.738 -22.108 -0.777 312 H GLY 39 H GLY 39 5.968 -21.262 -1.333 313 HA2 GLY 39 HA2 GLY 39 3.333 -22.258 -0.648 314 HA3 GLY 39 HA1 GLY 39 3.333 -20.718 -1.502 315 H LYS 40 H LYS 40 2.146 -23.047 -2.512 316 HA LYS 40 HA LYS 40 3.954 -23.761 -4.736 317 HB2 LYS 40 HB2 LYS 40 1.538 -25.312 -3.781 318 HB3 LYS 40 HB1 LYS 40 2.757 -25.843 -4.936 319 HG2 LYS 40 HG2 LYS 40 3.942 -24.981 -2.411 320 HG3 LYS 40 HG1 LYS 40 2.807 -26.313 -2.196 321 HD2 LYS 40 HD2 LYS 40 3.976 -27.539 -4.042 322 HD3 LYS 40 HD1 LYS 40 5.172 -26.243 -4.091 323 HE2 LYS 40 HE2 LYS 40 5.844 -26.688 -1.810 324 HE3 LYS 40 HE1 LYS 40 4.530 -27.847 -1.602 325 HZ1 LYS 40 HZ1 LYS 40 6.842 -28.105 -3.446 326 HZ2 LYS 40 HZ2 LYS 40 5.533 -29.185 -3.386 327 HZ3 LYS 40 HZ3 LYS 40 6.561 -29.015 -2.044 328 HA PRO 41 HA PRO 41 0.806 -21.967 -7.349 329 HB2 PRO 41 HB2 PRO 41 1.556 -22.860 -9.739 330 HB3 PRO 41 HB1 PRO 41 2.688 -21.912 -8.750 331 HG2 PRO 41 HG2 PRO 41 2.623 -24.833 -9.271 332 HG3 PRO 41 HG1 PRO 41 4.002 -23.753 -9.029 333 HD2 PRO 41 HD2 PRO 41 2.779 -25.424 -7.064 334 HD3 PRO 41 HD1 PRO 41 4.046 -24.206 -6.796 335 H GLY 42 H GLY 42 -0.922 -22.426 -8.936 336 HA2 GLY 42 HA2 GLY 42 -1.787 -25.136 -9.389 337 HA3 GLY 42 HA1 GLY 42 -2.772 -24.292 -8.197 338 H PHE 43 H PHE 43 -3.769 -25.222 -10.671 339 HA PHE 43 HA PHE 43 -3.887 -23.050 -12.557 340 HB2 PHE 43 HB2 PHE 43 -5.816 -25.364 -12.421 341 HB3 PHE 43 HB1 PHE 43 -5.304 -24.444 -13.837 342 HD1 PHE 43 HD1 PHE 43 -5.047 -27.561 -12.607 343 HD2 PHE 43 HD2 PHE 43 -2.440 -24.323 -13.687 344 HE1 PHE 43 HE1 PHE 43 -3.202 -29.173 -12.990 345 HE2 PHE 43 HE2 PHE 43 -0.595 -25.935 -14.070 346 HZ PHE 43 HZ PHE 43 -0.977 -28.361 -13.723 347 H PHE 44 H PHE 44 -5.461 -21.529 -12.811 348 HA PHE 44 HA PHE 44 -7.133 -20.084 -12.170 349 HB2 PHE 44 HB2 PHE 44 -8.507 -22.640 -11.310 350 HB3 PHE 44 HB1 PHE 44 -9.284 -21.102 -11.684 351 HD1 PHE 44 HD1 PHE 44 -9.717 -20.439 -13.940 352 HD2 PHE 44 HD2 PHE 44 -7.319 -23.910 -13.128 353 HE1 PHE 44 HE1 PHE 44 -9.828 -21.076 -16.334 354 HE2 PHE 44 HE2 PHE 44 -7.429 -24.545 -15.523 355 HZ PHE 44 HZ PHE 44 -8.685 -23.130 -17.125 356 H LYS 45 H LYS 45 -5.079 -21.033 -10.120 357 HA LYS 45 HA LYS 45 -5.798 -19.472 -7.966 358 HB2 LYS 45 HB2 LYS 45 -6.360 -21.362 -6.300 359 HB3 LYS 45 HB1 LYS 45 -7.645 -20.785 -7.359 360 HG2 LYS 45 HG2 LYS 45 -7.520 -22.680 -8.747 361 HG3 LYS 45 HG1 LYS 45 -5.898 -23.093 -8.190 362 HD2 LYS 45 HD2 LYS 45 -6.687 -23.916 -6.124 363 HD3 LYS 45 HD1 LYS 45 -8.239 -23.095 -6.290 364 HE2 LYS 45 HE2 LYS 45 -7.907 -25.722 -6.837 365 HE3 LYS 45 HE1 LYS 45 -9.108 -24.718 -7.650 366 HZ1 LYS 45 HZ1 LYS 45 -8.075 -25.368 -9.503 367 HZ2 LYS 45 HZ2 LYS 45 -6.681 -25.880 -8.678 368 HZ3 LYS 45 HZ3 LYS 45 -6.877 -24.242 -9.084 369 H CYS 46 H CYS 46 -4.735 -20.597 -5.787 370 HA CYS 46 HA CYS 46 -2.358 -22.122 -6.373 371 HB2 CYS 46 HB2 CYS 46 -1.324 -19.777 -5.141 372 HB3 CYS 46 HB1 CYS 46 -0.934 -20.433 -6.732 373 H THR 47 H THR 47 -1.417 -22.971 -4.519 374 HA THR 47 HA THR 47 -2.843 -22.372 -2.004 375 HB THR 47 HB THR 47 -1.709 -24.688 -1.405 376 HG1 THR 47 HG1 THR 47 -0.748 -25.396 -3.138 377 HG21 THR 47 HG21 THR 47 -3.832 -25.730 -2.602 378 HG22 THR 47 HG22 THR 47 -4.240 -24.032 -2.851 379 HG23 THR 47 HG23 THR 47 -4.009 -24.653 -1.216 380 H CYS 48 H CYS 48 -1.716 -21.839 -0.196 381 HA CYS 48 HA CYS 48 1.230 -21.818 -0.375 382 HB2 CYS 48 HB2 CYS 48 0.287 -19.617 1.215 383 HB3 CYS 48 HB1 CYS 48 1.303 -19.583 -0.228 384 H TYR 49 H TYR 49 2.279 -21.635 1.790 385 HA TYR 49 HA TYR 49 0.576 -22.466 4.030 386 HB2 TYR 49 HB2 TYR 49 2.992 -24.050 3.132 387 HB3 TYR 49 HB1 TYR 49 1.999 -24.380 4.549 388 HD1 TYR 49 HD1 TYR 49 1.859 -24.069 0.829 389 HD2 TYR 49 HD2 TYR 49 0.024 -25.670 4.368 390 HE1 TYR 49 HE1 TYR 49 0.291 -25.377 -0.576 391 HE2 TYR 49 HE2 TYR 49 -1.544 -26.979 2.961 392 HH TYR 49 HH TYR 49 -1.957 -27.702 0.854 393 H PHE 50 H PHE 50 1.701 -22.341 6.103 394 HA PHE 50 HA PHE 50 3.806 -20.278 6.040 395 HB2 PHE 50 HB2 PHE 50 2.367 -21.204 8.520 396 HB3 PHE 50 HB1 PHE 50 3.206 -19.688 8.244 397 HD1 PHE 50 HD1 PHE 50 1.882 -17.831 7.990 398 HD2 PHE 50 HD2 PHE 50 0.378 -21.622 6.651 399 HE1 PHE 50 HE1 PHE 50 -0.255 -16.756 7.330 400 HE2 PHE 50 HE2 PHE 50 -1.747 -20.548 5.986 401 HZ PHE 50 HZ PHE 50 -2.065 -18.112 6.330 402 H THR 51 H THR 51 5.795 -21.181 6.007 403 HA THR 51 HA THR 51 6.402 -23.789 6.888 404 HB THR 51 HB THR 51 8.762 -23.097 6.739 405 HG1 THR 51 HG1 THR 51 7.550 -20.557 6.627 406 HG21 THR 51 HG21 THR 51 6.941 -22.060 4.553 407 HG22 THR 51 HG22 THR 51 7.647 -23.672 4.670 408 HG23 THR 51 HG23 THR 51 8.682 -22.276 4.370 409 H THR 52 H THR 52 5.090 -23.480 8.967 410 HA THR 52 HA THR 52 7.000 -22.912 11.132 411 HB THR 52 HB THR 52 4.681 -22.076 12.274 412 HG1 THR 52 HG1 THR 52 4.265 -20.489 10.263 413 HG21 THR 52 HG21 THR 52 5.584 -19.719 11.565 414 HG22 THR 52 HG22 THR 52 6.905 -20.645 10.852 415 HG23 THR 52 HG23 THR 52 6.583 -20.758 12.582 416 H GLY 53 H GLY 53 7.245 -25.081 11.577 417 HA2 GLY 53 HA2 GLY 53 5.622 -26.332 13.400 418 HA3 GLY 53 HA1 GLY 53 5.023 -26.881 11.836 Start of MODEL 14 1 H1 GLU 1 H1 GLU 1 -0.380 -30.260 13.089 2 H2 GLU 1 H2 GLU 1 -1.634 -29.262 12.528 3 H3 GLU 1 H3 GLU 1 -0.375 -28.606 13.459 4 HA GLU 1 HA GLU 1 1.089 -29.588 11.524 5 HB2 GLU 1 HB2 GLU 1 -0.536 -28.752 9.482 6 HB3 GLU 1 HB1 GLU 1 -0.298 -30.439 9.934 7 HG2 GLU 1 HG2 GLU 1 -2.438 -28.685 11.163 8 HG3 GLU 1 HG1 GLU 1 -2.722 -29.708 9.756 9 H VAL 2 H VAL 2 1.082 -27.741 9.514 10 HA VAL 2 HA VAL 2 1.746 -25.323 10.947 11 HB VAL 2 HB VAL 2 2.410 -24.495 8.688 12 HG11 VAL 2 HG11 VAL 2 4.231 -26.176 8.371 13 HG12 VAL 2 HG12 VAL 2 3.398 -27.246 9.498 14 HG13 VAL 2 HG13 VAL 2 4.031 -25.699 10.057 15 HG21 VAL 2 HG21 VAL 2 2.213 -27.094 7.392 16 HG22 VAL 2 HG22 VAL 2 1.690 -25.515 6.806 17 HG23 VAL 2 HG23 VAL 2 0.619 -26.476 7.827 18 H ILE 3 H ILE 3 0.730 -24.305 8.001 19 HA ILE 3 HA ILE 3 -2.041 -23.767 8.801 20 HB ILE 3 HB ILE 3 0.112 -21.849 8.953 21 HG12 ILE 3 HG12 ILE 3 -2.874 -21.608 9.431 22 HG13 ILE 3 HG11 ILE 3 -1.699 -22.194 10.609 23 HG21 ILE 3 HG21 ILE 3 -0.432 -21.255 6.650 24 HG22 ILE 3 HG22 ILE 3 -1.043 -20.002 7.729 25 HG23 ILE 3 HG23 ILE 3 -2.151 -21.190 7.042 26 HD11 ILE 3 HD11 ILE 3 -0.607 -20.071 10.722 27 HD12 ILE 3 HD12 ILE 3 -2.336 -19.728 10.812 28 HD13 ILE 3 HD13 ILE 3 -1.464 -19.478 9.300 29 H LYS 4 H LYS 4 -3.400 -23.100 7.065 30 HA LYS 4 HA LYS 4 -2.334 -23.853 4.413 31 HB2 LYS 4 HB2 LYS 4 -5.241 -23.751 5.230 32 HB3 LYS 4 HB1 LYS 4 -4.541 -24.532 3.812 33 HG2 LYS 4 HG2 LYS 4 -4.054 -25.334 6.697 34 HG3 LYS 4 HG1 LYS 4 -5.060 -26.205 5.538 35 HD2 LYS 4 HD2 LYS 4 -2.998 -26.380 4.058 36 HD3 LYS 4 HD1 LYS 4 -2.064 -25.788 5.432 37 HE2 LYS 4 HE2 LYS 4 -1.935 -28.145 5.616 38 HE3 LYS 4 HE1 LYS 4 -3.185 -27.687 6.774 39 HZ1 LYS 4 HZ1 LYS 4 -4.680 -27.998 4.638 40 HZ2 LYS 4 HZ2 LYS 4 -4.296 -29.297 5.664 41 HZ3 LYS 4 HZ3 LYS 4 -3.435 -29.070 4.216 42 H LYS 5 H LYS 5 -1.733 -22.052 3.366 43 HA LYS 5 HA LYS 5 -3.587 -19.745 3.400 44 HB2 LYS 5 HB2 LYS 5 -1.342 -19.330 4.423 45 HB3 LYS 5 HB1 LYS 5 -0.608 -19.707 2.864 46 HG2 LYS 5 HG2 LYS 5 -0.798 -17.423 2.626 47 HG3 LYS 5 HG1 LYS 5 -2.384 -17.897 2.017 48 HD2 LYS 5 HD2 LYS 5 -3.443 -17.395 4.096 49 HD3 LYS 5 HD1 LYS 5 -1.897 -17.270 4.935 50 HE2 LYS 5 HE2 LYS 5 -1.392 -15.361 3.237 51 HE3 LYS 5 HE1 LYS 5 -3.135 -15.347 2.977 52 HZ1 LYS 5 HZ1 LYS 5 -1.679 -14.230 5.101 53 HZ2 LYS 5 HZ2 LYS 5 -2.687 -15.444 5.727 54 HZ3 LYS 5 HZ3 LYS 5 -3.350 -14.170 4.821 55 H ASP 6 H ASP 6 -4.795 -19.990 1.602 56 HA ASP 6 HA ASP 6 -3.364 -20.327 -0.958 57 HB2 ASP 6 HB2 ASP 6 -5.403 -21.519 -1.777 58 HB3 ASP 6 HB1 ASP 6 -4.568 -22.377 -0.481 59 H THR 7 H THR 7 -3.884 -18.930 -2.576 60 HA THR 7 HA THR 7 -6.030 -16.987 -1.990 61 HB THR 7 HB THR 7 -4.612 -15.308 -2.448 62 HG1 THR 7 HG1 THR 7 -4.013 -16.871 -4.723 63 HG21 THR 7 HG21 THR 7 -2.159 -15.904 -2.599 64 HG22 THR 7 HG22 THR 7 -2.641 -17.598 -2.609 65 HG23 THR 7 HG23 THR 7 -2.999 -16.588 -1.208 66 HA PRO 8 HA PRO 8 -7.612 -18.126 -6.007 67 HB2 PRO 8 HB2 PRO 8 -9.330 -16.133 -6.446 68 HB3 PRO 8 HB1 PRO 8 -9.500 -17.152 -5.001 69 HG2 PRO 8 HG2 PRO 8 -8.487 -14.379 -5.244 70 HG3 PRO 8 HG1 PRO 8 -9.350 -15.156 -3.907 71 HD2 PRO 8 HD2 PRO 8 -6.515 -14.782 -4.147 72 HD3 PRO 8 HD1 PRO 8 -7.387 -15.662 -2.874 73 H TYR 9 H TYR 9 -6.513 -18.086 -7.922 74 HA TYR 9 HA TYR 9 -5.298 -15.579 -8.845 75 HB2 TYR 9 HB2 TYR 9 -3.905 -17.619 -8.827 76 HB3 TYR 9 HB1 TYR 9 -5.036 -18.394 -9.937 77 HD1 TYR 9 HD1 TYR 9 -4.366 -18.400 -12.166 78 HD2 TYR 9 HD2 TYR 9 -3.302 -15.069 -9.671 79 HE1 TYR 9 HE1 TYR 9 -3.203 -17.336 -14.081 80 HE2 TYR 9 HE2 TYR 9 -2.142 -14.004 -11.586 81 HH TYR 9 HH TYR 9 -1.201 -15.560 -14.258 82 H LYS 10 H LYS 10 -7.797 -17.886 -9.645 83 HA LYS 10 HA LYS 10 -9.184 -18.030 -11.522 84 HB2 LYS 10 HB2 LYS 10 -9.519 -15.418 -10.129 85 HB3 LYS 10 HB1 LYS 10 -10.409 -15.677 -11.631 86 HG2 LYS 10 HG2 LYS 10 -10.441 -17.914 -9.675 87 HG3 LYS 10 HG1 LYS 10 -11.352 -16.470 -9.232 88 HD2 LYS 10 HD2 LYS 10 -12.497 -16.555 -11.444 89 HD3 LYS 10 HD1 LYS 10 -11.645 -18.058 -11.798 90 HE2 LYS 10 HE2 LYS 10 -13.672 -17.555 -9.610 91 HE3 LYS 10 HE1 LYS 10 -13.791 -18.697 -10.949 92 HZ1 LYS 10 HZ1 LYS 10 -12.366 -18.929 -8.437 93 HZ2 LYS 10 HZ2 LYS 10 -11.517 -19.481 -9.801 94 HZ3 LYS 10 HZ3 LYS 10 -13.037 -20.136 -9.421 95 H LYS 11 H LYS 11 -6.718 -17.767 -12.574 96 HA LYS 11 HA LYS 11 -5.413 -16.574 -14.172 97 HB2 LYS 11 HB2 LYS 11 -6.400 -17.157 -16.368 98 HB3 LYS 11 HB1 LYS 11 -6.458 -18.504 -15.228 99 HG2 LYS 11 HG2 LYS 11 -8.797 -16.659 -15.255 100 HG3 LYS 11 HG1 LYS 11 -8.613 -17.737 -16.638 101 HD2 LYS 11 HD2 LYS 11 -8.435 -19.668 -15.088 102 HD3 LYS 11 HD1 LYS 11 -8.687 -18.579 -13.725 103 HE2 LYS 11 HE2 LYS 11 -10.685 -19.882 -15.151 104 HE3 LYS 11 HE1 LYS 11 -10.917 -18.510 -14.067 105 HZ1 LYS 11 HZ1 LYS 11 -11.851 -17.821 -16.062 106 HZ2 LYS 11 HZ2 LYS 11 -10.615 -18.508 -17.004 107 HZ3 LYS 11 HZ3 LYS 11 -10.312 -17.109 -16.091 108 H ARG 12 H ARG 12 -6.358 -14.482 -12.863 109 HA ARG 12 HA ARG 12 -8.192 -12.726 -13.742 110 HB2 ARG 12 HB2 ARG 12 -5.318 -12.234 -12.986 111 HB3 ARG 12 HB1 ARG 12 -6.402 -10.902 -13.387 112 HG2 ARG 12 HG2 ARG 12 -7.904 -11.470 -11.605 113 HG3 ARG 12 HG1 ARG 12 -7.082 -13.004 -11.318 114 HD2 ARG 12 HD2 ARG 12 -5.025 -11.193 -11.070 115 HD3 ARG 12 HD1 ARG 12 -6.383 -10.299 -10.395 116 HE ARG 12 HE ARG 12 -6.046 -13.032 -9.424 117 HH11 ARG 12 HH11 ARG 12 -5.669 -13.187 -7.186 118 HH12 ARG 12 HH12 ARG 12 -5.301 -11.761 -6.275 119 HH21 ARG 12 HH21 ARG 12 -5.485 -9.642 -9.015 120 HH22 ARG 12 HH22 ARG 12 -5.197 -9.753 -7.311 121 H LYS 13 H LYS 13 -5.173 -11.531 -14.876 122 HA LYS 13 HA LYS 13 -6.301 -11.094 -17.521 123 HB2 LYS 13 HB2 LYS 13 -3.549 -10.331 -16.529 124 HB3 LYS 13 HB1 LYS 13 -4.436 -9.641 -17.890 125 HG2 LYS 13 HG2 LYS 13 -6.212 -9.318 -15.803 126 HG3 LYS 13 HG1 LYS 13 -4.655 -9.049 -15.019 127 HD2 LYS 13 HD2 LYS 13 -5.066 -6.913 -15.801 128 HD3 LYS 13 HD1 LYS 13 -4.216 -7.577 -17.196 129 HE2 LYS 13 HE2 LYS 13 -6.052 -6.884 -18.351 130 HE3 LYS 13 HE1 LYS 13 -6.779 -8.365 -17.725 131 HZ1 LYS 13 HZ1 LYS 13 -7.781 -5.917 -17.332 132 HZ2 LYS 13 HZ2 LYS 13 -6.849 -6.100 -15.923 133 HZ3 LYS 13 HZ3 LYS 13 -8.060 -7.231 -16.297 134 H PHE 14 H PHE 14 -2.981 -11.328 -17.763 135 HA PHE 14 HA PHE 14 -3.129 -13.578 -19.527 136 HB2 PHE 14 HB2 PHE 14 -0.428 -13.131 -18.865 137 HB3 PHE 14 HB1 PHE 14 -1.288 -12.553 -20.292 138 HD1 PHE 14 HD1 PHE 14 0.466 -11.578 -17.365 139 HD2 PHE 14 HD2 PHE 14 -2.763 -10.399 -19.943 140 HE1 PHE 14 HE1 PHE 14 0.657 -9.247 -16.540 141 HE2 PHE 14 HE2 PHE 14 -2.572 -8.069 -19.116 142 HZ PHE 14 HZ PHE 14 -0.861 -7.492 -17.414 143 HA PRO 15 HA PRO 15 -2.384 -16.832 -16.663 144 HB2 PRO 15 HB2 PRO 15 -1.100 -18.634 -18.261 145 HB3 PRO 15 HB1 PRO 15 -2.833 -18.283 -18.395 146 HG2 PRO 15 HG2 PRO 15 -0.572 -17.323 -20.070 147 HG3 PRO 15 HG1 PRO 15 -2.214 -17.787 -20.544 148 HD2 PRO 15 HD2 PRO 15 -1.391 -15.171 -20.268 149 HD3 PRO 15 HD1 PRO 15 -3.077 -15.700 -20.085 150 H TYR 16 H TYR 16 -0.879 -17.319 -15.140 151 HA TYR 16 HA TYR 16 1.921 -17.510 -15.674 152 HB2 TYR 16 HB2 TYR 16 0.806 -14.923 -14.756 153 HB3 TYR 16 HB1 TYR 16 2.234 -15.499 -13.895 154 HD1 TYR 16 HD1 TYR 16 1.113 -13.719 -16.732 155 HD2 TYR 16 HD2 TYR 16 4.157 -16.467 -15.453 156 HE1 TYR 16 HE1 TYR 16 2.546 -13.015 -18.631 157 HE2 TYR 16 HE2 TYR 16 5.589 -15.764 -17.351 158 HH TYR 16 HH TYR 16 4.384 -13.651 -19.879 159 H LYS 17 H LYS 17 1.376 -19.509 -14.598 160 HA LYS 17 HA LYS 17 0.233 -19.941 -12.169 161 HB2 LYS 17 HB2 LYS 17 2.856 -21.285 -12.594 162 HB3 LYS 17 HB1 LYS 17 1.291 -21.975 -12.159 163 HG2 LYS 17 HG2 LYS 17 1.535 -22.694 -14.373 164 HG3 LYS 17 HG1 LYS 17 0.584 -21.222 -14.567 165 HD2 LYS 17 HD2 LYS 17 2.203 -20.588 -16.022 166 HD3 LYS 17 HD1 LYS 17 3.162 -20.249 -14.581 167 HE2 LYS 17 HE2 LYS 17 3.163 -22.788 -16.231 168 HE3 LYS 17 HE1 LYS 17 4.500 -21.661 -15.998 169 HZ1 LYS 17 HZ1 LYS 17 4.735 -22.296 -13.776 170 HZ2 LYS 17 HZ2 LYS 17 4.509 -23.759 -14.607 171 HZ3 LYS 17 HZ3 LYS 17 3.228 -23.069 -13.730 172 H SER 18 H SER 18 3.071 -18.116 -12.802 173 HA SER 18 HA SER 18 4.180 -18.273 -10.142 174 HB2 SER 18 HB2 SER 18 4.733 -16.090 -12.146 175 HB3 SER 18 HB1 SER 18 5.798 -16.727 -10.896 176 HG SER 18 HG SER 18 6.350 -18.298 -12.186 177 H GLU 19 H GLU 19 2.669 -15.637 -12.011 178 HA GLU 19 HA GLU 19 2.361 -13.749 -10.036 179 HB2 GLU 19 HB2 GLU 19 1.721 -13.539 -12.471 180 HB3 GLU 19 HB1 GLU 19 0.235 -14.402 -12.083 181 HG2 GLU 19 HG2 GLU 19 -0.231 -12.027 -11.987 182 HG3 GLU 19 HG1 GLU 19 -0.250 -12.660 -10.341 183 H CYS 20 H CYS 20 0.982 -16.826 -10.213 184 HA CYS 20 HA CYS 20 -1.363 -16.297 -8.609 185 HB2 CYS 20 HB2 CYS 20 -1.793 -18.143 -9.887 186 HB3 CYS 20 HB1 CYS 20 -0.099 -18.616 -9.953 187 H LEU 21 H LEU 21 1.837 -17.697 -8.153 188 HA LEU 21 HA LEU 21 1.435 -18.274 -5.368 189 HB2 LEU 21 HB2 LEU 21 3.105 -19.494 -6.687 190 HB3 LEU 21 HB1 LEU 21 3.980 -17.992 -6.991 191 HG LEU 21 HG LEU 21 4.230 -17.715 -4.505 192 HD11 LEU 21 HD11 LEU 21 3.937 -20.054 -3.325 193 HD12 LEU 21 HD12 LEU 21 2.784 -20.340 -4.629 194 HD13 LEU 21 HD13 LEU 21 2.546 -18.988 -3.523 195 HD21 LEU 21 HD21 LEU 21 6.238 -18.579 -5.094 196 HD22 LEU 21 HD22 LEU 21 5.499 -19.695 -6.241 197 HD23 LEU 21 HD23 LEU 21 5.621 -20.135 -4.538 198 H LYS 22 H LYS 22 2.745 -15.614 -7.270 199 HA LYS 22 HA LYS 22 3.984 -14.087 -5.311 200 HB2 LYS 22 HB2 LYS 22 3.741 -13.639 -7.849 201 HB3 LYS 22 HB1 LYS 22 2.229 -12.840 -7.418 202 HG2 LYS 22 HG2 LYS 22 3.631 -11.540 -5.683 203 HG3 LYS 22 HG1 LYS 22 5.035 -12.109 -6.586 204 HD2 LYS 22 HD2 LYS 22 3.938 -11.176 -8.675 205 HD3 LYS 22 HD1 LYS 22 2.747 -10.417 -7.618 206 HE2 LYS 22 HE2 LYS 22 4.440 -9.114 -6.513 207 HE3 LYS 22 HE1 LYS 22 5.731 -10.014 -7.308 208 HZ1 LYS 22 HZ1 LYS 22 5.527 -8.820 -9.166 209 HZ2 LYS 22 HZ2 LYS 22 4.701 -7.694 -8.198 210 HZ3 LYS 22 HZ3 LYS 22 3.832 -8.825 -9.121 211 H ALA 23 H ALA 23 0.545 -14.321 -6.153 212 HA ALA 23 HA ALA 23 -0.482 -12.304 -4.536 213 HB1 ALA 23 HB1 ALA 23 -2.407 -14.197 -4.289 214 HB2 ALA 23 HB2 ALA 23 -1.519 -14.839 -5.671 215 HB3 ALA 23 HB3 ALA 23 -2.199 -13.213 -5.737 216 H CYS 24 H CYS 24 0.215 -15.694 -3.741 217 HA CYS 24 HA CYS 24 -0.609 -15.693 -1.068 218 HB2 CYS 24 HB2 CYS 24 1.046 -17.353 -2.782 219 HB3 CYS 24 HB1 CYS 24 1.697 -17.279 -1.144 220 H ALA 25 H ALA 25 2.427 -14.620 -2.531 221 HA ALA 25 HA ALA 25 3.715 -14.075 -0.024 222 HB1 ALA 25 HB1 ALA 25 5.516 -13.947 -1.342 223 HB2 ALA 25 HB2 ALA 25 4.843 -12.543 -2.171 224 HB3 ALA 25 HB3 ALA 25 4.477 -14.170 -2.748 225 H THR 26 H THR 26 2.177 -12.047 -2.519 226 HA THR 26 HA THR 26 2.555 -9.623 -1.020 227 HB THR 26 HB THR 26 0.616 -10.074 -3.294 228 HG1 THR 26 HG1 THR 26 2.297 -9.725 -4.650 229 HG21 THR 26 HG21 THR 26 2.022 -7.567 -3.270 230 HG22 THR 26 HG22 THR 26 1.293 -7.837 -1.686 231 HG23 THR 26 HG23 THR 26 0.288 -7.858 -3.135 232 H SER 27 H SER 27 0.345 -12.195 -0.880 233 HA SER 27 HA SER 27 -2.110 -11.245 -0.280 234 HB2 SER 27 HB2 SER 27 -2.356 -13.077 1.319 235 HB3 SER 27 HB1 SER 27 -1.452 -13.619 -0.090 236 HG SER 27 HG SER 27 0.440 -12.890 1.301 237 H PHE 28 H PHE 28 0.693 -11.145 1.901 238 HA PHE 28 HA PHE 28 -0.825 -9.297 3.643 239 HB2 PHE 28 HB2 PHE 28 0.191 -11.615 4.466 240 HB3 PHE 28 HB1 PHE 28 1.656 -10.642 4.607 241 HD1 PHE 28 HD1 PHE 28 -1.999 -10.512 5.457 242 HD2 PHE 28 HD2 PHE 28 2.003 -9.390 6.548 243 HE1 PHE 28 HE1 PHE 28 -2.849 -9.530 7.570 244 HE2 PHE 28 HE2 PHE 28 1.152 -8.408 8.661 245 HZ PHE 28 HZ PHE 28 -1.274 -8.479 9.171 246 H THR 29 H THR 29 0.958 -7.993 5.013 247 HA THR 29 HA THR 29 2.102 -6.140 3.202 248 HB THR 29 HB THR 29 3.294 -5.341 5.355 249 HG1 THR 29 HG1 THR 29 2.975 -6.487 7.075 250 HG21 THR 29 HG21 THR 29 0.306 -5.515 4.975 251 HG22 THR 29 HG22 THR 29 1.375 -4.154 4.636 252 HG23 THR 29 HG23 THR 29 1.019 -4.601 6.304 253 H GLY 30 H GLY 30 3.779 -8.222 5.574 254 HA2 GLY 30 HA2 GLY 30 6.356 -7.851 4.507 255 HA3 GLY 30 HA1 GLY 30 5.867 -9.191 5.539 256 H GLY 31 H GLY 31 5.542 -8.062 2.168 257 HA2 GLY 31 HA2 GLY 31 4.967 -10.646 1.113 258 HA3 GLY 31 HA1 GLY 31 5.453 -9.233 0.181 259 H ASP 32 H ASP 32 6.741 -11.774 2.309 260 HA ASP 32 HA ASP 32 9.048 -12.052 0.544 261 HB2 ASP 32 HB2 ASP 32 9.327 -11.406 3.487 262 HB3 ASP 32 HB1 ASP 32 10.646 -11.912 2.433 263 H GLU 33 H GLU 33 8.140 -13.065 3.849 264 HA GLU 33 HA GLU 33 7.975 -15.846 2.914 265 HB2 GLU 33 HB2 GLU 33 9.809 -14.816 5.081 266 HB3 GLU 33 HB1 GLU 33 9.341 -16.512 4.956 267 HG2 GLU 33 HG2 GLU 33 10.294 -16.670 2.731 268 HG3 GLU 33 HG1 GLU 33 10.614 -14.937 2.702 269 H SER 34 H SER 34 8.040 -14.143 6.041 270 HA SER 34 HA SER 34 6.473 -15.442 7.671 271 HB2 SER 34 HB2 SER 34 7.160 -12.930 7.750 272 HB3 SER 34 HB1 SER 34 5.545 -12.644 7.107 273 HG SER 34 HG SER 34 6.031 -12.862 9.555 274 H ARG 35 H ARG 35 4.531 -16.365 7.815 275 HA ARG 35 HA ARG 35 2.346 -16.912 7.410 276 HB2 ARG 35 HB2 ARG 35 2.242 -14.658 5.401 277 HB3 ARG 35 HB1 ARG 35 0.900 -15.439 6.228 278 HG2 ARG 35 HG2 ARG 35 1.464 -14.476 8.317 279 HG3 ARG 35 HG1 ARG 35 3.073 -14.016 7.763 280 HD2 ARG 35 HD2 ARG 35 2.047 -12.428 6.157 281 HD3 ARG 35 HD1 ARG 35 0.453 -12.860 6.771 282 HE ARG 35 HE ARG 35 2.451 -11.219 8.123 283 HH11 ARG 35 HH11 ARG 35 1.699 -10.188 10.002 284 HH12 ARG 35 HH12 ARG 35 0.175 -10.650 10.687 285 HH21 ARG 35 HH21 ARG 35 -0.474 -13.062 8.281 286 HH22 ARG 35 HH22 ARG 35 -1.054 -12.278 9.711 287 H ILE 36 H ILE 36 4.843 -16.817 5.195 288 HA ILE 36 HA ILE 36 3.495 -18.852 3.567 289 HB ILE 36 HB ILE 36 5.309 -16.942 2.166 290 HG12 ILE 36 HG12 ILE 36 3.692 -15.498 3.400 291 HG13 ILE 36 HG11 ILE 36 3.436 -15.446 1.657 292 HG21 ILE 36 HG21 ILE 36 4.068 -17.630 0.260 293 HG22 ILE 36 HG22 ILE 36 2.752 -18.259 1.251 294 HG23 ILE 36 HG23 ILE 36 4.304 -19.092 1.217 295 HD11 ILE 36 HD11 ILE 36 1.540 -16.113 3.649 296 HD12 ILE 36 HD12 ILE 36 1.897 -17.606 2.781 297 HD13 ILE 36 HD13 ILE 36 1.332 -16.190 1.902 298 H GLN 37 H GLN 37 6.659 -17.235 3.342 299 HA GLN 37 HA GLN 37 8.795 -18.064 3.510 300 HB2 GLN 37 HB2 GLN 37 7.585 -20.427 4.947 301 HB3 GLN 37 HB1 GLN 37 9.242 -19.838 5.049 302 HG2 GLN 37 HG2 GLN 37 7.588 -17.637 5.690 303 HG3 GLN 37 HG1 GLN 37 6.938 -19.016 6.576 304 HE21 GLN 37 HE21 GLN 37 10.376 -18.636 5.708 305 HE22 GLN 37 HE22 GLN 37 10.927 -18.481 7.306 306 H GLU 38 H GLU 38 6.252 -20.312 2.576 307 HA GLU 38 HA GLU 38 7.649 -21.029 0.177 308 HB2 GLU 38 HB2 GLU 38 7.799 -23.445 0.647 309 HB3 GLU 38 HB1 GLU 38 8.828 -22.509 1.725 310 HG2 GLU 38 HG2 GLU 38 7.106 -22.608 3.480 311 HG3 GLU 38 HG1 GLU 38 6.055 -23.524 2.400 312 H GLY 39 H GLY 39 6.247 -21.758 -1.335 313 HA2 GLY 39 HA2 GLY 39 3.722 -22.950 -0.616 314 HA3 GLY 39 HA1 GLY 39 3.566 -21.305 -1.224 315 H LYS 40 H LYS 40 2.383 -23.417 -2.530 316 HA LYS 40 HA LYS 40 4.078 -23.815 -4.911 317 HB2 LYS 40 HB2 LYS 40 2.036 -25.491 -3.541 318 HB3 LYS 40 HB1 LYS 40 2.106 -25.583 -5.300 319 HG2 LYS 40 HG2 LYS 40 4.581 -25.992 -5.107 320 HG3 LYS 40 HG1 LYS 40 4.372 -26.088 -3.358 321 HD2 LYS 40 HD2 LYS 40 4.303 -28.345 -4.211 322 HD3 LYS 40 HD1 LYS 40 2.658 -27.903 -3.751 323 HE2 LYS 40 HE2 LYS 40 1.926 -27.785 -5.936 324 HE3 LYS 40 HE1 LYS 40 3.512 -27.323 -6.553 325 HZ1 LYS 40 HZ1 LYS 40 3.923 -29.430 -7.026 326 HZ2 LYS 40 HZ2 LYS 40 2.372 -29.865 -6.487 327 HZ3 LYS 40 HZ3 LYS 40 3.686 -29.881 -5.409 328 HA PRO 41 HA PRO 41 0.880 -21.513 -7.031 329 HB2 PRO 41 HB2 PRO 41 1.657 -21.800 -9.547 330 HB3 PRO 41 HB1 PRO 41 2.778 -21.077 -8.371 331 HG2 PRO 41 HG2 PRO 41 2.731 -23.844 -9.480 332 HG3 PRO 41 HG1 PRO 41 4.107 -22.787 -9.139 333 HD2 PRO 41 HD2 PRO 41 3.142 -24.821 -7.433 334 HD3 PRO 41 HD1 PRO 41 4.267 -23.520 -6.983 335 H GLY 42 H GLY 42 -0.871 -21.740 -8.594 336 HA2 GLY 42 HA2 GLY 42 -1.543 -24.362 -9.626 337 HA3 GLY 42 HA1 GLY 42 -2.581 -23.817 -8.310 338 H PHE 43 H PHE 43 -3.448 -24.316 -10.977 339 HA PHE 43 HA PHE 43 -3.707 -21.831 -12.393 340 HB2 PHE 43 HB2 PHE 43 -5.626 -24.065 -12.848 341 HB3 PHE 43 HB1 PHE 43 -4.776 -23.055 -14.017 342 HD1 PHE 43 HD1 PHE 43 -2.548 -23.610 -14.782 343 HD2 PHE 43 HD2 PHE 43 -4.474 -25.953 -11.738 344 HE1 PHE 43 HE1 PHE 43 -0.812 -25.364 -15.031 345 HE2 PHE 43 HE2 PHE 43 -2.738 -27.706 -11.989 346 HZ PHE 43 HZ PHE 43 -0.907 -27.411 -13.636 347 H PHE 44 H PHE 44 -5.351 -20.379 -12.356 348 HA PHE 44 HA PHE 44 -7.051 -19.160 -11.399 349 HB2 PHE 44 HB2 PHE 44 -9.203 -20.323 -11.324 350 HB3 PHE 44 HB1 PHE 44 -8.318 -20.768 -12.782 351 HD1 PHE 44 HD1 PHE 44 -7.534 -23.013 -13.138 352 HD2 PHE 44 HD2 PHE 44 -9.294 -21.888 -9.384 353 HE1 PHE 44 HE1 PHE 44 -7.660 -25.402 -12.482 354 HE2 PHE 44 HE2 PHE 44 -9.421 -24.277 -8.728 355 HZ PHE 44 HZ PHE 44 -8.606 -26.034 -10.278 356 H LYS 45 H LYS 45 -5.162 -20.886 -9.585 357 HA LYS 45 HA LYS 45 -6.349 -20.001 -7.118 358 HB2 LYS 45 HB2 LYS 45 -6.890 -22.015 -6.120 359 HB3 LYS 45 HB1 LYS 45 -7.399 -22.318 -7.781 360 HG2 LYS 45 HG2 LYS 45 -5.087 -23.289 -8.192 361 HG3 LYS 45 HG1 LYS 45 -4.830 -23.206 -6.450 362 HD2 LYS 45 HD2 LYS 45 -7.130 -24.669 -7.778 363 HD3 LYS 45 HD1 LYS 45 -5.656 -25.443 -7.191 364 HE2 LYS 45 HE2 LYS 45 -6.229 -24.243 -4.937 365 HE3 LYS 45 HE1 LYS 45 -7.854 -24.127 -5.615 366 HZ1 LYS 45 HZ1 LYS 45 -6.549 -26.717 -5.820 367 HZ2 LYS 45 HZ2 LYS 45 -8.171 -26.339 -5.485 368 HZ3 LYS 45 HZ3 LYS 45 -7.000 -26.235 -4.259 369 H CYS 46 H CYS 46 -4.963 -20.696 -5.220 370 HA CYS 46 HA CYS 46 -2.200 -21.403 -5.860 371 HB2 CYS 46 HB2 CYS 46 -2.802 -18.796 -4.449 372 HB3 CYS 46 HB1 CYS 46 -1.231 -19.393 -4.993 373 H THR 47 H THR 47 -1.318 -22.547 -4.187 374 HA THR 47 HA THR 47 -2.607 -22.274 -1.541 375 HB THR 47 HB THR 47 -2.275 -24.732 -1.244 376 HG1 THR 47 HG1 THR 47 -1.197 -25.710 -2.735 377 HG21 THR 47 HG21 THR 47 -4.309 -23.328 -2.546 378 HG22 THR 47 HG22 THR 47 -4.424 -24.954 -1.870 379 HG23 THR 47 HG23 THR 47 -4.017 -24.733 -3.572 380 H CYS 48 H CYS 48 -1.100 -21.332 -0.327 381 HA CYS 48 HA CYS 48 1.627 -22.461 -0.413 382 HB2 CYS 48 HB2 CYS 48 2.412 -20.243 0.397 383 HB3 CYS 48 HB1 CYS 48 1.662 -20.162 -1.195 384 H TYR 49 H TYR 49 2.808 -22.284 1.700 385 HA TYR 49 HA TYR 49 0.922 -22.625 3.963 386 HB2 TYR 49 HB2 TYR 49 3.546 -24.080 3.546 387 HB3 TYR 49 HB1 TYR 49 2.399 -24.331 4.860 388 HD1 TYR 49 HD1 TYR 49 2.710 -24.465 1.137 389 HD2 TYR 49 HD2 TYR 49 0.612 -25.848 4.621 390 HE1 TYR 49 HE1 TYR 49 1.466 -26.093 -0.260 391 HE2 TYR 49 HE2 TYR 49 -0.632 -27.476 3.225 392 HH TYR 49 HH TYR 49 -1.293 -27.631 0.726 393 H PHE 50 H PHE 50 1.758 -22.035 6.065 394 HA PHE 50 HA PHE 50 3.787 -19.912 5.860 395 HB2 PHE 50 HB2 PHE 50 1.764 -19.028 6.754 396 HB3 PHE 50 HB1 PHE 50 1.550 -20.406 7.825 397 HD1 PHE 50 HD1 PHE 50 4.788 -18.644 7.247 398 HD2 PHE 50 HD2 PHE 50 1.464 -19.244 9.907 399 HE1 PHE 50 HE1 PHE 50 6.011 -17.461 9.043 400 HE2 PHE 50 HE2 PHE 50 2.693 -18.058 11.703 401 HZ PHE 50 HZ PHE 50 4.966 -17.167 11.272 402 H THR 51 H THR 51 5.725 -20.930 6.155 403 HA THR 51 HA THR 51 6.238 -23.126 7.806 404 HB THR 51 HB THR 51 8.128 -20.878 7.070 405 HG1 THR 51 HG1 THR 51 8.692 -22.697 5.528 406 HG21 THR 51 HG21 THR 51 8.597 -23.714 8.030 407 HG22 THR 51 HG22 THR 51 9.026 -22.231 8.882 408 HG23 THR 51 HG23 THR 51 9.856 -22.661 7.386 409 H THR 52 H THR 52 5.157 -22.849 9.779 410 HA THR 52 HA THR 52 6.405 -20.878 11.599 411 HB THR 52 HB THR 52 3.749 -22.000 12.288 412 HG1 THR 52 HG1 THR 52 3.599 -21.532 10.045 413 HG21 THR 52 HG21 THR 52 4.969 -19.224 12.344 414 HG22 THR 52 HG22 THR 52 4.906 -20.348 13.701 415 HG23 THR 52 HG23 THR 52 3.414 -19.673 13.047 416 H GLY 53 H GLY 53 7.350 -21.651 13.393 417 HA2 GLY 53 HA2 GLY 53 7.562 -24.514 13.738 418 HA3 GLY 53 HA1 GLY 53 8.382 -23.282 14.691 Start of MODEL 15 1 H1 GLU 1 H1 GLU 1 -2.149 -28.548 11.457 2 H2 GLU 1 H2 GLU 1 -2.205 -29.872 12.521 3 H3 GLU 1 H3 GLU 1 -2.466 -30.103 10.857 4 HA GLU 1 HA GLU 1 -0.049 -30.201 12.270 5 HB2 GLU 1 HB2 GLU 1 -1.190 -30.886 9.672 6 HB3 GLU 1 HB1 GLU 1 0.487 -30.358 9.538 7 HG2 GLU 1 HG2 GLU 1 0.487 -32.745 9.925 8 HG3 GLU 1 HG1 GLU 1 1.070 -31.954 11.389 9 H VAL 2 H VAL 2 -0.278 -28.603 9.128 10 HA VAL 2 HA VAL 2 1.083 -26.243 10.273 11 HB VAL 2 HB VAL 2 2.317 -26.156 8.028 12 HG11 VAL 2 HG11 VAL 2 3.894 -26.726 9.545 13 HG12 VAL 2 HG12 VAL 2 3.647 -28.388 9.009 14 HG13 VAL 2 HG13 VAL 2 2.780 -27.776 10.419 15 HG21 VAL 2 HG21 VAL 2 2.636 -28.533 7.103 16 HG22 VAL 2 HG22 VAL 2 1.107 -27.740 6.723 17 HG23 VAL 2 HG23 VAL 2 1.177 -28.956 7.997 18 H ILE 3 H ILE 3 -0.358 -24.661 10.131 19 HA ILE 3 HA ILE 3 -2.605 -24.368 8.666 20 HB ILE 3 HB ILE 3 -2.221 -22.625 10.146 21 HG12 ILE 3 HG12 ILE 3 -1.348 -21.387 7.516 22 HG13 ILE 3 HG11 ILE 3 -3.022 -21.775 7.916 23 HG21 ILE 3 HG21 ILE 3 0.058 -21.238 9.565 24 HG22 ILE 3 HG22 ILE 3 0.545 -22.879 9.138 25 HG23 ILE 3 HG23 ILE 3 -0.033 -22.525 10.766 26 HD11 ILE 3 HD11 ILE 3 -1.700 -19.396 8.525 27 HD12 ILE 3 HD12 ILE 3 -1.714 -20.279 10.052 28 HD13 ILE 3 HD13 ILE 3 -3.229 -19.939 9.215 29 H LYS 4 H LYS 4 -3.130 -23.116 6.726 30 HA LYS 4 HA LYS 4 -1.013 -22.924 4.710 31 HB2 LYS 4 HB2 LYS 4 -2.484 -24.138 3.059 32 HB3 LYS 4 HB1 LYS 4 -1.802 -25.162 4.322 33 HG2 LYS 4 HG2 LYS 4 -3.853 -25.254 5.511 34 HG3 LYS 4 HG1 LYS 4 -4.526 -23.893 4.614 35 HD2 LYS 4 HD2 LYS 4 -4.388 -25.310 2.527 36 HD3 LYS 4 HD1 LYS 4 -3.956 -26.675 3.558 37 HE2 LYS 4 HE2 LYS 4 -6.198 -27.020 3.684 38 HE3 LYS 4 HE1 LYS 4 -6.169 -25.694 4.847 39 HZ1 LYS 4 HZ1 LYS 4 -6.370 -24.215 2.786 40 HZ2 LYS 4 HZ2 LYS 4 -7.756 -25.043 3.313 41 HZ3 LYS 4 HZ3 LYS 4 -6.870 -25.622 1.982 42 H LYS 5 H LYS 5 -1.552 -21.556 2.947 43 HA LYS 5 HA LYS 5 -4.089 -20.074 3.201 44 HB2 LYS 5 HB2 LYS 5 -1.346 -18.819 2.926 45 HB3 LYS 5 HB1 LYS 5 -2.880 -17.950 2.857 46 HG2 LYS 5 HG2 LYS 5 -3.169 -19.362 5.186 47 HG3 LYS 5 HG1 LYS 5 -1.436 -19.030 5.192 48 HD2 LYS 5 HD2 LYS 5 -2.136 -16.599 4.569 49 HD3 LYS 5 HD1 LYS 5 -3.727 -17.077 5.163 50 HE2 LYS 5 HE2 LYS 5 -2.717 -17.751 7.316 51 HE3 LYS 5 HE1 LYS 5 -1.132 -17.251 6.725 52 HZ1 LYS 5 HZ1 LYS 5 -3.004 -15.671 7.980 53 HZ2 LYS 5 HZ2 LYS 5 -3.050 -15.194 6.350 54 HZ3 LYS 5 HZ3 LYS 5 -1.585 -15.153 7.210 55 H ASP 6 H ASP 6 -5.042 -20.676 1.340 56 HA ASP 6 HA ASP 6 -3.481 -20.492 -1.151 57 HB2 ASP 6 HB2 ASP 6 -4.883 -22.127 -2.086 58 HB3 ASP 6 HB1 ASP 6 -4.673 -22.678 -0.425 59 H THR 7 H THR 7 -4.110 -19.163 -2.770 60 HA THR 7 HA THR 7 -6.531 -17.538 -2.287 61 HB THR 7 HB THR 7 -5.328 -15.663 -2.573 62 HG1 THR 7 HG1 THR 7 -4.263 -17.018 -4.818 63 HG21 THR 7 HG21 THR 7 -3.680 -17.049 -1.293 64 HG22 THR 7 HG22 THR 7 -2.924 -15.805 -2.289 65 HG23 THR 7 HG23 THR 7 -2.922 -17.486 -2.824 66 HA PRO 8 HA PRO 8 -7.648 -18.730 -6.433 67 HB2 PRO 8 HB2 PRO 8 -9.489 -16.882 -7.030 68 HB3 PRO 8 HB1 PRO 8 -9.711 -17.957 -5.633 69 HG2 PRO 8 HG2 PRO 8 -8.949 -15.095 -5.711 70 HG3 PRO 8 HG1 PRO 8 -9.862 -15.992 -4.487 71 HD2 PRO 8 HD2 PRO 8 -7.078 -15.330 -4.413 72 HD3 PRO 8 HD1 PRO 8 -7.976 -16.350 -3.269 73 H TYR 9 H TYR 9 -6.820 -18.513 -8.472 74 HA TYR 9 HA TYR 9 -6.442 -16.013 -9.782 75 HB2 TYR 9 HB2 TYR 9 -4.590 -15.654 -8.343 76 HB3 TYR 9 HB1 TYR 9 -4.053 -17.324 -8.494 77 HD1 TYR 9 HD1 TYR 9 -4.134 -14.015 -10.072 78 HD2 TYR 9 HD2 TYR 9 -2.957 -18.117 -10.559 79 HE1 TYR 9 HE1 TYR 9 -2.698 -13.377 -11.987 80 HE2 TYR 9 HE2 TYR 9 -1.516 -17.478 -12.471 81 HH TYR 9 HH TYR 9 -1.480 -15.559 -14.179 82 H LYS 10 H LYS 10 -4.797 -16.412 -11.715 83 HA LYS 10 HA LYS 10 -3.991 -17.857 -13.404 84 HB2 LYS 10 HB2 LYS 10 -4.538 -19.803 -11.765 85 HB3 LYS 10 HB1 LYS 10 -6.055 -19.902 -12.655 86 HG2 LYS 10 HG2 LYS 10 -4.826 -21.302 -13.988 87 HG3 LYS 10 HG1 LYS 10 -4.360 -19.775 -14.739 88 HD2 LYS 10 HD2 LYS 10 -2.304 -19.695 -13.537 89 HD3 LYS 10 HD1 LYS 10 -2.815 -20.972 -12.432 90 HE2 LYS 10 HE2 LYS 10 -1.242 -21.414 -14.603 91 HE3 LYS 10 HE1 LYS 10 -2.306 -22.635 -13.907 92 HZ1 LYS 10 HZ1 LYS 10 -2.523 -21.218 -16.402 93 HZ2 LYS 10 HZ2 LYS 10 -3.969 -21.245 -15.513 94 HZ3 LYS 10 HZ3 LYS 10 -3.202 -22.700 -15.935 95 H LYS 11 H LYS 11 -7.443 -17.840 -12.597 96 HA LYS 11 HA LYS 11 -8.468 -18.040 -15.190 97 HB2 LYS 11 HB2 LYS 11 -10.505 -17.479 -14.259 98 HB3 LYS 11 HB1 LYS 11 -9.627 -17.943 -12.801 99 HG2 LYS 11 HG2 LYS 11 -8.900 -15.398 -12.812 100 HG3 LYS 11 HG1 LYS 11 -10.365 -15.208 -13.776 101 HD2 LYS 11 HD2 LYS 11 -11.176 -14.939 -11.597 102 HD3 LYS 11 HD1 LYS 11 -11.478 -16.651 -11.896 103 HE2 LYS 11 HE2 LYS 11 -8.979 -16.841 -10.934 104 HE3 LYS 11 HE1 LYS 11 -9.471 -15.363 -10.109 105 HZ1 LYS 11 HZ1 LYS 11 -10.422 -18.082 -9.766 106 HZ2 LYS 11 HZ2 LYS 11 -11.622 -16.881 -9.740 107 HZ3 LYS 11 HZ3 LYS 11 -10.326 -16.816 -8.642 108 H ARG 12 H ARG 12 -6.364 -15.793 -14.054 109 HA ARG 12 HA ARG 12 -7.343 -13.717 -15.925 110 HB2 ARG 12 HB2 ARG 12 -6.963 -13.391 -13.239 111 HB3 ARG 12 HB1 ARG 12 -5.394 -12.896 -13.874 112 HG2 ARG 12 HG2 ARG 12 -6.615 -11.411 -15.508 113 HG3 ARG 12 HG1 ARG 12 -8.106 -11.792 -14.645 114 HD2 ARG 12 HD2 ARG 12 -6.337 -11.095 -12.617 115 HD3 ARG 12 HD1 ARG 12 -5.952 -9.960 -13.907 116 HE ARG 12 HE ARG 12 -8.746 -10.051 -13.654 117 HH11 ARG 12 HH11 ARG 12 -9.813 -8.428 -12.479 118 HH12 ARG 12 HH12 ARG 12 -8.939 -7.494 -11.312 119 HH21 ARG 12 HH21 ARG 12 -5.933 -9.135 -11.861 120 HH22 ARG 12 HH22 ARG 12 -6.741 -7.895 -10.960 121 H LYS 13 H LYS 13 -6.141 -13.590 -17.699 122 HA LYS 13 HA LYS 13 -4.332 -13.590 -19.110 123 HB2 LYS 13 HB2 LYS 13 -3.181 -12.873 -16.477 124 HB3 LYS 13 HB1 LYS 13 -2.039 -13.448 -17.692 125 HG2 LYS 13 HG2 LYS 13 -2.760 -11.761 -19.266 126 HG3 LYS 13 HG1 LYS 13 -4.081 -11.271 -18.204 127 HD2 LYS 13 HD2 LYS 13 -2.118 -10.890 -16.469 128 HD3 LYS 13 HD1 LYS 13 -1.143 -10.754 -17.934 129 HE2 LYS 13 HE2 LYS 13 -3.204 -8.923 -16.865 130 HE3 LYS 13 HE1 LYS 13 -1.810 -8.576 -17.889 131 HZ1 LYS 13 HZ1 LYS 13 -4.529 -9.253 -18.629 132 HZ2 LYS 13 HZ2 LYS 13 -3.319 -10.010 -19.549 133 HZ3 LYS 13 HZ3 LYS 13 -3.380 -8.316 -19.453 134 H PHE 14 H PHE 14 -3.042 -15.085 -20.097 135 HA PHE 14 HA PHE 14 -3.329 -17.737 -19.782 136 HB2 PHE 14 HB2 PHE 14 -0.534 -17.104 -20.392 137 HB3 PHE 14 HB1 PHE 14 -1.755 -17.902 -21.387 138 HD1 PHE 14 HD1 PHE 14 -3.727 -16.308 -22.206 139 HD2 PHE 14 HD2 PHE 14 0.185 -14.978 -21.031 140 HE1 PHE 14 HE1 PHE 14 -4.055 -14.213 -23.489 141 HE2 PHE 14 HE2 PHE 14 -0.143 -12.881 -22.316 142 HZ PHE 14 HZ PHE 14 -2.262 -12.499 -23.545 143 HA PRO 15 HA PRO 15 -1.658 -19.569 -16.178 144 HB2 PRO 15 HB2 PRO 15 0.317 -20.918 -17.981 145 HB3 PRO 15 HB1 PRO 15 -0.726 -21.619 -16.729 146 HG2 PRO 15 HG2 PRO 15 -1.285 -21.802 -19.351 147 HG3 PRO 15 HG1 PRO 15 -2.539 -21.721 -18.105 148 HD2 PRO 15 HD2 PRO 15 -1.790 -19.696 -20.110 149 HD3 PRO 15 HD1 PRO 15 -3.272 -19.825 -19.139 150 H TYR 16 H TYR 16 0.097 -19.395 -14.721 151 HA TYR 16 HA TYR 16 2.612 -18.232 -15.611 152 HB2 TYR 16 HB2 TYR 16 0.501 -16.645 -14.295 153 HB3 TYR 16 HB1 TYR 16 2.103 -16.507 -13.568 154 HD1 TYR 16 HD1 TYR 16 -0.012 -15.447 -16.252 155 HD2 TYR 16 HD2 TYR 16 4.097 -16.066 -15.163 156 HE1 TYR 16 HE1 TYR 16 0.702 -13.948 -18.093 157 HE2 TYR 16 HE2 TYR 16 4.811 -14.567 -17.005 158 HH TYR 16 HH TYR 16 3.874 -13.785 -19.203 159 H LYS 17 H LYS 17 0.537 -19.194 -12.907 160 HA LYS 17 HA LYS 17 0.981 -20.444 -11.036 161 HB2 LYS 17 HB2 LYS 17 3.741 -20.902 -12.178 162 HB3 LYS 17 HB1 LYS 17 2.876 -21.893 -11.004 163 HG2 LYS 17 HG2 LYS 17 1.373 -22.716 -12.605 164 HG3 LYS 17 HG1 LYS 17 1.683 -21.386 -13.719 165 HD2 LYS 17 HD2 LYS 17 3.795 -22.257 -14.351 166 HD3 LYS 17 HD1 LYS 17 3.845 -23.355 -12.972 167 HE2 LYS 17 HE2 LYS 17 3.246 -24.373 -15.268 168 HE3 LYS 17 HE1 LYS 17 2.205 -24.786 -13.906 169 HZ1 LYS 17 HZ1 LYS 17 0.540 -23.403 -14.643 170 HZ2 LYS 17 HZ2 LYS 17 1.159 -23.989 -16.112 171 HZ3 LYS 17 HZ3 LYS 17 1.584 -22.437 -15.567 172 H SER 18 H SER 18 3.861 -18.560 -12.003 173 HA SER 18 HA SER 18 4.637 -18.003 -9.303 174 HB2 SER 18 HB2 SER 18 5.647 -17.469 -11.963 175 HB3 SER 18 HB1 SER 18 5.747 -16.026 -10.956 176 HG SER 18 HG SER 18 6.783 -17.334 -9.372 177 H GLU 19 H GLU 19 2.769 -16.312 -11.766 178 HA GLU 19 HA GLU 19 2.518 -13.821 -10.443 179 HB2 GLU 19 HB2 GLU 19 1.965 -14.016 -12.785 180 HB3 GLU 19 HB1 GLU 19 0.738 -15.230 -12.442 181 HG2 GLU 19 HG2 GLU 19 -0.321 -13.049 -12.802 182 HG3 GLU 19 HG1 GLU 19 -0.536 -13.562 -11.130 183 H CYS 20 H CYS 20 0.960 -16.887 -10.076 184 HA CYS 20 HA CYS 20 -1.301 -15.916 -8.577 185 HB2 CYS 20 HB2 CYS 20 -2.014 -18.090 -8.600 186 HB3 CYS 20 HB1 CYS 20 -0.879 -18.173 -9.945 187 H LEU 21 H LEU 21 1.700 -17.638 -7.799 188 HA LEU 21 HA LEU 21 1.330 -17.783 -5.016 189 HB2 LEU 21 HB2 LEU 21 3.075 -18.986 -6.410 190 HB3 LEU 21 HB1 LEU 21 3.982 -17.474 -6.440 191 HG LEU 21 HG LEU 21 3.055 -18.336 -3.765 192 HD11 LEU 21 HD11 LEU 21 5.115 -19.897 -3.677 193 HD12 LEU 21 HD12 LEU 21 5.000 -19.924 -5.438 194 HD13 LEU 21 HD13 LEU 21 3.658 -20.514 -4.458 195 HD21 LEU 21 HD21 LEU 21 5.018 -17.276 -3.084 196 HD22 LEU 21 HD22 LEU 21 4.664 -16.395 -4.571 197 HD23 LEU 21 HD23 LEU 21 5.873 -17.680 -4.573 198 H LYS 22 H LYS 22 2.402 -15.234 -7.138 199 HA LYS 22 HA LYS 22 3.671 -13.524 -5.323 200 HB2 LYS 22 HB2 LYS 22 2.314 -13.232 -7.945 201 HB3 LYS 22 HB1 LYS 22 2.484 -11.761 -6.989 202 HG2 LYS 22 HG2 LYS 22 4.808 -13.634 -7.450 203 HG3 LYS 22 HG1 LYS 22 4.422 -12.337 -8.581 204 HD2 LYS 22 HD2 LYS 22 4.353 -11.194 -5.984 205 HD3 LYS 22 HD1 LYS 22 5.818 -12.171 -6.069 206 HE2 LYS 22 HE2 LYS 22 4.985 -9.914 -7.899 207 HE3 LYS 22 HE1 LYS 22 6.437 -10.024 -6.905 208 HZ1 LYS 22 HZ1 LYS 22 6.599 -12.240 -8.428 209 HZ2 LYS 22 HZ2 LYS 22 7.388 -10.774 -8.763 210 HZ3 LYS 22 HZ3 LYS 22 5.904 -11.133 -9.510 211 H ALA 23 H ALA 23 0.248 -13.595 -6.345 212 HA ALA 23 HA ALA 23 -0.671 -11.572 -4.635 213 HB1 ALA 23 HB1 ALA 23 -2.333 -13.994 -5.285 214 HB2 ALA 23 HB2 ALA 23 -1.906 -12.830 -6.540 215 HB3 ALA 23 HB3 ALA 23 -2.840 -12.312 -5.136 216 H CYS 24 H CYS 24 0.370 -14.776 -3.980 217 HA CYS 24 HA CYS 24 -0.986 -14.955 -1.409 218 HB2 CYS 24 HB2 CYS 24 -0.406 -16.908 -3.027 219 HB3 CYS 24 HB1 CYS 24 1.207 -16.792 -2.323 220 H ALA 25 H ALA 25 2.343 -14.640 -2.629 221 HA ALA 25 HA ALA 25 3.512 -14.404 -0.025 222 HB1 ALA 25 HB1 ALA 25 4.824 -15.171 -1.953 223 HB2 ALA 25 HB2 ALA 25 5.540 -13.719 -1.254 224 HB3 ALA 25 HB3 ALA 25 4.597 -13.610 -2.740 225 H THR 26 H THR 26 2.009 -12.219 -2.253 226 HA THR 26 HA THR 26 3.139 -9.813 -1.145 227 HB THR 26 HB THR 26 0.725 -10.245 -2.921 228 HG1 THR 26 HG1 THR 26 2.162 -9.635 -4.533 229 HG21 THR 26 HG21 THR 26 0.517 -8.127 -1.771 230 HG22 THR 26 HG22 THR 26 1.055 -7.804 -3.419 231 HG23 THR 26 HG23 THR 26 2.209 -7.741 -2.088 232 H SER 27 H SER 27 0.677 -11.978 -0.219 233 HA SER 27 HA SER 27 -1.330 -10.532 0.910 234 HB2 SER 27 HB2 SER 27 -1.746 -12.352 2.279 235 HB3 SER 27 HB1 SER 27 -0.714 -13.093 1.059 236 HG SER 27 HG SER 27 0.803 -11.963 2.949 237 H PHE 28 H PHE 28 2.007 -10.438 1.770 238 HA PHE 28 HA PHE 28 1.357 -8.677 4.058 239 HB2 PHE 28 HB2 PHE 28 2.824 -11.065 4.110 240 HB3 PHE 28 HB1 PHE 28 4.035 -9.785 4.168 241 HD1 PHE 28 HD1 PHE 28 0.551 -10.120 5.535 242 HD2 PHE 28 HD2 PHE 28 4.700 -9.373 6.362 243 HE1 PHE 28 HE1 PHE 28 0.003 -9.705 7.917 244 HE2 PHE 28 HE2 PHE 28 4.150 -8.959 8.745 245 HZ PHE 28 HZ PHE 28 1.802 -9.124 9.523 246 H THR 29 H THR 29 3.609 -7.433 4.576 247 HA THR 29 HA THR 29 3.884 -5.411 2.746 248 HB THR 29 HB THR 29 4.832 -5.362 5.032 249 HG1 THR 29 HG1 THR 29 5.588 -3.937 3.383 250 HG21 THR 29 HG21 THR 29 5.838 -7.758 4.629 251 HG22 THR 29 HG22 THR 29 6.688 -6.617 5.671 252 HG23 THR 29 HG23 THR 29 7.222 -6.859 4.008 253 H GLY 30 H GLY 30 6.095 -4.887 1.624 254 HA2 GLY 30 HA2 GLY 30 6.356 -6.218 -0.714 255 HA3 GLY 30 HA1 GLY 30 7.727 -5.430 0.061 256 H GLY 31 H GLY 31 7.486 -7.306 2.391 257 HA2 GLY 31 HA2 GLY 31 9.427 -9.177 1.677 258 HA3 GLY 31 HA1 GLY 31 8.378 -9.311 3.085 259 H ASP 32 H ASP 32 9.364 -11.379 1.195 260 HA ASP 32 HA ASP 32 6.805 -12.309 0.055 261 HB2 ASP 32 HB2 ASP 32 9.623 -13.250 -0.525 262 HB3 ASP 32 HB1 ASP 32 8.157 -13.809 -1.329 263 H GLU 33 H GLU 33 7.867 -12.471 2.913 264 HA GLU 33 HA GLU 33 7.540 -15.396 3.210 265 HB2 GLU 33 HB2 GLU 33 8.873 -14.307 5.488 266 HB3 GLU 33 HB1 GLU 33 9.482 -15.485 4.325 267 HG2 GLU 33 HG2 GLU 33 10.299 -13.738 2.876 268 HG3 GLU 33 HG1 GLU 33 9.514 -12.495 3.849 269 H SER 34 H SER 34 7.408 -15.349 6.027 270 HA SER 34 HA SER 34 5.849 -15.162 7.707 271 HB2 SER 34 HB2 SER 34 6.608 -12.688 7.268 272 HB3 SER 34 HB1 SER 34 4.991 -12.514 6.593 273 HG SER 34 HG SER 34 5.328 -12.129 8.953 274 H ARG 35 H ARG 35 4.086 -16.375 7.685 275 HA ARG 35 HA ARG 35 1.913 -17.018 7.321 276 HB2 ARG 35 HB2 ARG 35 1.634 -14.783 5.311 277 HB3 ARG 35 HB1 ARG 35 0.369 -15.610 6.210 278 HG2 ARG 35 HG2 ARG 35 0.677 -14.343 8.071 279 HG3 ARG 35 HG1 ARG 35 2.431 -14.340 7.899 280 HD2 ARG 35 HD2 ARG 35 1.381 -12.080 7.583 281 HD3 ARG 35 HD1 ARG 35 2.330 -12.624 6.203 282 HE ARG 35 HE ARG 35 0.381 -12.592 4.959 283 HH11 ARG 35 HH11 ARG 35 -1.865 -12.436 4.668 284 HH12 ARG 35 HH12 ARG 35 -2.917 -12.486 6.042 285 HH21 ARG 35 HH21 ARG 35 -0.340 -12.830 8.335 286 HH22 ARG 35 HH22 ARG 35 -2.054 -12.709 8.118 287 H ILE 36 H ILE 36 4.391 -16.880 5.135 288 HA ILE 36 HA ILE 36 3.175 -18.991 3.523 289 HB ILE 36 HB ILE 36 4.387 -16.502 2.298 290 HG12 ILE 36 HG12 ILE 36 1.995 -16.773 1.118 291 HG13 ILE 36 HG11 ILE 36 1.613 -17.554 2.653 292 HG21 ILE 36 HG21 ILE 36 5.008 -17.911 0.652 293 HG22 ILE 36 HG22 ILE 36 3.288 -18.066 0.293 294 HG23 ILE 36 HG23 ILE 36 4.082 -19.245 1.340 295 HD11 ILE 36 HD11 ILE 36 2.883 -15.392 3.609 296 HD12 ILE 36 HD12 ILE 36 1.156 -15.379 3.253 297 HD13 ILE 36 HD13 ILE 36 2.299 -14.707 2.091 298 H GLN 37 H GLN 37 6.080 -16.980 3.098 299 HA GLN 37 HA GLN 37 8.318 -17.524 3.192 300 HB2 GLN 37 HB2 GLN 37 7.312 -18.759 5.364 301 HB3 GLN 37 HB1 GLN 37 7.827 -20.172 4.442 302 HG2 GLN 37 HG2 GLN 37 9.619 -17.789 4.942 303 HG3 GLN 37 HG1 GLN 37 9.575 -19.199 5.993 304 HE21 GLN 37 HE21 GLN 37 12.009 -18.804 4.858 305 HE22 GLN 37 HE22 GLN 37 12.277 -19.874 3.567 306 H GLU 38 H GLU 38 6.103 -20.171 2.451 307 HA GLU 38 HA GLU 38 7.407 -20.628 -0.088 308 HB2 GLU 38 HB2 GLU 38 7.687 -23.087 0.380 309 HB3 GLU 38 HB1 GLU 38 8.814 -22.031 1.215 310 HG2 GLU 38 HG2 GLU 38 7.028 -22.058 3.128 311 HG3 GLU 38 HG1 GLU 38 6.465 -23.525 2.326 312 H GLY 39 H GLY 39 5.886 -21.023 -1.507 313 HA2 GLY 39 HA2 GLY 39 3.517 -22.561 -0.699 314 HA3 GLY 39 HA1 GLY 39 3.282 -20.988 -1.454 315 H LYS 40 H LYS 40 2.304 -23.443 -2.484 316 HA LYS 40 HA LYS 40 4.007 -23.872 -4.852 317 HB2 LYS 40 HB2 LYS 40 2.424 -25.640 -3.182 318 HB3 LYS 40 HB1 LYS 40 1.952 -25.771 -4.876 319 HG2 LYS 40 HG2 LYS 40 4.130 -26.376 -5.558 320 HG3 LYS 40 HG1 LYS 40 4.855 -25.792 -4.060 321 HD2 LYS 40 HD2 LYS 40 4.037 -27.624 -2.811 322 HD3 LYS 40 HD1 LYS 40 2.857 -28.051 -4.051 323 HE2 LYS 40 HE2 LYS 40 4.487 -28.970 -5.468 324 HE3 LYS 40 HE1 LYS 40 5.801 -28.103 -4.674 325 HZ1 LYS 40 HZ1 LYS 40 4.504 -30.590 -3.929 326 HZ2 LYS 40 HZ2 LYS 40 4.853 -29.533 -2.645 327 HZ3 LYS 40 HZ3 LYS 40 6.098 -30.074 -3.665 328 HA PRO 41 HA PRO 41 0.676 -22.127 -7.221 329 HB2 PRO 41 HB2 PRO 41 1.346 -22.858 -9.681 330 HB3 PRO 41 HB1 PRO 41 2.494 -21.930 -8.692 331 HG2 PRO 41 HG2 PRO 41 2.478 -24.828 -9.349 332 HG3 PRO 41 HG1 PRO 41 3.839 -23.718 -9.150 333 HD2 PRO 41 HD2 PRO 41 2.810 -25.500 -7.177 334 HD3 PRO 41 HD1 PRO 41 4.027 -24.226 -6.934 335 H GLY 42 H GLY 42 -1.124 -22.539 -8.643 336 HA2 GLY 42 HA2 GLY 42 -1.926 -25.257 -9.247 337 HA3 GLY 42 HA1 GLY 42 -2.903 -24.464 -8.012 338 H PHE 43 H PHE 43 -3.884 -25.306 -10.566 339 HA PHE 43 HA PHE 43 -4.118 -22.908 -12.203 340 HB2 PHE 43 HB2 PHE 43 -5.751 -24.442 -13.485 341 HB3 PHE 43 HB1 PHE 43 -4.043 -24.882 -13.492 342 HD1 PHE 43 HD1 PHE 43 -7.386 -25.876 -12.527 343 HD2 PHE 43 HD2 PHE 43 -3.211 -26.615 -11.838 344 HE1 PHE 43 HE1 PHE 43 -7.943 -28.060 -11.492 345 HE2 PHE 43 HE2 PHE 43 -3.768 -28.800 -10.804 346 HZ PHE 43 HZ PHE 43 -6.134 -29.523 -10.631 347 H PHE 44 H PHE 44 -5.728 -21.447 -12.046 348 HA PHE 44 HA PHE 44 -7.779 -20.512 -11.509 349 HB2 PHE 44 HB2 PHE 44 -8.604 -22.916 -12.096 350 HB3 PHE 44 HB1 PHE 44 -8.706 -23.121 -10.346 351 HD1 PHE 44 HD1 PHE 44 -9.817 -20.940 -13.162 352 HD2 PHE 44 HD2 PHE 44 -10.496 -22.189 -9.109 353 HE1 PHE 44 HE1 PHE 44 -11.963 -19.695 -13.138 354 HE2 PHE 44 HE2 PHE 44 -12.640 -20.944 -9.084 355 HZ PHE 44 HZ PHE 44 -13.373 -19.697 -11.098 356 H LYS 45 H LYS 45 -5.403 -21.297 -9.637 357 HA LYS 45 HA LYS 45 -5.932 -19.724 -7.476 358 HB2 LYS 45 HB2 LYS 45 -6.427 -21.622 -5.743 359 HB3 LYS 45 HB1 LYS 45 -7.758 -20.911 -6.653 360 HG2 LYS 45 HG2 LYS 45 -8.179 -22.844 -7.753 361 HG3 LYS 45 HG1 LYS 45 -6.466 -23.141 -8.054 362 HD2 LYS 45 HD2 LYS 45 -6.163 -24.053 -5.836 363 HD3 LYS 45 HD1 LYS 45 -7.798 -23.583 -5.370 364 HE2 LYS 45 HE2 LYS 45 -7.128 -25.559 -7.571 365 HE3 LYS 45 HE1 LYS 45 -7.645 -26.000 -5.944 366 HZ1 LYS 45 HZ1 LYS 45 -9.389 -25.818 -7.814 367 HZ2 LYS 45 HZ2 LYS 45 -9.269 -24.144 -7.552 368 HZ3 LYS 45 HZ3 LYS 45 -9.749 -25.173 -6.288 369 H CYS 46 H CYS 46 -4.769 -20.847 -5.341 370 HA CYS 46 HA CYS 46 -2.523 -22.516 -5.992 371 HB2 CYS 46 HB2 CYS 46 -2.155 -19.542 -5.722 372 HB3 CYS 46 HB1 CYS 46 -0.865 -20.670 -5.300 373 H THR 47 H THR 47 -1.623 -23.383 -4.191 374 HA THR 47 HA THR 47 -2.763 -22.459 -1.622 375 HB THR 47 HB THR 47 -3.151 -24.867 -2.585 376 HG1 THR 47 HG1 THR 47 -2.999 -23.793 -0.170 377 HG21 THR 47 HG21 THR 47 -0.628 -25.128 -2.889 378 HG22 THR 47 HG22 THR 47 -1.451 -26.447 -2.055 379 HG23 THR 47 HG23 THR 47 -0.536 -25.254 -1.133 380 H CYS 48 H CYS 48 -1.454 -21.657 -0.125 381 HA CYS 48 HA CYS 48 1.448 -22.119 -0.414 382 HB2 CYS 48 HB2 CYS 48 0.505 -19.726 1.056 383 HB3 CYS 48 HB1 CYS 48 1.876 -19.910 -0.040 384 H TYR 49 H TYR 49 2.696 -22.133 1.594 385 HA TYR 49 HA TYR 49 1.041 -22.943 3.919 386 HB2 TYR 49 HB2 TYR 49 3.843 -23.927 3.421 387 HB3 TYR 49 HB1 TYR 49 2.602 -24.618 4.464 388 HD1 TYR 49 HD1 TYR 49 4.319 -25.511 1.765 389 HD2 TYR 49 HD2 TYR 49 0.228 -24.678 2.775 390 HE1 TYR 49 HE1 TYR 49 3.563 -26.964 -0.097 391 HE2 TYR 49 HE2 TYR 49 -0.528 -26.132 0.913 392 HH TYR 49 HH TYR 49 0.118 -27.280 -0.902 393 H PHE 50 H PHE 50 1.637 -22.127 5.928 394 HA PHE 50 HA PHE 50 3.584 -19.927 5.810 395 HB2 PHE 50 HB2 PHE 50 1.523 -19.134 6.650 396 HB3 PHE 50 HB1 PHE 50 1.295 -20.553 7.668 397 HD1 PHE 50 HD1 PHE 50 0.983 -19.250 9.706 398 HD2 PHE 50 HD2 PHE 50 4.585 -18.887 7.389 399 HE1 PHE 50 HE1 PHE 50 2.083 -18.075 11.591 400 HE2 PHE 50 HE2 PHE 50 5.678 -17.715 9.273 401 HZ PHE 50 HZ PHE 50 4.430 -17.308 11.376 402 H THR 51 H THR 51 5.559 -20.817 6.146 403 HA THR 51 HA THR 51 6.135 -22.998 7.828 404 HB THR 51 HB THR 51 8.035 -20.752 7.132 405 HG1 THR 51 HG1 THR 51 8.441 -22.012 5.270 406 HG21 THR 51 HG21 THR 51 8.256 -23.336 8.437 407 HG22 THR 51 HG22 THR 51 9.469 -22.069 8.262 408 HG23 THR 51 HG23 THR 51 9.259 -23.270 6.989 409 H THR 52 H THR 52 5.341 -22.867 9.890 410 HA THR 52 HA THR 52 6.236 -20.579 11.534 411 HB THR 52 HB THR 52 4.298 -20.700 12.740 412 HG1 THR 52 HG1 THR 52 3.899 -22.522 13.658 413 HG21 THR 52 HG21 THR 52 2.474 -20.947 11.302 414 HG22 THR 52 HG22 THR 52 3.195 -22.322 10.466 415 HG23 THR 52 HG23 THR 52 3.806 -20.693 10.174 416 H GLY 53 H GLY 53 8.006 -21.035 12.668 417 HA2 GLY 53 HA2 GLY 53 9.470 -22.118 14.077 418 HA3 GLY 53 HA1 GLY 53 8.123 -23.154 14.541 Start of MODEL 16 1 H1 GLU 1 H1 GLU 1 1.776 -27.767 13.224 2 H2 GLU 1 H2 GLU 1 2.195 -27.767 14.871 3 H3 GLU 1 H3 GLU 1 3.354 -27.362 13.697 4 HA GLU 1 HA GLU 1 0.884 -25.804 14.216 5 HB2 GLU 1 HB2 GLU 1 2.787 -24.160 15.056 6 HB3 GLU 1 HB1 GLU 1 2.109 -25.375 16.140 7 HG2 GLU 1 HG2 GLU 1 4.477 -26.059 14.420 8 HG3 GLU 1 HG1 GLU 1 4.711 -25.170 15.924 9 H VAL 2 H VAL 2 0.487 -25.511 12.019 10 HA VAL 2 HA VAL 2 2.170 -23.545 10.719 11 HB VAL 2 HB VAL 2 3.127 -25.854 10.137 12 HG11 VAL 2 HG11 VAL 2 1.928 -27.265 8.694 13 HG12 VAL 2 HG12 VAL 2 0.799 -25.991 8.233 14 HG13 VAL 2 HG13 VAL 2 0.690 -26.731 9.829 15 HG21 VAL 2 HG21 VAL 2 2.149 -23.886 8.054 16 HG22 VAL 2 HG22 VAL 2 3.240 -25.217 7.665 17 HG23 VAL 2 HG23 VAL 2 3.744 -23.965 8.800 18 H ILE 3 H ILE 3 0.973 -22.224 9.450 19 HA ILE 3 HA ILE 3 -1.887 -22.794 9.281 20 HB ILE 3 HB ILE 3 -2.180 -20.562 9.375 21 HG12 ILE 3 HG12 ILE 3 0.048 -20.411 7.327 22 HG13 ILE 3 HG11 ILE 3 -1.672 -20.114 7.079 23 HG21 ILE 3 HG21 ILE 3 -0.469 -19.398 10.533 24 HG22 ILE 3 HG22 ILE 3 0.807 -20.324 9.745 25 HG23 ILE 3 HG23 ILE 3 -0.217 -21.092 10.956 26 HD11 ILE 3 HD11 ILE 3 0.237 -18.421 8.715 27 HD12 ILE 3 HD12 ILE 3 -1.508 -18.166 8.647 28 HD13 ILE 3 HD13 ILE 3 -0.532 -17.972 7.191 29 H LYS 4 H LYS 4 -3.077 -22.710 7.358 30 HA LYS 4 HA LYS 4 -1.493 -23.080 4.883 31 HB2 LYS 4 HB2 LYS 4 -2.462 -25.204 5.571 32 HB3 LYS 4 HB1 LYS 4 -4.052 -24.458 5.733 33 HG2 LYS 4 HG2 LYS 4 -2.973 -23.890 3.117 34 HG3 LYS 4 HG1 LYS 4 -2.941 -25.628 3.411 35 HD2 LYS 4 HD2 LYS 4 -5.275 -25.723 3.800 36 HD3 LYS 4 HD1 LYS 4 -5.392 -23.976 4.020 37 HE2 LYS 4 HE2 LYS 4 -5.660 -23.633 1.807 38 HE3 LYS 4 HE1 LYS 4 -4.271 -24.650 1.420 39 HZ1 LYS 4 HZ1 LYS 4 -5.712 -26.145 0.687 40 HZ2 LYS 4 HZ2 LYS 4 -7.040 -25.267 1.280 41 HZ3 LYS 4 HZ3 LYS 4 -6.232 -26.373 2.284 42 H LYS 5 H LYS 5 -1.711 -21.174 3.844 43 HA LYS 5 HA LYS 5 -4.449 -20.092 3.538 44 HB2 LYS 5 HB2 LYS 5 -3.354 -17.878 3.208 45 HB3 LYS 5 HB1 LYS 5 -3.065 -18.555 4.812 46 HG2 LYS 5 HG2 LYS 5 -0.874 -18.157 4.375 47 HG3 LYS 5 HG1 LYS 5 -0.971 -19.603 3.369 48 HD2 LYS 5 HD2 LYS 5 -0.040 -17.885 1.983 49 HD3 LYS 5 HD1 LYS 5 -1.715 -18.083 1.467 50 HE2 LYS 5 HE2 LYS 5 -1.764 -16.195 3.572 51 HE3 LYS 5 HE1 LYS 5 -0.421 -15.731 2.528 52 HZ1 LYS 5 HZ1 LYS 5 -2.070 -16.101 0.637 53 HZ2 LYS 5 HZ2 LYS 5 -2.256 -14.702 1.582 54 HZ3 LYS 5 HZ3 LYS 5 -3.272 -16.040 1.831 55 H ASP 6 H ASP 6 -5.235 -19.955 1.537 56 HA ASP 6 HA ASP 6 -3.357 -20.230 -0.737 57 HB2 ASP 6 HB2 ASP 6 -5.027 -21.538 -1.899 58 HB3 ASP 6 HB1 ASP 6 -4.744 -22.269 -0.321 59 H THR 7 H THR 7 -3.688 -18.912 -2.505 60 HA THR 7 HA THR 7 -5.749 -16.828 -2.157 61 HB THR 7 HB THR 7 -3.995 -15.435 -2.383 62 HG1 THR 7 HG1 THR 7 -3.369 -16.306 -4.935 63 HG21 THR 7 HG21 THR 7 -2.468 -17.280 -1.822 64 HG22 THR 7 HG22 THR 7 -1.749 -16.219 -3.032 65 HG23 THR 7 HG23 THR 7 -2.431 -17.772 -3.514 66 HA PRO 8 HA PRO 8 -7.345 -18.115 -6.120 67 HB2 PRO 8 HB2 PRO 8 -8.822 -15.992 -6.796 68 HB3 PRO 8 HB1 PRO 8 -9.156 -16.876 -5.292 69 HG2 PRO 8 HG2 PRO 8 -7.847 -14.248 -5.686 70 HG3 PRO 8 HG1 PRO 8 -8.842 -14.827 -4.341 71 HD2 PRO 8 HD2 PRO 8 -5.981 -14.749 -4.452 72 HD3 PRO 8 HD1 PRO 8 -6.993 -15.462 -3.179 73 H TYR 9 H TYR 9 -7.135 -17.907 -8.414 74 HA TYR 9 HA TYR 9 -5.717 -15.641 -9.545 75 HB2 TYR 9 HB2 TYR 9 -3.878 -16.985 -8.630 76 HB3 TYR 9 HB1 TYR 9 -4.456 -18.391 -9.520 77 HD1 TYR 9 HD1 TYR 9 -3.119 -14.939 -9.908 78 HD2 TYR 9 HD2 TYR 9 -3.929 -18.698 -11.820 79 HE1 TYR 9 HE1 TYR 9 -1.818 -14.210 -11.890 80 HE2 TYR 9 HE2 TYR 9 -2.632 -17.970 -13.804 81 HH TYR 9 HH TYR 9 -1.748 -16.116 -14.843 82 H LYS 10 H LYS 10 -7.944 -15.772 -10.506 83 HA LYS 10 HA LYS 10 -8.995 -17.718 -12.093 84 HB2 LYS 10 HB2 LYS 10 -9.986 -15.452 -11.710 85 HB3 LYS 10 HB1 LYS 10 -8.858 -14.807 -12.903 86 HG2 LYS 10 HG2 LYS 10 -10.120 -17.124 -14.021 87 HG3 LYS 10 HG1 LYS 10 -11.374 -16.067 -13.374 88 HD2 LYS 10 HD2 LYS 10 -9.135 -15.065 -15.151 89 HD3 LYS 10 HD1 LYS 10 -10.699 -15.590 -15.778 90 HE2 LYS 10 HE2 LYS 10 -11.376 -13.882 -13.691 91 HE3 LYS 10 HE1 LYS 10 -9.986 -13.094 -14.436 92 HZ1 LYS 10 HZ1 LYS 10 -11.636 -14.066 -16.473 93 HZ2 LYS 10 HZ2 LYS 10 -11.282 -12.449 -16.089 94 HZ3 LYS 10 HZ3 LYS 10 -12.619 -13.221 -15.380 95 H LYS 11 H LYS 11 -7.311 -18.970 -12.989 96 HA LYS 11 HA LYS 11 -5.157 -18.645 -14.398 97 HB2 LYS 11 HB2 LYS 11 -5.913 -20.266 -16.124 98 HB3 LYS 11 HB1 LYS 11 -6.356 -20.762 -14.489 99 HG2 LYS 11 HG2 LYS 11 -8.530 -20.793 -15.061 100 HG3 LYS 11 HG1 LYS 11 -8.446 -19.097 -15.538 101 HD2 LYS 11 HD2 LYS 11 -7.765 -19.675 -17.772 102 HD3 LYS 11 HD1 LYS 11 -7.531 -21.364 -17.325 103 HE2 LYS 11 HE2 LYS 11 -9.814 -21.799 -17.235 104 HE3 LYS 11 HE1 LYS 11 -10.226 -20.116 -16.911 105 HZ1 LYS 11 HZ1 LYS 11 -8.983 -20.097 -19.358 106 HZ2 LYS 11 HZ2 LYS 11 -10.650 -19.936 -19.066 107 HZ3 LYS 11 HZ3 LYS 11 -9.988 -21.463 -19.406 108 H ARG 12 H ARG 12 -4.904 -16.466 -15.051 109 HA ARG 12 HA ARG 12 -6.504 -15.555 -17.338 110 HB2 ARG 12 HB2 ARG 12 -5.087 -13.430 -16.954 111 HB3 ARG 12 HB1 ARG 12 -6.298 -13.840 -15.739 112 HG2 ARG 12 HG2 ARG 12 -4.732 -14.194 -14.147 113 HG3 ARG 12 HG1 ARG 12 -3.719 -15.135 -15.244 114 HD2 ARG 12 HD2 ARG 12 -3.903 -12.140 -15.503 115 HD3 ARG 12 HD1 ARG 12 -2.789 -12.878 -14.358 116 HE ARG 12 HE ARG 12 -2.262 -14.182 -16.702 117 HH11 ARG 12 HH11 ARG 12 -0.735 -13.447 -18.217 118 HH12 ARG 12 HH12 ARG 12 -0.326 -11.766 -18.282 119 HH21 ARG 12 HH21 ARG 12 -2.477 -10.873 -15.711 120 HH22 ARG 12 HH22 ARG 12 -1.315 -10.307 -16.865 121 H LYS 13 H LYS 13 -5.791 -16.271 -19.253 122 HA LYS 13 HA LYS 13 -4.385 -16.793 -20.994 123 HB2 LYS 13 HB2 LYS 13 -3.086 -14.453 -19.661 124 HB3 LYS 13 HB1 LYS 13 -2.201 -15.302 -20.929 125 HG2 LYS 13 HG2 LYS 13 -3.508 -13.470 -21.905 126 HG3 LYS 13 HG1 LYS 13 -4.145 -15.022 -22.447 127 HD2 LYS 13 HD2 LYS 13 -5.993 -14.907 -20.952 128 HD3 LYS 13 HD1 LYS 13 -5.262 -13.592 -20.031 129 HE2 LYS 13 HE2 LYS 13 -5.697 -12.004 -21.705 130 HE3 LYS 13 HE1 LYS 13 -5.871 -13.234 -22.957 131 HZ1 LYS 13 HZ1 LYS 13 -7.735 -13.380 -20.728 132 HZ2 LYS 13 HZ2 LYS 13 -7.994 -13.654 -22.385 133 HZ3 LYS 13 HZ3 LYS 13 -7.934 -12.066 -21.783 134 H PHE 14 H PHE 14 -4.171 -18.879 -19.716 135 HA PHE 14 HA PHE 14 -2.864 -20.641 -19.045 136 HB2 PHE 14 HB2 PHE 14 -1.002 -18.911 -20.591 137 HB3 PHE 14 HB1 PHE 14 -0.288 -20.181 -19.595 138 HD1 PHE 14 HD1 PHE 14 0.440 -21.641 -21.368 139 HD2 PHE 14 HD2 PHE 14 -3.650 -20.354 -21.134 140 HE1 PHE 14 HE1 PHE 14 -0.191 -23.334 -23.068 141 HE2 PHE 14 HE2 PHE 14 -4.283 -22.045 -22.834 142 HZ PHE 14 HZ PHE 14 -2.552 -23.536 -23.802 143 HA PRO 15 HA PRO 15 -1.455 -19.566 -15.018 144 HB2 PRO 15 HB2 PRO 15 -0.075 -21.832 -14.364 145 HB3 PRO 15 HB1 PRO 15 -1.846 -21.761 -14.438 146 HG2 PRO 15 HG2 PRO 15 0.087 -22.849 -16.418 147 HG3 PRO 15 HG1 PRO 15 -1.505 -23.460 -15.938 148 HD2 PRO 15 HD2 PRO 15 -1.062 -22.038 -18.253 149 HD3 PRO 15 HD1 PRO 15 -2.625 -22.077 -17.406 150 H TYR 16 H TYR 16 0.257 -18.526 -14.096 151 HA TYR 16 HA TYR 16 2.795 -18.531 -15.598 152 HB2 TYR 16 HB2 TYR 16 1.218 -16.472 -14.270 153 HB3 TYR 16 HB1 TYR 16 2.898 -16.464 -13.736 154 HD1 TYR 16 HD1 TYR 16 0.649 -16.135 -16.652 155 HD2 TYR 16 HD2 TYR 16 4.708 -15.939 -15.260 156 HE1 TYR 16 HE1 TYR 16 1.324 -15.043 -18.774 157 HE2 TYR 16 HE2 TYR 16 5.382 -14.848 -17.382 158 HH TYR 16 HH TYR 16 4.662 -13.924 -19.282 159 H LYS 17 H LYS 17 1.392 -19.767 -12.811 160 HA LYS 17 HA LYS 17 2.287 -20.948 -11.048 161 HB2 LYS 17 HB2 LYS 17 5.064 -20.375 -12.037 162 HB3 LYS 17 HB1 LYS 17 4.445 -21.816 -11.228 163 HG2 LYS 17 HG2 LYS 17 2.896 -21.929 -13.392 164 HG3 LYS 17 HG1 LYS 17 4.229 -21.017 -14.099 165 HD2 LYS 17 HD2 LYS 17 5.738 -22.837 -12.990 166 HD3 LYS 17 HD1 LYS 17 4.253 -23.787 -12.927 167 HE2 LYS 17 HE2 LYS 17 5.077 -24.408 -15.011 168 HE3 LYS 17 HE1 LYS 17 4.043 -23.050 -15.456 169 HZ1 LYS 17 HZ1 LYS 17 6.052 -22.609 -16.507 170 HZ2 LYS 17 HZ2 LYS 17 6.983 -23.114 -15.179 171 HZ3 LYS 17 HZ3 LYS 17 6.126 -21.649 -15.112 172 H SER 18 H SER 18 4.273 -18.119 -11.911 173 HA SER 18 HA SER 18 4.813 -17.511 -9.129 174 HB2 SER 18 HB2 SER 18 5.567 -16.317 -11.767 175 HB3 SER 18 HB1 SER 18 5.722 -15.342 -10.309 176 HG SER 18 HG SER 18 7.113 -16.837 -9.468 177 H GLU 19 H GLU 19 3.404 -15.541 -11.748 178 HA GLU 19 HA GLU 19 2.277 -13.503 -10.398 179 HB2 GLU 19 HB2 GLU 19 2.054 -14.215 -12.907 180 HB3 GLU 19 HB1 GLU 19 0.535 -14.938 -12.374 181 HG2 GLU 19 HG2 GLU 19 -0.209 -12.811 -12.894 182 HG3 GLU 19 HG1 GLU 19 0.226 -12.572 -11.202 183 H CYS 20 H CYS 20 1.462 -16.815 -10.035 184 HA CYS 20 HA CYS 20 -1.051 -16.208 -8.648 185 HB2 CYS 20 HB2 CYS 20 -0.793 -18.137 -10.305 186 HB3 CYS 20 HB1 CYS 20 0.182 -18.930 -9.068 187 H LEU 21 H LEU 21 2.107 -17.733 -8.061 188 HA LEU 21 HA LEU 21 1.630 -18.162 -5.268 189 HB2 LEU 21 HB2 LEU 21 3.300 -19.471 -6.559 190 HB3 LEU 21 HB1 LEU 21 4.263 -18.007 -6.764 191 HG LEU 21 HG LEU 21 4.234 -17.815 -4.208 192 HD11 LEU 21 HD11 LEU 21 2.904 -19.286 -3.136 193 HD12 LEU 21 HD12 LEU 21 4.065 -20.539 -3.575 194 HD13 LEU 21 HD13 LEU 21 2.667 -20.233 -4.605 195 HD21 LEU 21 HD21 LEU 21 6.051 -19.552 -3.990 196 HD22 LEU 21 HD22 LEU 21 6.249 -18.475 -5.373 197 HD23 LEU 21 HD23 LEU 21 5.633 -20.110 -5.609 198 H LYS 22 H LYS 22 2.830 -15.541 -7.223 199 HA LYS 22 HA LYS 22 4.169 -14.039 -5.254 200 HB2 LYS 22 HB2 LYS 22 3.941 -13.694 -7.856 201 HB3 LYS 22 HB1 LYS 22 2.566 -12.689 -7.396 202 HG2 LYS 22 HG2 LYS 22 3.932 -11.239 -6.087 203 HG3 LYS 22 HG1 LYS 22 5.292 -12.361 -6.127 204 HD2 LYS 22 HD2 LYS 22 5.676 -11.952 -8.460 205 HD3 LYS 22 HD1 LYS 22 4.151 -11.077 -8.620 206 HE2 LYS 22 HE2 LYS 22 6.176 -10.099 -6.638 207 HE3 LYS 22 HE1 LYS 22 6.422 -9.749 -8.349 208 HZ1 LYS 22 HZ1 LYS 22 4.167 -8.819 -8.412 209 HZ2 LYS 22 HZ2 LYS 22 5.175 -7.986 -7.328 210 HZ3 LYS 22 HZ3 LYS 22 4.016 -9.081 -6.742 211 H ALA 23 H ALA 23 0.791 -13.884 -6.389 212 HA ALA 23 HA ALA 23 -0.220 -11.879 -4.824 213 HB1 ALA 23 HB1 ALA 23 -2.312 -13.478 -4.674 214 HB2 ALA 23 HB2 ALA 23 -1.371 -14.472 -5.788 215 HB3 ALA 23 HB3 ALA 23 -1.806 -12.822 -6.231 216 H CYS 24 H CYS 24 0.271 -15.272 -3.873 217 HA CYS 24 HA CYS 24 -0.757 -15.165 -1.288 218 HB2 CYS 24 HB2 CYS 24 0.547 -17.063 -2.787 219 HB3 CYS 24 HB1 CYS 24 1.728 -16.719 -1.523 220 H ALA 25 H ALA 25 2.395 -14.163 -2.520 221 HA ALA 25 HA ALA 25 3.492 -13.579 0.072 222 HB1 ALA 25 HB1 ALA 25 4.958 -12.104 -1.747 223 HB2 ALA 25 HB2 ALA 25 4.368 -13.453 -2.718 224 HB3 ALA 25 HB3 ALA 25 5.305 -13.762 -1.256 225 H THR 26 H THR 26 1.318 -12.011 -2.025 226 HA THR 26 HA THR 26 1.914 -9.339 -0.983 227 HB THR 26 HB THR 26 -0.452 -9.600 -2.677 228 HG1 THR 26 HG1 THR 26 0.962 -10.031 -4.535 229 HG21 THR 26 HG21 THR 26 0.682 -7.476 -2.209 230 HG22 THR 26 HG22 THR 26 0.755 -7.837 -3.934 231 HG23 THR 26 HG23 THR 26 2.172 -8.101 -2.917 232 H SER 27 H SER 27 -0.079 -12.008 -0.295 233 HA SER 27 HA SER 27 -2.490 -11.056 0.536 234 HB2 SER 27 HB2 SER 27 -0.817 -13.293 1.227 235 HB3 SER 27 HB1 SER 27 -1.618 -12.683 2.673 236 HG SER 27 HG SER 27 -2.735 -13.621 0.255 237 H PHE 28 H PHE 28 0.620 -10.566 2.102 238 HA PHE 28 HA PHE 28 -0.698 -8.698 3.981 239 HB2 PHE 28 HB2 PHE 28 0.451 -10.972 4.808 240 HB3 PHE 28 HB1 PHE 28 1.890 -9.954 4.743 241 HD1 PHE 28 HD1 PHE 28 -1.697 -9.622 5.816 242 HD2 PHE 28 HD2 PHE 28 2.431 -8.832 6.704 243 HE1 PHE 28 HE1 PHE 28 -2.361 -8.541 7.948 244 HE2 PHE 28 HE2 PHE 28 1.766 -7.751 8.834 245 HZ PHE 28 HZ PHE 28 -0.631 -7.606 9.457 246 H THR 29 H THR 29 2.682 -9.451 3.132 247 HA THR 29 HA THR 29 3.132 -6.571 2.714 248 HB THR 29 HB THR 29 5.077 -8.844 3.175 249 HG1 THR 29 HG1 THR 29 3.784 -8.019 4.957 250 HG21 THR 29 HG21 THR 29 6.391 -6.434 3.567 251 HG22 THR 29 HG22 THR 29 5.418 -6.135 2.126 252 HG23 THR 29 HG23 THR 29 6.560 -7.478 2.156 253 H GLY 30 H GLY 30 5.478 -8.629 1.385 254 HA2 GLY 30 HA2 GLY 30 4.596 -9.346 -1.113 255 HA3 GLY 30 HA1 GLY 30 5.011 -7.642 -1.271 256 H GLY 31 H GLY 31 6.768 -9.472 1.057 257 HA2 GLY 31 HA2 GLY 31 9.245 -9.033 -0.354 258 HA3 GLY 31 HA1 GLY 31 9.059 -9.816 1.212 259 H ASP 32 H ASP 32 9.213 -11.988 1.321 260 HA ASP 32 HA ASP 32 8.462 -13.774 -0.748 261 HB2 ASP 32 HB2 ASP 32 10.657 -12.616 -1.585 262 HB3 ASP 32 HB1 ASP 32 11.440 -13.704 -0.439 263 H GLU 33 H GLU 33 8.827 -13.145 2.305 264 HA GLU 33 HA GLU 33 9.062 -15.951 3.066 265 HB2 GLU 33 HB2 GLU 33 11.347 -14.483 3.197 266 HB3 GLU 33 HB1 GLU 33 10.662 -14.158 4.789 267 HG2 GLU 33 HG2 GLU 33 10.253 -16.767 4.807 268 HG3 GLU 33 HG1 GLU 33 11.543 -16.767 3.604 269 H SER 34 H SER 34 8.794 -16.060 5.584 270 HA SER 34 HA SER 34 7.360 -15.765 7.351 271 HB2 SER 34 HB2 SER 34 7.253 -12.871 6.496 272 HB3 SER 34 HB1 SER 34 6.977 -13.528 8.106 273 HG SER 34 HG SER 34 9.038 -13.278 8.378 274 H ARG 35 H ARG 35 5.337 -16.432 7.417 275 HA ARG 35 HA ARG 35 3.053 -16.453 7.130 276 HB2 ARG 35 HB2 ARG 35 3.323 -14.362 4.970 277 HB3 ARG 35 HB1 ARG 35 1.909 -14.776 5.928 278 HG2 ARG 35 HG2 ARG 35 2.537 -13.460 7.656 279 HG3 ARG 35 HG1 ARG 35 4.214 -13.993 7.568 280 HD2 ARG 35 HD2 ARG 35 4.760 -12.401 5.917 281 HD3 ARG 35 HD1 ARG 35 3.073 -12.147 5.480 282 HE ARG 35 HE ARG 35 3.024 -11.242 7.969 283 HH11 ARG 35 HH11 ARG 35 3.721 -9.211 8.717 284 HH12 ARG 35 HH12 ARG 35 5.002 -8.385 7.895 285 HH21 ARG 35 HH21 ARG 35 5.438 -10.870 5.516 286 HH22 ARG 35 HH22 ARG 35 5.970 -9.322 6.082 287 H ILE 36 H ILE 36 5.421 -16.782 4.683 288 HA ILE 36 HA ILE 36 3.754 -18.818 3.392 289 HB ILE 36 HB ILE 36 5.341 -17.093 1.557 290 HG12 ILE 36 HG12 ILE 36 3.955 -15.556 3.084 291 HG13 ILE 36 HG11 ILE 36 3.632 -15.430 1.356 292 HG21 ILE 36 HG21 ILE 36 3.372 -17.663 0.099 293 HG22 ILE 36 HG22 ILE 36 2.720 -18.603 1.441 294 HG23 ILE 36 HG23 ILE 36 4.250 -19.071 0.699 295 HD11 ILE 36 HD11 ILE 36 1.517 -16.199 1.583 296 HD12 ILE 36 HD12 ILE 36 1.722 -15.883 3.306 297 HD13 ILE 36 HD13 ILE 36 2.021 -17.497 2.665 298 H GLN 37 H GLN 37 6.874 -17.250 2.687 299 HA GLN 37 HA GLN 37 9.005 -18.098 2.578 300 HB2 GLN 37 HB2 GLN 37 8.406 -18.906 4.898 301 HB3 GLN 37 HB1 GLN 37 7.949 -20.443 4.162 302 HG2 GLN 37 HG2 GLN 37 10.611 -19.330 3.431 303 HG3 GLN 37 HG1 GLN 37 10.424 -19.978 5.057 304 HE21 GLN 37 HE21 GLN 37 10.756 -20.835 1.704 305 HE22 GLN 37 HE22 GLN 37 10.622 -22.514 1.913 306 H GLU 38 H GLU 38 6.397 -20.434 2.053 307 HA GLU 38 HA GLU 38 7.482 -21.157 -0.520 308 HB2 GLU 38 HB2 GLU 38 8.807 -22.591 0.981 309 HB3 GLU 38 HB1 GLU 38 7.324 -23.259 1.651 310 HG2 GLU 38 HG2 GLU 38 6.862 -24.486 -0.237 311 HG3 GLU 38 HG1 GLU 38 7.615 -23.310 -1.313 312 H GLY 39 H GLY 39 5.945 -22.057 -1.846 313 HA2 GLY 39 HA2 GLY 39 3.461 -23.076 -0.756 314 HA3 GLY 39 HA1 GLY 39 3.309 -21.533 -1.589 315 H LYS 40 H LYS 40 1.994 -23.844 -2.410 316 HA LYS 40 HA LYS 40 3.385 -24.554 -4.922 317 HB2 LYS 40 HB2 LYS 40 1.535 -26.088 -3.126 318 HB3 LYS 40 HB1 LYS 40 1.618 -26.479 -4.845 319 HG2 LYS 40 HG2 LYS 40 4.134 -26.632 -4.587 320 HG3 LYS 40 HG1 LYS 40 3.891 -26.511 -2.845 321 HD2 LYS 40 HD2 LYS 40 3.609 -28.750 -2.842 322 HD3 LYS 40 HD1 LYS 40 2.068 -28.466 -3.654 323 HE2 LYS 40 HE2 LYS 40 4.751 -29.013 -4.949 324 HE3 LYS 40 HE1 LYS 40 3.305 -30.020 -5.016 325 HZ1 LYS 40 HZ1 LYS 40 2.332 -27.748 -5.955 326 HZ2 LYS 40 HZ2 LYS 40 3.028 -28.932 -6.954 327 HZ3 LYS 40 HZ3 LYS 40 3.939 -27.582 -6.471 328 HA PRO 41 HA PRO 41 -0.249 -22.325 -6.451 329 HB2 PRO 41 HB2 PRO 41 0.840 -21.259 -8.628 330 HB3 PRO 41 HB1 PRO 41 1.375 -20.733 -7.017 331 HG2 PRO 41 HG2 PRO 41 2.705 -22.567 -8.945 332 HG3 PRO 41 HG1 PRO 41 3.408 -21.354 -7.868 333 HD2 PRO 41 HD2 PRO 41 3.236 -24.130 -7.341 334 HD3 PRO 41 HD1 PRO 41 3.636 -22.856 -6.166 335 H GLY 42 H GLY 42 -1.538 -22.349 -8.403 336 HA2 GLY 42 HA2 GLY 42 -1.087 -24.317 -10.470 337 HA3 GLY 42 HA1 GLY 42 -2.380 -24.747 -9.351 338 H PHE 43 H PHE 43 -2.934 -24.306 -12.047 339 HA PHE 43 HA PHE 43 -3.738 -21.627 -12.586 340 HB2 PHE 43 HB2 PHE 43 -4.674 -22.453 -14.577 341 HB3 PHE 43 HB1 PHE 43 -3.318 -23.535 -14.262 342 HD1 PHE 43 HD1 PHE 43 -4.161 -25.424 -12.329 343 HD2 PHE 43 HD2 PHE 43 -6.504 -23.601 -15.432 344 HE1 PHE 43 HE1 PHE 43 -5.710 -27.360 -12.297 345 HE2 PHE 43 HE2 PHE 43 -8.053 -25.536 -15.399 346 HZ PHE 43 HZ PHE 43 -7.657 -27.416 -13.833 347 H PHE 44 H PHE 44 -5.487 -20.540 -12.000 348 HA PHE 44 HA PHE 44 -7.582 -20.036 -11.214 349 HB2 PHE 44 HB2 PHE 44 -8.292 -21.813 -12.851 350 HB3 PHE 44 HB1 PHE 44 -8.243 -22.963 -11.514 351 HD1 PHE 44 HD1 PHE 44 -9.921 -22.971 -9.800 352 HD2 PHE 44 HD2 PHE 44 -9.871 -19.884 -12.784 353 HE1 PHE 44 HE1 PHE 44 -12.169 -22.227 -9.066 354 HE2 PHE 44 HE2 PHE 44 -12.121 -19.139 -12.051 355 HZ PHE 44 HZ PHE 44 -13.270 -20.310 -10.191 356 H LYS 45 H LYS 45 -5.313 -21.473 -9.568 357 HA LYS 45 HA LYS 45 -6.468 -21.070 -7.043 358 HB2 LYS 45 HB2 LYS 45 -6.528 -23.464 -6.272 359 HB3 LYS 45 HB1 LYS 45 -7.804 -23.028 -7.407 360 HG2 LYS 45 HG2 LYS 45 -6.324 -23.918 -9.261 361 HG3 LYS 45 HG1 LYS 45 -5.254 -24.546 -8.007 362 HD2 LYS 45 HD2 LYS 45 -6.873 -26.061 -7.208 363 HD3 LYS 45 HD1 LYS 45 -8.198 -25.191 -7.980 364 HE2 LYS 45 HE2 LYS 45 -6.138 -26.140 -9.858 365 HE3 LYS 45 HE1 LYS 45 -6.992 -27.433 -9.019 366 HZ1 LYS 45 HZ1 LYS 45 -9.025 -26.744 -9.851 367 HZ2 LYS 45 HZ2 LYS 45 -7.985 -26.520 -11.176 368 HZ3 LYS 45 HZ3 LYS 45 -8.469 -25.189 -10.238 369 H CYS 46 H CYS 46 -4.967 -21.238 -5.379 370 HA CYS 46 HA CYS 46 -2.390 -22.498 -5.875 371 HB2 CYS 46 HB2 CYS 46 -2.769 -19.519 -5.746 372 HB3 CYS 46 HB1 CYS 46 -1.258 -20.263 -5.223 373 H THR 47 H THR 47 -1.859 -23.482 -4.047 374 HA THR 47 HA THR 47 -2.837 -22.358 -1.493 375 HB THR 47 HB THR 47 -2.290 -24.717 -0.653 376 HG1 THR 47 HG1 THR 47 -1.388 -24.886 -3.111 377 HG21 THR 47 HG21 THR 47 -4.516 -23.804 -2.369 378 HG22 THR 47 HG22 THR 47 -4.551 -24.499 -0.748 379 HG23 THR 47 HG23 THR 47 -4.396 -25.551 -2.155 380 H CYS 48 H CYS 48 -1.409 -21.682 -0.001 381 HA CYS 48 HA CYS 48 1.437 -22.359 -0.413 382 HB2 CYS 48 HB2 CYS 48 0.914 -19.800 0.924 383 HB3 CYS 48 HB1 CYS 48 2.061 -20.190 -0.356 384 H TYR 49 H TYR 49 2.765 -22.167 1.577 385 HA TYR 49 HA TYR 49 1.169 -22.605 4.029 386 HB2 TYR 49 HB2 TYR 49 3.429 -24.273 2.932 387 HB3 TYR 49 HB1 TYR 49 3.010 -24.287 4.646 388 HD1 TYR 49 HD1 TYR 49 1.245 -25.635 5.429 389 HD2 TYR 49 HD2 TYR 49 1.525 -24.719 1.242 390 HE1 TYR 49 HE1 TYR 49 -0.611 -27.212 4.959 391 HE2 TYR 49 HE2 TYR 49 -0.330 -26.295 0.772 392 HH TYR 49 HH TYR 49 -1.773 -28.257 3.363 393 H PHE 50 H PHE 50 2.120 -21.865 5.946 394 HA PHE 50 HA PHE 50 4.297 -19.944 5.506 395 HB2 PHE 50 HB2 PHE 50 2.426 -18.910 6.538 396 HB3 PHE 50 HB1 PHE 50 2.211 -20.244 7.665 397 HD1 PHE 50 HD1 PHE 50 2.247 -18.665 9.567 398 HD2 PHE 50 HD2 PHE 50 5.619 -19.066 6.931 399 HE1 PHE 50 HE1 PHE 50 3.684 -17.506 11.220 400 HE2 PHE 50 HE2 PHE 50 7.050 -17.911 8.585 401 HZ PHE 50 HZ PHE 50 6.084 -17.130 10.730 402 H THR 51 H THR 51 6.185 -21.051 5.659 403 HA THR 51 HA THR 51 6.642 -23.171 7.522 404 HB THR 51 HB THR 51 8.675 -21.484 6.043 405 HG1 THR 51 HG1 THR 51 7.162 -22.497 4.667 406 HG21 THR 51 HG21 THR 51 9.121 -24.341 6.711 407 HG22 THR 51 HG22 THR 51 9.163 -23.210 8.063 408 HG23 THR 51 HG23 THR 51 10.261 -22.996 6.700 409 H THR 52 H THR 52 6.019 -22.268 9.553 410 HA THR 52 HA THR 52 7.714 -20.099 10.586 411 HB THR 52 HB THR 52 5.880 -19.491 11.717 412 HG1 THR 52 HG1 THR 52 5.011 -21.600 12.983 413 HG21 THR 52 HG21 THR 52 4.640 -20.497 9.839 414 HG22 THR 52 HG22 THR 52 3.749 -20.658 11.350 415 HG23 THR 52 HG23 THR 52 4.611 -22.044 10.684 416 H GLY 53 H GLY 53 9.473 -20.555 11.719 417 HA2 GLY 53 HA2 GLY 53 9.643 -22.353 13.849 418 HA3 GLY 53 HA1 GLY 53 10.240 -23.191 12.420 Start of MODEL 17 1 H1 GLU 1 H1 GLU 1 -0.558 -30.310 11.262 2 H2 GLU 1 H2 GLU 1 -1.913 -29.865 12.186 3 H3 GLU 1 H3 GLU 1 -0.645 -28.760 11.945 4 HA GLU 1 HA GLU 1 -1.714 -29.726 9.475 5 HB2 GLU 1 HB2 GLU 1 -3.636 -29.467 11.421 6 HB3 GLU 1 HB1 GLU 1 -3.614 -27.849 10.722 7 HG2 GLU 1 HG2 GLU 1 -3.915 -30.435 9.170 8 HG3 GLU 1 HG1 GLU 1 -5.211 -29.296 9.527 9 H VAL 2 H VAL 2 0.544 -28.479 9.721 10 HA VAL 2 HA VAL 2 1.094 -25.942 10.159 11 HB VAL 2 HB VAL 2 2.251 -25.801 7.911 12 HG11 VAL 2 HG11 VAL 2 3.211 -26.860 9.997 13 HG12 VAL 2 HG12 VAL 2 3.866 -27.497 8.488 14 HG13 VAL 2 HG13 VAL 2 2.656 -28.418 9.383 15 HG21 VAL 2 HG21 VAL 2 2.194 -28.285 6.890 16 HG22 VAL 2 HG22 VAL 2 1.077 -27.030 6.355 17 HG23 VAL 2 HG23 VAL 2 0.556 -28.229 7.538 18 H ILE 3 H ILE 3 0.120 -24.044 9.954 19 HA ILE 3 HA ILE 3 -2.259 -23.349 9.045 20 HB ILE 3 HB ILE 3 0.325 -21.903 9.046 21 HG12 ILE 3 HG12 ILE 3 -2.480 -21.231 9.985 22 HG13 ILE 3 HG11 ILE 3 -1.223 -21.972 10.975 23 HG21 ILE 3 HG21 ILE 3 -0.433 -21.188 6.866 24 HG22 ILE 3 HG22 ILE 3 -0.783 -19.888 8.004 25 HG23 ILE 3 HG23 ILE 3 -2.078 -20.955 7.460 26 HD11 ILE 3 HD11 ILE 3 -0.057 -19.679 9.786 27 HD12 ILE 3 HD12 ILE 3 -0.467 -19.915 11.485 28 HD13 ILE 3 HD13 ILE 3 -1.637 -19.182 10.388 29 H LYS 4 H LYS 4 -3.361 -22.910 7.159 30 HA LYS 4 HA LYS 4 -1.995 -23.699 4.656 31 HB2 LYS 4 HB2 LYS 4 -4.324 -24.347 3.885 32 HB3 LYS 4 HB1 LYS 4 -3.631 -25.368 5.145 33 HG2 LYS 4 HG2 LYS 4 -5.308 -24.858 6.555 34 HG3 LYS 4 HG1 LYS 4 -5.010 -23.131 6.347 35 HD2 LYS 4 HD2 LYS 4 -6.340 -23.153 4.264 36 HD3 LYS 4 HD1 LYS 4 -6.649 -24.876 4.484 37 HE2 LYS 4 HE2 LYS 4 -7.843 -24.455 6.555 38 HE3 LYS 4 HE1 LYS 4 -7.414 -22.746 6.501 39 HZ1 LYS 4 HZ1 LYS 4 -9.521 -22.755 5.614 40 HZ2 LYS 4 HZ2 LYS 4 -9.308 -24.239 4.813 41 HZ3 LYS 4 HZ3 LYS 4 -8.570 -22.831 4.212 42 H LYS 5 H LYS 5 -1.543 -21.875 3.589 43 HA LYS 5 HA LYS 5 -3.612 -19.764 3.471 44 HB2 LYS 5 HB2 LYS 5 -1.279 -19.268 4.453 45 HB3 LYS 5 HB1 LYS 5 -0.704 -19.375 2.788 46 HG2 LYS 5 HG2 LYS 5 -1.189 -17.091 3.018 47 HG3 LYS 5 HG1 LYS 5 -2.653 -17.725 2.263 48 HD2 LYS 5 HD2 LYS 5 -3.135 -18.100 4.967 49 HD3 LYS 5 HD1 LYS 5 -2.292 -16.550 4.923 50 HE2 LYS 5 HE2 LYS 5 -4.796 -17.314 3.400 51 HE3 LYS 5 HE1 LYS 5 -4.649 -16.096 4.666 52 HZ1 LYS 5 HZ1 LYS 5 -4.228 -14.644 3.064 53 HZ2 LYS 5 HZ2 LYS 5 -4.133 -15.863 1.884 54 HZ3 LYS 5 HZ3 LYS 5 -2.755 -15.438 2.784 55 H ASP 6 H ASP 6 -4.776 -20.086 1.654 56 HA ASP 6 HA ASP 6 -3.275 -20.417 -0.868 57 HB2 ASP 6 HB2 ASP 6 -5.989 -21.637 -0.383 58 HB3 ASP 6 HB1 ASP 6 -4.864 -21.969 -1.698 59 H THR 7 H THR 7 -3.835 -19.092 -2.498 60 HA THR 7 HA THR 7 -6.129 -17.293 -2.037 61 HB THR 7 HB THR 7 -4.940 -15.541 -2.976 62 HG1 THR 7 HG1 THR 7 -2.853 -16.857 -4.105 63 HG21 THR 7 HG21 THR 7 -3.019 -15.410 -1.719 64 HG22 THR 7 HG22 THR 7 -2.464 -17.011 -2.210 65 HG23 THR 7 HG23 THR 7 -3.718 -16.852 -0.979 66 HA PRO 8 HA PRO 8 -7.642 -18.743 -5.968 67 HB2 PRO 8 HB2 PRO 8 -9.389 -16.819 -6.596 68 HB3 PRO 8 HB1 PRO 8 -9.574 -17.748 -5.094 69 HG2 PRO 8 HG2 PRO 8 -8.633 -14.970 -5.491 70 HG3 PRO 8 HG1 PRO 8 -9.493 -15.689 -4.122 71 HD2 PRO 8 HD2 PRO 8 -6.670 -15.234 -4.341 72 HD3 PRO 8 HD1 PRO 8 -7.533 -16.062 -3.028 73 H TYR 9 H TYR 9 -7.430 -18.576 -8.229 74 HA TYR 9 HA TYR 9 -5.732 -16.347 -9.169 75 HB2 TYR 9 HB2 TYR 9 -4.876 -18.777 -9.235 76 HB3 TYR 9 HB1 TYR 9 -6.024 -19.006 -10.553 77 HD1 TYR 9 HD1 TYR 9 -3.573 -16.350 -9.498 78 HD2 TYR 9 HD2 TYR 9 -5.114 -18.798 -12.675 79 HE1 TYR 9 HE1 TYR 9 -1.978 -15.302 -11.080 80 HE2 TYR 9 HE2 TYR 9 -3.517 -17.749 -14.257 81 HH TYR 9 HH TYR 9 -1.001 -16.458 -13.743 82 H LYS 10 H LYS 10 -7.984 -18.692 -10.650 83 HA LYS 10 HA LYS 10 -9.484 -18.422 -12.382 84 HB2 LYS 10 HB2 LYS 10 -10.100 -15.880 -10.857 85 HB3 LYS 10 HB1 LYS 10 -11.174 -16.717 -11.979 86 HG2 LYS 10 HG2 LYS 10 -11.914 -18.003 -10.291 87 HG3 LYS 10 HG1 LYS 10 -10.282 -18.642 -10.081 88 HD2 LYS 10 HD2 LYS 10 -10.851 -17.702 -7.973 89 HD3 LYS 10 HD1 LYS 10 -9.793 -16.514 -8.734 90 HE2 LYS 10 HE2 LYS 10 -11.710 -15.351 -7.796 91 HE3 LYS 10 HE1 LYS 10 -11.831 -15.307 -9.555 92 HZ1 LYS 10 HZ1 LYS 10 -13.936 -15.910 -8.512 93 HZ2 LYS 10 HZ2 LYS 10 -13.203 -17.262 -7.789 94 HZ3 LYS 10 HZ3 LYS 10 -13.345 -17.171 -9.480 95 H LYS 11 H LYS 11 -6.792 -16.682 -12.270 96 HA LYS 11 HA LYS 11 -7.270 -14.485 -14.001 97 HB2 LYS 11 HB2 LYS 11 -5.065 -15.579 -12.620 98 HB3 LYS 11 HB1 LYS 11 -4.616 -15.566 -14.325 99 HG2 LYS 11 HG2 LYS 11 -3.978 -13.428 -13.474 100 HG3 LYS 11 HG1 LYS 11 -5.458 -13.157 -14.395 101 HD2 LYS 11 HD2 LYS 11 -6.595 -12.502 -12.557 102 HD3 LYS 11 HD1 LYS 11 -5.996 -13.864 -11.609 103 HE2 LYS 11 HE2 LYS 11 -5.277 -11.551 -10.802 104 HE3 LYS 11 HE1 LYS 11 -3.975 -12.713 -11.057 105 HZ1 LYS 11 HZ1 LYS 11 -3.255 -11.644 -12.920 106 HZ2 LYS 11 HZ2 LYS 11 -3.851 -10.312 -12.048 107 HZ3 LYS 11 HZ3 LYS 11 -4.779 -11.001 -13.294 108 H ARG 12 H ARG 12 -5.179 -17.190 -14.898 109 HA ARG 12 HA ARG 12 -5.069 -18.481 -16.799 110 HB2 ARG 12 HB2 ARG 12 -7.673 -18.512 -16.323 111 HB3 ARG 12 HB1 ARG 12 -7.724 -17.495 -17.764 112 HG2 ARG 12 HG2 ARG 12 -7.687 -19.436 -18.931 113 HG3 ARG 12 HG1 ARG 12 -5.978 -19.513 -18.502 114 HD2 ARG 12 HD2 ARG 12 -6.585 -20.749 -16.430 115 HD3 ARG 12 HD1 ARG 12 -8.272 -20.728 -16.936 116 HE ARG 12 HE ARG 12 -6.548 -21.854 -18.942 117 HH11 ARG 12 HH11 ARG 12 -6.738 -24.093 -19.286 118 HH12 ARG 12 HH12 ARG 12 -7.533 -25.080 -18.105 119 HH21 ARG 12 HH21 ARG 12 -8.228 -22.435 -15.973 120 HH22 ARG 12 HH22 ARG 12 -8.376 -24.142 -16.229 121 H LYS 13 H LYS 13 -6.095 -15.158 -16.967 122 HA LYS 13 HA LYS 13 -5.643 -14.669 -19.710 123 HB2 LYS 13 HB2 LYS 13 -6.742 -13.167 -17.884 124 HB3 LYS 13 HB1 LYS 13 -5.094 -12.612 -17.591 125 HG2 LYS 13 HG2 LYS 13 -5.814 -11.098 -19.215 126 HG3 LYS 13 HG1 LYS 13 -5.023 -12.328 -20.202 127 HD2 LYS 13 HD2 LYS 13 -7.596 -13.315 -19.932 128 HD3 LYS 13 HD1 LYS 13 -7.853 -11.576 -20.082 129 HE2 LYS 13 HE2 LYS 13 -6.072 -13.143 -21.962 130 HE3 LYS 13 HE1 LYS 13 -7.780 -12.843 -22.283 131 HZ1 LYS 13 HZ1 LYS 13 -7.211 -10.417 -21.892 132 HZ2 LYS 13 HZ2 LYS 13 -6.654 -11.113 -23.339 133 HZ3 LYS 13 HZ3 LYS 13 -5.585 -10.877 -22.039 134 H PHE 14 H PHE 14 -3.501 -15.179 -17.057 135 HA PHE 14 HA PHE 14 -1.211 -14.597 -18.824 136 HB2 PHE 14 HB2 PHE 14 -1.643 -13.737 -15.975 137 HB3 PHE 14 HB1 PHE 14 -0.015 -13.939 -16.625 138 HD1 PHE 14 HD1 PHE 14 0.163 -12.926 -19.172 139 HD2 PHE 14 HD2 PHE 14 -2.476 -11.568 -16.067 140 HE1 PHE 14 HE1 PHE 14 -0.010 -10.719 -20.285 141 HE2 PHE 14 HE2 PHE 14 -2.648 -9.359 -17.179 142 HZ PHE 14 HZ PHE 14 -1.416 -8.934 -19.290 143 HA PRO 15 HA PRO 15 -1.287 -19.059 -17.443 144 HB2 PRO 15 HB2 PRO 15 0.593 -18.999 -19.768 145 HB3 PRO 15 HB1 PRO 15 -0.669 -20.180 -19.369 146 HG2 PRO 15 HG2 PRO 15 -0.994 -18.323 -21.275 147 HG3 PRO 15 HG1 PRO 15 -2.334 -18.913 -20.278 148 HD2 PRO 15 HD2 PRO 15 -0.987 -16.277 -20.221 149 HD3 PRO 15 HD1 PRO 15 -2.606 -16.728 -19.649 150 H TYR 16 H TYR 16 -0.137 -18.133 -15.541 151 HA TYR 16 HA TYR 16 2.635 -18.979 -15.542 152 HB2 TYR 16 HB2 TYR 16 1.839 -16.094 -15.221 153 HB3 TYR 16 HB1 TYR 16 3.298 -16.729 -14.459 154 HD1 TYR 16 HD1 TYR 16 1.668 -15.881 -17.634 155 HD2 TYR 16 HD2 TYR 16 5.157 -17.609 -15.819 156 HE1 TYR 16 HE1 TYR 16 2.875 -15.713 -19.794 157 HE2 TYR 16 HE2 TYR 16 6.364 -17.441 -17.979 158 HH TYR 16 HH TYR 16 5.248 -17.296 -20.702 159 H LYS 17 H LYS 17 1.866 -20.506 -14.060 160 HA LYS 17 HA LYS 17 0.305 -20.171 -11.836 161 HB2 LYS 17 HB2 LYS 17 2.792 -21.798 -11.530 162 HB3 LYS 17 HB1 LYS 17 1.132 -22.189 -11.084 163 HG2 LYS 17 HG2 LYS 17 0.577 -22.312 -13.535 164 HG3 LYS 17 HG1 LYS 17 2.298 -22.128 -13.879 165 HD2 LYS 17 HD2 LYS 17 2.207 -24.140 -11.949 166 HD3 LYS 17 HD1 LYS 17 0.837 -24.494 -13.002 167 HE2 LYS 17 HE2 LYS 17 2.447 -24.164 -14.965 168 HE3 LYS 17 HE1 LYS 17 3.747 -24.209 -13.772 169 HZ1 LYS 17 HZ1 LYS 17 2.484 -26.363 -14.948 170 HZ2 LYS 17 HZ2 LYS 17 1.932 -26.337 -13.342 171 HZ3 LYS 17 HZ3 LYS 17 3.597 -26.402 -13.671 172 H SER 18 H SER 18 3.471 -18.883 -12.385 173 HA SER 18 HA SER 18 4.096 -18.424 -9.608 174 HB2 SER 18 HB2 SER 18 6.051 -18.500 -10.817 175 HB3 SER 18 HB1 SER 18 5.336 -17.732 -12.232 176 HG SER 18 HG SER 18 6.104 -16.540 -9.774 177 H GLU 19 H GLU 19 2.387 -16.729 -12.119 178 HA GLU 19 HA GLU 19 2.498 -14.106 -11.038 179 HB2 GLU 19 HB2 GLU 19 1.766 -14.589 -13.346 180 HB3 GLU 19 HB1 GLU 19 0.338 -15.407 -12.720 181 HG2 GLU 19 HG2 GLU 19 -0.341 -13.178 -13.292 182 HG3 GLU 19 HG1 GLU 19 -0.257 -13.251 -11.533 183 H CYS 20 H CYS 20 0.778 -16.952 -10.194 184 HA CYS 20 HA CYS 20 -1.280 -15.602 -8.672 185 HB2 CYS 20 HB2 CYS 20 -2.175 -17.708 -8.309 186 HB3 CYS 20 HB1 CYS 20 -1.319 -17.974 -9.823 187 H LEU 21 H LEU 21 1.467 -17.727 -7.851 188 HA LEU 21 HA LEU 21 1.409 -17.603 -5.114 189 HB2 LEU 21 HB2 LEU 21 3.063 -18.889 -6.482 190 HB3 LEU 21 HB1 LEU 21 3.922 -17.381 -6.793 191 HG LEU 21 HG LEU 21 3.949 -17.119 -4.207 192 HD11 LEU 21 HD11 LEU 21 2.447 -19.455 -4.385 193 HD12 LEU 21 HD12 LEU 21 3.225 -18.839 -2.927 194 HD13 LEU 21 HD13 LEU 21 4.052 -20.029 -3.935 195 HD21 LEU 21 HD21 LEU 21 5.847 -19.077 -4.280 196 HD22 LEU 21 HD22 LEU 21 6.081 -17.465 -4.955 197 HD23 LEU 21 HD23 LEU 21 5.602 -18.798 -6.004 198 H LYS 22 H LYS 22 2.582 -15.172 -7.386 199 HA LYS 22 HA LYS 22 3.811 -13.388 -5.637 200 HB2 LYS 22 HB2 LYS 22 3.820 -13.091 -8.082 201 HB3 LYS 22 HB1 LYS 22 2.091 -12.749 -8.049 202 HG2 LYS 22 HG2 LYS 22 3.261 -11.039 -6.124 203 HG3 LYS 22 HG1 LYS 22 4.291 -10.950 -7.553 204 HD2 LYS 22 HD2 LYS 22 2.480 -10.282 -8.946 205 HD3 LYS 22 HD1 LYS 22 1.283 -10.727 -7.730 206 HE2 LYS 22 HE2 LYS 22 3.362 -8.607 -7.190 207 HE3 LYS 22 HE1 LYS 22 1.830 -8.217 -7.971 208 HZ1 LYS 22 HZ1 LYS 22 0.641 -9.069 -6.100 209 HZ2 LYS 22 HZ2 LYS 22 1.792 -7.957 -5.530 210 HZ3 LYS 22 HZ3 LYS 22 2.067 -9.626 -5.370 211 H ALA 23 H ALA 23 0.420 -13.914 -6.395 212 HA ALA 23 HA ALA 23 -0.614 -11.714 -4.913 213 HB1 ALA 23 HB1 ALA 23 -2.497 -12.396 -5.913 214 HB2 ALA 23 HB2 ALA 23 -2.484 -13.878 -4.956 215 HB3 ALA 23 HB3 ALA 23 -1.655 -13.826 -6.511 216 H CYS 24 H CYS 24 0.394 -14.951 -4.079 217 HA CYS 24 HA CYS 24 -0.829 -14.902 -1.451 218 HB2 CYS 24 HB2 CYS 24 -0.227 -16.970 -2.969 219 HB3 CYS 24 HB1 CYS 24 1.355 -16.812 -2.203 220 H ALA 25 H ALA 25 2.442 -14.596 -2.807 221 HA ALA 25 HA ALA 25 3.818 -14.319 -0.360 222 HB1 ALA 25 HB1 ALA 25 4.460 -13.245 -3.117 223 HB2 ALA 25 HB2 ALA 25 5.032 -14.756 -2.410 224 HB3 ALA 25 HB3 ALA 25 5.578 -13.214 -1.753 225 H THR 26 H THR 26 1.646 -12.254 -1.964 226 HA THR 26 HA THR 26 2.665 -9.831 -0.665 227 HB THR 26 HB THR 26 0.274 -10.163 -2.490 228 HG1 THR 26 HG1 THR 26 2.932 -9.349 -3.049 229 HG21 THR 26 HG21 THR 26 0.934 -7.648 -2.832 230 HG22 THR 26 HG22 THR 26 1.730 -7.837 -1.270 231 HG23 THR 26 HG23 THR 26 -0.007 -8.110 -1.414 232 H SER 27 H SER 27 0.439 -12.344 -0.145 233 HA SER 27 HA SER 27 -1.763 -11.339 1.069 234 HB2 SER 27 HB2 SER 27 -1.074 -13.768 0.926 235 HB3 SER 27 HB1 SER 27 -0.081 -13.496 2.355 236 HG SER 27 HG SER 27 -1.869 -13.134 3.538 237 H PHE 28 H PHE 28 1.395 -11.730 2.686 238 HA PHE 28 HA PHE 28 0.456 -9.894 4.799 239 HB2 PHE 28 HB2 PHE 28 1.222 -12.127 5.550 240 HB3 PHE 28 HB1 PHE 28 2.802 -11.808 4.834 241 HD1 PHE 28 HD1 PHE 28 0.339 -10.387 7.267 242 HD2 PHE 28 HD2 PHE 28 4.454 -10.694 6.077 243 HE1 PHE 28 HE1 PHE 28 1.023 -9.171 9.316 244 HE2 PHE 28 HE2 PHE 28 5.138 -9.477 8.126 245 HZ PHE 28 HZ PHE 28 3.422 -8.715 9.746 246 H THR 29 H THR 29 2.563 -8.789 5.830 247 HA THR 29 HA THR 29 4.226 -7.691 3.656 248 HB THR 29 HB THR 29 2.749 -6.048 5.728 249 HG1 THR 29 HG1 THR 29 1.577 -5.342 4.000 250 HG21 THR 29 HG21 THR 29 4.567 -5.177 3.467 251 HG22 THR 29 HG22 THR 29 5.035 -5.217 5.167 252 HG23 THR 29 HG23 THR 29 3.759 -4.124 4.629 253 H GLY 30 H GLY 30 6.284 -8.011 4.193 254 HA2 GLY 30 HA2 GLY 30 7.437 -7.093 6.607 255 HA3 GLY 30 HA1 GLY 30 7.213 -8.837 6.699 256 H GLY 31 H GLY 31 7.567 -9.064 3.734 257 HA2 GLY 31 HA2 GLY 31 9.775 -8.185 2.536 258 HA3 GLY 31 HA1 GLY 31 10.483 -9.221 3.772 259 H ASP 32 H ASP 32 10.655 -11.351 3.371 260 HA ASP 32 HA ASP 32 9.342 -12.377 0.933 261 HB2 ASP 32 HB2 ASP 32 11.996 -12.864 2.195 262 HB3 ASP 32 HB1 ASP 32 11.231 -14.205 1.343 263 H GLU 33 H GLU 33 10.793 -14.057 3.707 264 HA GLU 33 HA GLU 33 8.593 -15.924 3.777 265 HB2 GLU 33 HB2 GLU 33 9.897 -16.736 5.865 266 HB3 GLU 33 HB1 GLU 33 10.650 -16.925 4.283 267 HG2 GLU 33 HG2 GLU 33 11.234 -14.306 5.374 268 HG3 GLU 33 HG1 GLU 33 11.713 -15.568 6.508 269 H SER 34 H SER 34 6.719 -15.317 4.598 270 HA SER 34 HA SER 34 6.347 -14.742 7.309 271 HB2 SER 34 HB2 SER 34 7.361 -12.548 6.688 272 HB3 SER 34 HB1 SER 34 6.052 -12.305 5.535 273 HG SER 34 HG SER 34 5.540 -12.919 8.242 274 H ARG 35 H ARG 35 4.674 -16.137 7.218 275 HA ARG 35 HA ARG 35 2.380 -16.547 7.111 276 HB2 ARG 35 HB2 ARG 35 2.368 -13.963 6.256 277 HB3 ARG 35 HB1 ARG 35 1.835 -14.799 4.794 278 HG2 ARG 35 HG2 ARG 35 -0.181 -14.452 5.935 279 HG3 ARG 35 HG1 ARG 35 0.252 -16.087 6.439 280 HD2 ARG 35 HD2 ARG 35 1.516 -14.888 8.381 281 HD3 ARG 35 HD1 ARG 35 0.487 -13.516 7.981 282 HE ARG 35 HE ARG 35 -1.143 -15.798 8.235 283 HH11 ARG 35 HH11 ARG 35 -2.305 -16.108 10.163 284 HH12 ARG 35 HH12 ARG 35 -1.796 -15.309 11.612 285 HH21 ARG 35 HH21 ARG 35 0.899 -13.728 10.110 286 HH22 ARG 35 HH22 ARG 35 0.018 -13.961 11.583 287 H ILE 36 H ILE 36 4.783 -16.780 4.828 288 HA ILE 36 HA ILE 36 3.382 -18.975 3.491 289 HB ILE 36 HB ILE 36 4.894 -16.906 1.885 290 HG12 ILE 36 HG12 ILE 36 2.395 -16.598 1.011 291 HG13 ILE 36 HG11 ILE 36 2.006 -17.111 2.651 292 HG21 ILE 36 HG21 ILE 36 3.574 -18.110 0.040 293 HG22 ILE 36 HG22 ILE 36 3.254 -19.357 1.246 294 HG23 ILE 36 HG23 ILE 36 4.914 -18.996 0.770 295 HD11 ILE 36 HD11 ILE 36 3.760 -14.772 1.857 296 HD12 ILE 36 HD12 ILE 36 3.542 -15.333 3.513 297 HD13 ILE 36 HD13 ILE 36 2.170 -14.688 2.617 298 H GLN 37 H GLN 37 6.447 -17.226 2.937 299 HA GLN 37 HA GLN 37 8.626 -17.945 2.969 300 HB2 GLN 37 HB2 GLN 37 8.403 -18.421 5.289 301 HB3 GLN 37 HB1 GLN 37 7.434 -19.859 4.977 302 HG2 GLN 37 HG2 GLN 37 9.252 -21.134 4.403 303 HG3 GLN 37 HG1 GLN 37 10.134 -19.765 3.733 304 HE21 GLN 37 HE21 GLN 37 10.279 -21.908 6.253 305 HE22 GLN 37 HE22 GLN 37 11.077 -20.943 7.400 306 H GLU 38 H GLU 38 6.106 -20.297 2.388 307 HA GLU 38 HA GLU 38 7.441 -21.291 0.067 308 HB2 GLU 38 HB2 GLU 38 8.614 -22.582 1.814 309 HB3 GLU 38 HB1 GLU 38 7.067 -23.215 2.366 310 HG2 GLU 38 HG2 GLU 38 7.286 -24.856 0.841 311 HG3 GLU 38 HG1 GLU 38 7.082 -23.631 -0.410 312 H GLY 39 H GLY 39 5.977 -21.948 -1.327 313 HA2 GLY 39 HA2 GLY 39 3.443 -23.093 -0.487 314 HA3 GLY 39 HA1 GLY 39 3.324 -21.495 -1.215 315 H LYS 40 H LYS 40 2.055 -23.638 -2.354 316 HA LYS 40 HA LYS 40 3.686 -24.224 -4.744 317 HB2 LYS 40 HB2 LYS 40 1.499 -25.790 -3.389 318 HB3 LYS 40 HB1 LYS 40 1.993 -26.118 -5.051 319 HG2 LYS 40 HG2 LYS 40 4.100 -25.924 -2.928 320 HG3 LYS 40 HG1 LYS 40 3.142 -27.400 -3.046 321 HD2 LYS 40 HD2 LYS 40 3.722 -27.469 -5.509 322 HD3 LYS 40 HD1 LYS 40 4.857 -26.152 -5.207 323 HE2 LYS 40 HE2 LYS 40 4.898 -28.831 -3.788 324 HE3 LYS 40 HE1 LYS 40 5.964 -28.380 -5.118 325 HZ1 LYS 40 HZ1 LYS 40 7.298 -27.609 -3.527 326 HZ2 LYS 40 HZ2 LYS 40 6.078 -27.639 -2.344 327 HZ3 LYS 40 HZ3 LYS 40 6.216 -26.310 -3.392 328 HA PRO 41 HA PRO 41 0.387 -21.868 -6.723 329 HB2 PRO 41 HB2 PRO 41 1.546 -21.458 -9.064 330 HB3 PRO 41 HB1 PRO 41 2.307 -20.811 -7.594 331 HG2 PRO 41 HG2 PRO 41 3.013 -23.245 -9.172 332 HG3 PRO 41 HG1 PRO 41 4.072 -22.030 -8.439 333 HD2 PRO 41 HD2 PRO 41 3.406 -24.507 -7.281 334 HD3 PRO 41 HD1 PRO 41 4.103 -23.106 -6.430 335 H GLY 42 H GLY 42 -1.003 -22.045 -8.601 336 HA2 GLY 42 HA2 GLY 42 -1.036 -24.400 -10.253 337 HA3 GLY 42 HA1 GLY 42 -2.303 -24.387 -9.027 338 H PHE 43 H PHE 43 -2.992 -24.373 -11.707 339 HA PHE 43 HA PHE 43 -3.516 -21.627 -12.521 340 HB2 PHE 43 HB2 PHE 43 -4.789 -22.908 -14.397 341 HB3 PHE 43 HB1 PHE 43 -3.028 -22.967 -14.368 342 HD1 PHE 43 HD1 PHE 43 -1.917 -24.938 -13.122 343 HD2 PHE 43 HD2 PHE 43 -6.048 -24.894 -14.295 344 HE1 PHE 43 HE1 PHE 43 -1.999 -27.411 -12.926 345 HE2 PHE 43 HE2 PHE 43 -6.132 -27.365 -14.097 346 HZ PHE 43 HZ PHE 43 -4.108 -28.623 -13.413 347 H PHE 44 H PHE 44 -5.311 -20.524 -12.066 348 HA PHE 44 HA PHE 44 -7.587 -20.135 -11.705 349 HB2 PHE 44 HB2 PHE 44 -7.814 -22.527 -12.787 350 HB3 PHE 44 HB1 PHE 44 -8.091 -23.027 -11.120 351 HD1 PHE 44 HD1 PHE 44 -9.215 -20.530 -13.674 352 HD2 PHE 44 HD2 PHE 44 -10.211 -22.760 -10.139 353 HE1 PHE 44 HE1 PHE 44 -11.553 -19.714 -13.816 354 HE2 PHE 44 HE2 PHE 44 -12.548 -21.943 -10.282 355 HZ PHE 44 HZ PHE 44 -13.219 -20.420 -12.120 356 H LYS 45 H LYS 45 -5.256 -21.318 -9.748 357 HA LYS 45 HA LYS 45 -6.263 -20.225 -7.377 358 HB2 LYS 45 HB2 LYS 45 -6.726 -22.257 -6.078 359 HB3 LYS 45 HB1 LYS 45 -7.849 -22.112 -7.428 360 HG2 LYS 45 HG2 LYS 45 -6.262 -23.595 -8.753 361 HG3 LYS 45 HG1 LYS 45 -5.411 -23.895 -7.237 362 HD2 LYS 45 HD2 LYS 45 -7.679 -24.583 -6.270 363 HD3 LYS 45 HD1 LYS 45 -8.266 -24.594 -7.934 364 HE2 LYS 45 HE2 LYS 45 -5.828 -26.011 -7.976 365 HE3 LYS 45 HE1 LYS 45 -6.694 -26.588 -6.553 366 HZ1 LYS 45 HZ1 LYS 45 -7.227 -27.790 -8.644 367 HZ2 LYS 45 HZ2 LYS 45 -7.923 -26.360 -9.242 368 HZ3 LYS 45 HZ3 LYS 45 -8.577 -27.119 -7.871 369 H CYS 46 H CYS 46 -4.935 -21.055 -5.422 370 HA CYS 46 HA CYS 46 -2.471 -22.410 -6.010 371 HB2 CYS 46 HB2 CYS 46 -2.514 -19.414 -5.769 372 HB3 CYS 46 HB1 CYS 46 -1.088 -20.347 -5.304 373 H THR 47 H THR 47 -1.490 -23.147 -4.217 374 HA THR 47 HA THR 47 -2.710 -22.378 -1.632 375 HB THR 47 HB THR 47 -2.018 -24.674 -0.888 376 HG1 THR 47 HG1 THR 47 -1.028 -25.941 -2.252 377 HG21 THR 47 HG21 THR 47 -4.205 -24.978 -1.335 378 HG22 THR 47 HG22 THR 47 -3.711 -25.615 -2.904 379 HG23 THR 47 HG23 THR 47 -4.129 -23.910 -2.736 380 H CYS 48 H CYS 48 -1.427 -21.805 0.039 381 HA CYS 48 HA CYS 48 1.481 -22.136 -0.221 382 HB2 CYS 48 HB2 CYS 48 0.892 -19.583 0.985 383 HB3 CYS 48 HB1 CYS 48 1.899 -19.940 -0.417 384 H TYR 49 H TYR 49 2.594 -22.205 1.779 385 HA TYR 49 HA TYR 49 0.824 -22.440 4.143 386 HB2 TYR 49 HB2 TYR 49 3.306 -24.059 3.512 387 HB3 TYR 49 HB1 TYR 49 2.316 -24.208 4.963 388 HD1 TYR 49 HD1 TYR 49 2.271 -24.544 1.256 389 HD2 TYR 49 HD2 TYR 49 0.304 -25.490 4.957 390 HE1 TYR 49 HE1 TYR 49 0.763 -26.104 0.057 391 HE2 TYR 49 HE2 TYR 49 -1.205 -27.050 3.756 392 HH TYR 49 HH TYR 49 -1.232 -27.242 0.251 393 H PHE 50 H PHE 50 1.653 -21.679 6.119 394 HA PHE 50 HA PHE 50 3.893 -19.798 5.803 395 HB2 PHE 50 HB2 PHE 50 1.931 -18.733 6.667 396 HB3 PHE 50 HB1 PHE 50 1.693 -20.000 7.862 397 HD1 PHE 50 HD1 PHE 50 2.066 -19.133 10.001 398 HD2 PHE 50 HD2 PHE 50 4.723 -18.049 6.803 399 HE1 PHE 50 HE1 PHE 50 3.487 -17.880 11.603 400 HE2 PHE 50 HE2 PHE 50 6.143 -16.802 8.408 401 HZ PHE 50 HZ PHE 50 5.525 -16.719 10.807 402 H THR 51 H THR 51 5.743 -20.909 6.133 403 HA THR 51 HA THR 51 6.462 -23.076 7.456 404 HB THR 51 HB THR 51 8.048 -21.376 6.498 405 HG1 THR 51 HG1 THR 51 8.996 -23.028 7.556 406 HG21 THR 51 HG21 THR 51 6.927 -19.678 8.326 407 HG22 THR 51 HG22 THR 51 8.481 -19.403 7.539 408 HG23 THR 51 HG23 THR 51 8.422 -20.129 9.145 409 H THR 52 H THR 52 4.990 -23.643 9.096 410 HA THR 52 HA THR 52 5.729 -22.649 11.728 411 HB THR 52 HB THR 52 3.226 -22.400 12.291 412 HG1 THR 52 HG1 THR 52 2.162 -23.025 10.549 413 HG21 THR 52 HG21 THR 52 4.878 -20.537 12.161 414 HG22 THR 52 HG22 THR 52 3.259 -20.053 11.656 415 HG23 THR 52 HG23 THR 52 4.503 -20.365 10.446 416 H GLY 53 H GLY 53 6.340 -24.607 12.480 417 HA2 GLY 53 HA2 GLY 53 4.263 -26.694 12.620 418 HA3 GLY 53 HA1 GLY 53 5.877 -27.114 12.055 Start of MODEL 18 1 H1 GLU 1 H1 GLU 1 -2.733 -29.315 8.435 2 H2 GLU 1 H2 GLU 1 -2.467 -30.799 9.218 3 H3 GLU 1 H3 GLU 1 -1.173 -29.979 8.482 4 HA GLU 1 HA GLU 1 -2.719 -29.020 10.828 5 HB2 GLU 1 HB2 GLU 1 0.160 -29.951 10.658 6 HB3 GLU 1 HB1 GLU 1 -0.735 -29.519 12.115 7 HG2 GLU 1 HG2 GLU 1 -2.391 -31.398 11.297 8 HG3 GLU 1 HG1 GLU 1 -0.987 -31.964 10.394 9 H VAL 2 H VAL 2 0.421 -28.618 9.169 10 HA VAL 2 HA VAL 2 1.152 -26.133 9.920 11 HB VAL 2 HB VAL 2 2.180 -25.833 7.691 12 HG11 VAL 2 HG11 VAL 2 3.615 -27.738 7.822 13 HG12 VAL 2 HG12 VAL 2 2.342 -28.738 8.521 14 HG13 VAL 2 HG13 VAL 2 3.067 -27.441 9.472 15 HG21 VAL 2 HG21 VAL 2 0.127 -26.812 6.500 16 HG22 VAL 2 HG22 VAL 2 0.775 -28.400 6.915 17 HG23 VAL 2 HG23 VAL 2 1.700 -27.313 5.878 18 H ILE 3 H ILE 3 0.838 -23.991 9.167 19 HA ILE 3 HA ILE 3 -1.820 -23.190 8.860 20 HB ILE 3 HB ILE 3 0.834 -21.867 8.499 21 HG12 ILE 3 HG12 ILE 3 -1.654 -21.183 10.099 22 HG13 ILE 3 HG11 ILE 3 -0.281 -22.102 10.717 23 HG21 ILE 3 HG21 ILE 3 -0.158 -20.767 6.701 24 HG22 ILE 3 HG22 ILE 3 -0.664 -19.742 8.044 25 HG23 ILE 3 HG23 ILE 3 -1.783 -20.925 7.367 26 HD11 ILE 3 HD11 ILE 3 -0.015 -19.321 9.553 27 HD12 ILE 3 HD12 ILE 3 1.199 -20.228 10.455 28 HD13 ILE 3 HD13 ILE 3 -0.244 -19.628 11.275 29 H LYS 4 H LYS 4 -3.150 -22.936 7.181 30 HA LYS 4 HA LYS 4 -2.126 -23.665 4.515 31 HB2 LYS 4 HB2 LYS 4 -4.012 -24.982 5.613 32 HB3 LYS 4 HB1 LYS 4 -5.015 -23.551 5.371 33 HG2 LYS 4 HG2 LYS 4 -4.824 -23.677 3.013 34 HG3 LYS 4 HG1 LYS 4 -3.457 -24.789 3.102 35 HD2 LYS 4 HD2 LYS 4 -4.905 -26.535 4.028 36 HD3 LYS 4 HD1 LYS 4 -6.278 -25.428 4.011 37 HE2 LYS 4 HE2 LYS 4 -4.717 -26.230 1.539 38 HE3 LYS 4 HE1 LYS 4 -6.232 -26.982 2.040 39 HZ1 LYS 4 HZ1 LYS 4 -6.926 -24.430 2.129 40 HZ2 LYS 4 HZ2 LYS 4 -7.087 -25.378 0.727 41 HZ3 LYS 4 HZ3 LYS 4 -5.750 -24.345 0.909 42 H LYS 5 H LYS 5 -1.569 -21.887 3.403 43 HA LYS 5 HA LYS 5 -3.462 -19.613 3.403 44 HB2 LYS 5 HB2 LYS 5 -0.867 -19.491 4.208 45 HB3 LYS 5 HB1 LYS 5 -0.696 -19.123 2.491 46 HG2 LYS 5 HG2 LYS 5 -1.054 -17.053 3.753 47 HG3 LYS 5 HG1 LYS 5 -2.444 -17.370 2.714 48 HD2 LYS 5 HD2 LYS 5 -3.824 -17.489 4.489 49 HD3 LYS 5 HD1 LYS 5 -2.784 -18.675 5.278 50 HE2 LYS 5 HE2 LYS 5 -1.327 -16.849 6.093 51 HE3 LYS 5 HE1 LYS 5 -2.384 -15.668 5.320 52 HZ1 LYS 5 HZ1 LYS 5 -2.835 -16.019 7.718 53 HZ2 LYS 5 HZ2 LYS 5 -3.294 -17.617 7.365 54 HZ3 LYS 5 HZ3 LYS 5 -4.176 -16.314 6.723 55 H ASP 6 H ASP 6 -4.673 -19.919 1.622 56 HA ASP 6 HA ASP 6 -3.254 -20.342 -0.940 57 HB2 ASP 6 HB2 ASP 6 -5.231 -21.577 -1.729 58 HB3 ASP 6 HB1 ASP 6 -4.524 -22.350 -0.311 59 H THR 7 H THR 7 -3.730 -18.932 -2.565 60 HA THR 7 HA THR 7 -5.724 -16.857 -1.933 61 HB THR 7 HB THR 7 -4.497 -15.361 -3.288 62 HG1 THR 7 HG1 THR 7 -3.991 -17.564 -4.666 63 HG21 THR 7 HG21 THR 7 -3.116 -16.929 -1.317 64 HG22 THR 7 HG22 THR 7 -2.883 -15.233 -1.733 65 HG23 THR 7 HG23 THR 7 -1.984 -16.482 -2.593 66 HA PRO 8 HA PRO 8 -7.970 -18.193 -5.554 67 HB2 PRO 8 HB2 PRO 8 -9.586 -16.094 -5.944 68 HB3 PRO 8 HB1 PRO 8 -9.638 -16.999 -4.417 69 HG2 PRO 8 HG2 PRO 8 -8.503 -14.330 -4.987 70 HG3 PRO 8 HG1 PRO 8 -9.187 -14.973 -3.487 71 HD2 PRO 8 HD2 PRO 8 -6.406 -14.800 -4.200 72 HD3 PRO 8 HD1 PRO 8 -7.111 -15.505 -2.729 73 H TYR 9 H TYR 9 -7.251 -18.393 -7.622 74 HA TYR 9 HA TYR 9 -5.945 -16.101 -8.906 75 HB2 TYR 9 HB2 TYR 9 -4.920 -18.461 -8.801 76 HB3 TYR 9 HB1 TYR 9 -6.098 -18.885 -10.042 77 HD1 TYR 9 HD1 TYR 9 -5.376 -18.705 -12.249 78 HD2 TYR 9 HD2 TYR 9 -3.742 -16.058 -9.286 79 HE1 TYR 9 HE1 TYR 9 -3.927 -17.667 -13.974 80 HE2 TYR 9 HE2 TYR 9 -2.294 -15.020 -11.011 81 HH TYR 9 HH TYR 9 -2.526 -15.979 -14.424 82 H LYS 10 H LYS 10 -7.813 -18.728 -10.406 83 HA LYS 10 HA LYS 10 -9.340 -18.636 -12.133 84 HB2 LYS 10 HB2 LYS 10 -10.527 -16.293 -10.658 85 HB3 LYS 10 HB1 LYS 10 -11.357 -17.551 -11.574 86 HG2 LYS 10 HG2 LYS 10 -10.900 -19.201 -9.903 87 HG3 LYS 10 HG1 LYS 10 -9.755 -18.143 -9.077 88 HD2 LYS 10 HD2 LYS 10 -11.429 -17.355 -7.807 89 HD3 LYS 10 HD1 LYS 10 -12.207 -16.719 -9.256 90 HE2 LYS 10 HE2 LYS 10 -13.072 -19.145 -9.595 91 HE3 LYS 10 HE1 LYS 10 -12.649 -19.373 -7.898 92 HZ1 LYS 10 HZ1 LYS 10 -14.949 -18.675 -8.159 93 HZ2 LYS 10 HZ2 LYS 10 -14.448 -17.263 -8.961 94 HZ3 LYS 10 HZ3 LYS 10 -14.053 -17.499 -7.326 95 H LYS 11 H LYS 11 -7.028 -16.460 -11.835 96 HA LYS 11 HA LYS 11 -7.703 -14.157 -13.207 97 HB2 LYS 11 HB2 LYS 11 -5.349 -15.350 -12.311 98 HB3 LYS 11 HB1 LYS 11 -5.113 -15.183 -14.050 99 HG2 LYS 11 HG2 LYS 11 -4.356 -13.147 -12.929 100 HG3 LYS 11 HG1 LYS 11 -5.792 -12.795 -13.891 101 HD2 LYS 11 HD2 LYS 11 -7.085 -12.387 -12.054 102 HD3 LYS 11 HD1 LYS 11 -6.305 -13.649 -11.100 103 HE2 LYS 11 HE2 LYS 11 -4.269 -12.140 -10.968 104 HE3 LYS 11 HE1 LYS 11 -5.264 -10.865 -11.672 105 HZ1 LYS 11 HZ1 LYS 11 -6.819 -11.121 -9.838 106 HZ2 LYS 11 HZ2 LYS 11 -5.266 -10.742 -9.266 107 HZ3 LYS 11 HZ3 LYS 11 -5.847 -12.334 -9.158 108 H ARG 12 H ARG 12 -5.760 -16.584 -14.903 109 HA ARG 12 HA ARG 12 -7.708 -16.607 -17.106 110 HB2 ARG 12 HB2 ARG 12 -4.930 -15.523 -17.198 111 HB3 ARG 12 HB1 ARG 12 -5.523 -16.411 -18.602 112 HG2 ARG 12 HG2 ARG 12 -7.325 -14.908 -18.938 113 HG3 ARG 12 HG1 ARG 12 -7.156 -14.216 -17.325 114 HD2 ARG 12 HD2 ARG 12 -6.080 -12.567 -18.503 115 HD3 ARG 12 HD1 ARG 12 -4.707 -13.644 -18.269 116 HE ARG 12 HE ARG 12 -6.098 -13.127 -20.765 117 HH11 ARG 12 HH11 ARG 12 -5.160 -14.088 -22.597 118 HH12 ARG 12 HH12 ARG 12 -3.956 -15.317 -22.402 119 HH21 ARG 12 HH21 ARG 12 -4.045 -15.225 -18.937 120 HH22 ARG 12 HH22 ARG 12 -3.325 -15.962 -20.328 121 H LYS 13 H LYS 13 -7.004 -18.232 -18.819 122 HA LYS 13 HA LYS 13 -6.346 -20.708 -17.460 123 HB2 LYS 13 HB2 LYS 13 -8.034 -20.151 -19.500 124 HB3 LYS 13 HB1 LYS 13 -6.619 -20.691 -20.406 125 HG2 LYS 13 HG2 LYS 13 -6.555 -22.781 -19.178 126 HG3 LYS 13 HG1 LYS 13 -7.842 -22.235 -18.102 127 HD2 LYS 13 HD2 LYS 13 -9.255 -21.959 -20.251 128 HD3 LYS 13 HD1 LYS 13 -8.025 -22.959 -21.025 129 HE2 LYS 13 HE2 LYS 13 -9.743 -23.703 -18.643 130 HE3 LYS 13 HE1 LYS 13 -9.787 -24.423 -20.252 131 HZ1 LYS 13 HZ1 LYS 13 -8.150 -25.785 -19.700 132 HZ2 LYS 13 HZ2 LYS 13 -8.229 -25.204 -18.105 133 HZ3 LYS 13 HZ3 LYS 13 -7.158 -24.496 -19.218 134 H PHE 14 H PHE 14 -4.181 -19.007 -17.367 135 HA PHE 14 HA PHE 14 -2.263 -20.439 -19.088 136 HB2 PHE 14 HB2 PHE 14 -2.701 -17.511 -18.867 137 HB3 PHE 14 HB1 PHE 14 -1.025 -18.061 -18.894 138 HD1 PHE 14 HD1 PHE 14 -4.277 -18.334 -20.705 139 HD2 PHE 14 HD2 PHE 14 -0.009 -18.772 -20.910 140 HE1 PHE 14 HE1 PHE 14 -4.432 -18.695 -23.153 141 HE2 PHE 14 HE2 PHE 14 -0.165 -19.133 -23.359 142 HZ PHE 14 HZ PHE 14 -2.377 -19.095 -24.480 143 HA PRO 15 HA PRO 15 -1.300 -21.013 -14.588 144 HB2 PRO 15 HB2 PRO 15 0.356 -23.073 -15.989 145 HB3 PRO 15 HB1 PRO 15 -0.620 -23.222 -14.514 146 HG2 PRO 15 HG2 PRO 15 -1.458 -24.193 -16.854 147 HG3 PRO 15 HG1 PRO 15 -2.577 -23.493 -15.674 148 HD2 PRO 15 HD2 PRO 15 -1.653 -22.377 -18.267 149 HD3 PRO 15 HD1 PRO 15 -3.161 -22.072 -17.378 150 H TYR 16 H TYR 16 -0.040 -19.232 -14.139 151 HA TYR 16 HA TYR 16 2.606 -19.026 -15.404 152 HB2 TYR 16 HB2 TYR 16 0.647 -17.119 -14.470 153 HB3 TYR 16 HB1 TYR 16 2.188 -16.852 -13.655 154 HD1 TYR 16 HD1 TYR 16 4.292 -17.255 -15.377 155 HD2 TYR 16 HD2 TYR 16 0.351 -15.908 -16.429 156 HE1 TYR 16 HE1 TYR 16 5.200 -16.200 -17.430 157 HE2 TYR 16 HE2 TYR 16 1.260 -14.853 -18.482 158 HH TYR 16 HH TYR 16 3.907 -13.933 -19.053 159 H LYS 17 H LYS 17 1.044 -20.035 -12.564 160 HA LYS 17 HA LYS 17 1.835 -20.880 -10.583 161 HB2 LYS 17 HB2 LYS 17 4.627 -20.598 -11.686 162 HB3 LYS 17 HB1 LYS 17 4.020 -21.778 -10.525 163 HG2 LYS 17 HG2 LYS 17 2.611 -22.793 -12.272 164 HG3 LYS 17 HG1 LYS 17 3.191 -21.604 -13.439 165 HD2 LYS 17 HD2 LYS 17 5.564 -22.534 -12.556 166 HD3 LYS 17 HD1 LYS 17 4.581 -23.977 -12.305 167 HE2 LYS 17 HE2 LYS 17 3.898 -24.001 -14.622 168 HE3 LYS 17 HE1 LYS 17 4.653 -22.434 -14.911 169 HZ1 LYS 17 HZ1 LYS 17 6.574 -24.138 -13.808 170 HZ2 LYS 17 HZ2 LYS 17 6.538 -23.465 -15.367 171 HZ3 LYS 17 HZ3 LYS 17 5.816 -24.975 -15.074 172 H SER 18 H SER 18 4.324 -18.555 -11.667 173 HA SER 18 HA SER 18 4.778 -17.500 -9.073 174 HB2 SER 18 HB2 SER 18 5.454 -15.568 -11.064 175 HB3 SER 18 HB1 SER 18 6.527 -16.610 -10.136 176 HG SER 18 HG SER 18 5.106 -17.794 -12.206 177 H GLU 19 H GLU 19 3.469 -15.682 -11.848 178 HA GLU 19 HA GLU 19 2.463 -13.481 -10.705 179 HB2 GLU 19 HB2 GLU 19 2.133 -14.024 -13.072 180 HB3 GLU 19 HB1 GLU 19 0.942 -15.246 -12.642 181 HG2 GLU 19 HG2 GLU 19 -0.388 -13.392 -13.193 182 HG3 GLU 19 HG1 GLU 19 -0.294 -13.297 -11.439 183 H CYS 20 H CYS 20 1.354 -16.711 -10.133 184 HA CYS 20 HA CYS 20 -0.983 -15.777 -8.618 185 HB2 CYS 20 HB2 CYS 20 -1.221 -17.698 -10.181 186 HB3 CYS 20 HB1 CYS 20 -0.063 -18.601 -9.205 187 H LEU 21 H LEU 21 1.934 -17.765 -8.152 188 HA LEU 21 HA LEU 21 1.589 -18.177 -5.378 189 HB2 LEU 21 HB2 LEU 21 3.294 -19.200 -7.154 190 HB3 LEU 21 HB1 LEU 21 4.340 -17.932 -6.520 191 HG LEU 21 HG LEU 21 3.415 -18.897 -4.191 192 HD11 LEU 21 HD11 LEU 21 2.809 -21.131 -4.228 193 HD12 LEU 21 HD12 LEU 21 3.705 -21.456 -5.712 194 HD13 LEU 21 HD13 LEU 21 2.150 -20.626 -5.784 195 HD21 LEU 21 HD21 LEU 21 5.651 -20.002 -5.913 196 HD22 LEU 21 HD22 LEU 21 5.475 -20.369 -4.196 197 HD23 LEU 21 HD23 LEU 21 5.765 -18.709 -4.719 198 H LYS 22 H LYS 22 2.731 -15.485 -7.242 199 HA LYS 22 HA LYS 22 4.188 -14.131 -5.218 200 HB2 LYS 22 HB2 LYS 22 3.541 -13.691 -7.920 201 HB3 LYS 22 HB1 LYS 22 2.871 -12.316 -7.043 202 HG2 LYS 22 HG2 LYS 22 4.992 -11.764 -6.094 203 HG3 LYS 22 HG1 LYS 22 5.696 -13.300 -6.598 204 HD2 LYS 22 HD2 LYS 22 6.005 -12.606 -8.761 205 HD3 LYS 22 HD1 LYS 22 4.551 -11.607 -8.756 206 HE2 LYS 22 HE2 LYS 22 5.671 -9.894 -7.443 207 HE3 LYS 22 HE1 LYS 22 7.100 -10.913 -7.270 208 HZ1 LYS 22 HZ1 LYS 22 6.073 -9.569 -9.688 209 HZ2 LYS 22 HZ2 LYS 22 7.105 -10.914 -9.812 210 HZ3 LYS 22 HZ3 LYS 22 7.630 -9.507 -9.018 211 H ALA 23 H ALA 23 0.814 -13.879 -6.328 212 HA ALA 23 HA ALA 23 -0.106 -11.822 -4.754 213 HB1 ALA 23 HB1 ALA 23 -1.858 -12.541 -6.000 214 HB2 ALA 23 HB2 ALA 23 -2.205 -13.568 -4.609 215 HB3 ALA 23 HB3 ALA 23 -1.308 -14.216 -5.982 216 H CYS 24 H CYS 24 0.518 -15.171 -3.831 217 HA CYS 24 HA CYS 24 -0.641 -15.112 -1.266 218 HB2 CYS 24 HB2 CYS 24 0.875 -16.938 -2.796 219 HB3 CYS 24 HB1 CYS 24 1.738 -16.729 -1.272 220 H ALA 25 H ALA 25 2.703 -14.429 -2.302 221 HA ALA 25 HA ALA 25 3.710 -13.823 0.268 222 HB1 ALA 25 HB1 ALA 25 5.030 -14.264 -1.876 223 HB2 ALA 25 HB2 ALA 25 5.619 -12.961 -0.844 224 HB3 ALA 25 HB3 ALA 25 4.697 -12.586 -2.300 225 H THR 26 H THR 26 1.760 -12.034 -1.958 226 HA THR 26 HA THR 26 2.252 -9.500 -0.567 227 HB THR 26 HB THR 26 0.352 -9.984 -2.863 228 HG1 THR 26 HG1 THR 26 2.425 -10.673 -3.452 229 HG21 THR 26 HG21 THR 26 0.645 -7.803 -1.291 230 HG22 THR 26 HG22 THR 26 0.215 -7.707 -2.998 231 HG23 THR 26 HG23 THR 26 1.889 -7.474 -2.496 232 H SER 27 H SER 27 0.125 -12.154 -0.491 233 HA SER 27 HA SER 27 -2.371 -11.294 0.061 234 HB2 SER 27 HB2 SER 27 -0.711 -13.337 1.526 235 HB3 SER 27 HB1 SER 27 -2.402 -13.053 1.931 236 HG SER 27 HG SER 27 -1.763 -13.359 -0.760 237 H PHE 28 H PHE 28 0.331 -11.198 2.375 238 HA PHE 28 HA PHE 28 -1.173 -9.906 4.432 239 HB2 PHE 28 HB2 PHE 28 1.067 -11.261 4.564 240 HB3 PHE 28 HB1 PHE 28 1.811 -9.698 4.226 241 HD1 PHE 28 HD1 PHE 28 2.244 -8.238 5.994 242 HD2 PHE 28 HD2 PHE 28 -0.782 -11.254 6.449 243 HE1 PHE 28 HE1 PHE 28 1.939 -7.574 8.364 244 HE2 PHE 28 HE2 PHE 28 -1.087 -10.589 8.819 245 HZ PHE 28 HZ PHE 28 0.274 -8.749 9.777 246 H THR 29 H THR 29 -0.542 -7.733 5.300 247 HA THR 29 HA THR 29 -0.985 -5.728 3.368 248 HB THR 29 HB THR 29 -0.632 -4.150 5.170 249 HG1 THR 29 HG1 THR 29 0.120 -5.143 7.216 250 HG21 THR 29 HG21 THR 29 -2.110 -5.156 6.904 251 HG22 THR 29 HG22 THR 29 -1.893 -6.730 6.139 252 HG23 THR 29 HG23 THR 29 -2.708 -5.431 5.268 253 H GLY 30 H GLY 30 1.912 -6.030 5.429 254 HA2 GLY 30 HA2 GLY 30 3.525 -4.422 3.721 255 HA3 GLY 30 HA1 GLY 30 4.104 -5.421 5.051 256 H GLY 31 H GLY 31 4.051 -7.849 4.568 257 HA2 GLY 31 HA2 GLY 31 3.956 -9.280 2.374 258 HA3 GLY 31 HA1 GLY 31 5.328 -8.257 1.956 259 H ASP 32 H ASP 32 7.201 -8.299 3.399 260 HA ASP 32 HA ASP 32 8.909 -9.561 4.307 261 HB2 ASP 32 HB2 ASP 32 7.135 -8.975 6.212 262 HB3 ASP 32 HB1 ASP 32 6.986 -10.731 6.255 263 H GLU 33 H GLU 33 8.226 -12.057 5.890 264 HA GLU 33 HA GLU 33 7.694 -13.899 3.645 265 HB2 GLU 33 HB2 GLU 33 9.927 -14.156 5.674 266 HB3 GLU 33 HB1 GLU 33 9.504 -15.365 4.461 267 HG2 GLU 33 HG2 GLU 33 10.065 -12.543 3.602 268 HG3 GLU 33 HG1 GLU 33 11.410 -13.628 3.950 269 H SER 34 H SER 34 7.827 -13.391 7.150 270 HA SER 34 HA SER 34 6.750 -15.858 7.942 271 HB2 SER 34 HB2 SER 34 7.716 -14.321 9.567 272 HB3 SER 34 HB1 SER 34 6.463 -13.130 9.230 273 HG SER 34 HG SER 34 4.976 -14.918 9.846 274 H ARG 35 H ARG 35 5.182 -16.391 6.451 275 HA ARG 35 HA ARG 35 2.535 -16.083 7.116 276 HB2 ARG 35 HB2 ARG 35 3.421 -13.673 5.984 277 HB3 ARG 35 HB1 ARG 35 2.559 -14.490 4.685 278 HG2 ARG 35 HG2 ARG 35 0.832 -13.351 5.774 279 HG3 ARG 35 HG1 ARG 35 0.746 -14.952 6.510 280 HD2 ARG 35 HD2 ARG 35 0.668 -13.055 8.166 281 HD3 ARG 35 HD1 ARG 35 1.971 -14.206 8.449 282 HE ARG 35 HE ARG 35 3.037 -12.214 6.831 283 HH11 ARG 35 HH11 ARG 35 4.187 -10.480 7.739 284 HH12 ARG 35 HH12 ARG 35 3.910 -10.032 9.390 285 HH21 ARG 35 HH21 ARG 35 1.533 -12.498 9.933 286 HH22 ARG 35 HH22 ARG 35 2.406 -11.175 10.632 287 H ILE 36 H ILE 36 5.009 -16.616 4.780 288 HA ILE 36 HA ILE 36 3.460 -18.801 3.606 289 HB ILE 36 HB ILE 36 5.053 -17.064 1.758 290 HG12 ILE 36 HG12 ILE 36 3.443 -15.590 3.035 291 HG13 ILE 36 HG11 ILE 36 3.149 -15.659 1.301 292 HG21 ILE 36 HG21 ILE 36 3.183 -17.899 0.219 293 HG22 ILE 36 HG22 ILE 36 2.698 -18.951 1.550 294 HG23 ILE 36 HG23 ILE 36 4.297 -19.124 0.826 295 HD11 ILE 36 HD11 ILE 36 1.735 -17.769 2.749 296 HD12 ILE 36 HD12 ILE 36 1.119 -16.605 1.577 297 HD13 ILE 36 HD13 ILE 36 1.262 -16.152 3.273 298 H GLN 37 H GLN 37 6.563 -17.131 3.020 299 HA GLN 37 HA GLN 37 8.727 -17.904 3.017 300 HB2 GLN 37 HB2 GLN 37 8.117 -18.551 5.368 301 HB3 GLN 37 HB1 GLN 37 7.684 -20.148 4.758 302 HG2 GLN 37 HG2 GLN 37 9.911 -20.616 4.085 303 HG3 GLN 37 HG1 GLN 37 10.390 -18.925 4.218 304 HE21 GLN 37 HE21 GLN 37 11.140 -21.644 5.696 305 HE22 GLN 37 HE22 GLN 37 11.177 -21.158 7.322 306 H GLU 38 H GLU 38 6.171 -20.235 2.390 307 HA GLU 38 HA GLU 38 7.556 -21.193 0.048 308 HB2 GLU 38 HB2 GLU 38 8.555 -22.618 1.765 309 HB3 GLU 38 HB1 GLU 38 6.955 -23.072 2.347 310 HG2 GLU 38 HG2 GLU 38 7.561 -24.855 0.934 311 HG3 GLU 38 HG1 GLU 38 6.524 -23.863 -0.083 312 H GLY 39 H GLY 39 6.136 -22.034 -1.438 313 HA2 GLY 39 HA2 GLY 39 3.470 -22.852 -0.711 314 HA3 GLY 39 HA1 GLY 39 3.514 -21.279 -1.499 315 H LYS 40 H LYS 40 2.143 -23.358 -2.656 316 HA LYS 40 HA LYS 40 3.869 -24.074 -4.943 317 HB2 LYS 40 HB2 LYS 40 1.854 -25.646 -3.410 318 HB3 LYS 40 HB1 LYS 40 1.940 -25.913 -5.150 319 HG2 LYS 40 HG2 LYS 40 4.225 -26.569 -5.043 320 HG3 LYS 40 HG1 LYS 40 4.405 -25.944 -3.403 321 HD2 LYS 40 HD2 LYS 40 3.262 -27.731 -2.448 322 HD3 LYS 40 HD1 LYS 40 2.363 -28.079 -3.926 323 HE2 LYS 40 HE2 LYS 40 3.997 -29.429 -4.743 324 HE3 LYS 40 HE1 LYS 40 5.284 -28.350 -4.203 325 HZ1 LYS 40 HZ1 LYS 40 5.219 -29.241 -2.056 326 HZ2 LYS 40 HZ2 LYS 40 5.125 -30.594 -3.079 327 HZ3 LYS 40 HZ3 LYS 40 3.728 -30.008 -2.310 328 HA PRO 41 HA PRO 41 0.636 -22.118 -7.321 329 HB2 PRO 41 HB2 PRO 41 1.216 -22.959 -9.775 330 HB3 PRO 41 HB1 PRO 41 2.435 -22.072 -8.834 331 HG2 PRO 41 HG2 PRO 41 2.244 -24.977 -9.417 332 HG3 PRO 41 HG1 PRO 41 3.670 -23.945 -9.254 333 HD2 PRO 41 HD2 PRO 41 2.559 -25.624 -7.236 334 HD3 PRO 41 HD1 PRO 41 3.851 -24.421 -7.031 335 H GLY 42 H GLY 42 -1.199 -22.498 -8.785 336 HA2 GLY 42 HA2 GLY 42 -2.158 -25.241 -9.063 337 HA3 GLY 42 HA1 GLY 42 -3.128 -24.175 -8.050 338 H PHE 43 H PHE 43 -3.949 -25.433 -10.509 339 HA PHE 43 HA PHE 43 -3.942 -23.421 -12.585 340 HB2 PHE 43 HB2 PHE 43 -5.776 -25.813 -12.451 341 HB3 PHE 43 HB1 PHE 43 -5.149 -24.987 -13.879 342 HD1 PHE 43 HD1 PHE 43 -2.927 -25.429 -14.718 343 HD2 PHE 43 HD2 PHE 43 -4.299 -27.259 -11.084 344 HE1 PHE 43 HE1 PHE 43 -0.979 -26.962 -14.757 345 HE2 PHE 43 HE2 PHE 43 -2.352 -28.795 -11.123 346 HZ PHE 43 HZ PHE 43 -0.691 -28.645 -12.960 347 H PHE 44 H PHE 44 -5.172 -21.653 -12.465 348 HA PHE 44 HA PHE 44 -6.986 -20.279 -12.107 349 HB2 PHE 44 HB2 PHE 44 -8.792 -22.549 -11.451 350 HB3 PHE 44 HB1 PHE 44 -9.062 -21.156 -12.496 351 HD1 PHE 44 HD1 PHE 44 -6.641 -21.298 -14.234 352 HD2 PHE 44 HD2 PHE 44 -9.289 -24.387 -12.860 353 HE1 PHE 44 HE1 PHE 44 -6.061 -22.676 -16.213 354 HE2 PHE 44 HE2 PHE 44 -8.709 -25.765 -14.838 355 HZ PHE 44 HZ PHE 44 -7.096 -24.910 -16.514 356 H LYS 45 H LYS 45 -5.245 -21.367 -9.991 357 HA LYS 45 HA LYS 45 -6.175 -20.074 -7.751 358 HB2 LYS 45 HB2 LYS 45 -6.859 -22.050 -6.323 359 HB3 LYS 45 HB1 LYS 45 -8.033 -21.576 -7.547 360 HG2 LYS 45 HG2 LYS 45 -6.315 -23.393 -8.833 361 HG3 LYS 45 HG1 LYS 45 -6.621 -24.090 -7.244 362 HD2 LYS 45 HD2 LYS 45 -9.039 -23.884 -7.587 363 HD3 LYS 45 HD1 LYS 45 -8.768 -23.118 -9.153 364 HE2 LYS 45 HE2 LYS 45 -8.930 -25.903 -8.580 365 HE3 LYS 45 HE1 LYS 45 -8.604 -25.134 -10.134 366 HZ1 LYS 45 HZ1 LYS 45 -6.613 -25.863 -8.057 367 HZ2 LYS 45 HZ2 LYS 45 -6.251 -24.970 -9.457 368 HZ3 LYS 45 HZ3 LYS 45 -6.794 -26.574 -9.587 369 H CYS 46 H CYS 46 -5.007 -20.908 -5.692 370 HA CYS 46 HA CYS 46 -2.691 -22.584 -6.206 371 HB2 CYS 46 HB2 CYS 46 -2.322 -19.650 -5.556 372 HB3 CYS 46 HB1 CYS 46 -1.041 -20.857 -5.652 373 H THR 47 H THR 47 -1.493 -23.085 -4.307 374 HA THR 47 HA THR 47 -2.845 -22.386 -1.769 375 HB THR 47 HB THR 47 -2.285 -24.754 -1.041 376 HG1 THR 47 HG1 THR 47 -1.958 -26.216 -2.744 377 HG21 THR 47 HG21 THR 47 -4.528 -24.722 -1.373 378 HG22 THR 47 HG22 THR 47 -4.159 -25.595 -2.860 379 HG23 THR 47 HG23 THR 47 -4.382 -23.846 -2.897 380 H CYS 48 H CYS 48 -1.503 -21.691 -0.211 381 HA CYS 48 HA CYS 48 1.374 -22.291 -0.489 382 HB2 CYS 48 HB2 CYS 48 0.646 -19.726 0.787 383 HB3 CYS 48 HB1 CYS 48 1.977 -20.110 -0.302 384 H TYR 49 H TYR 49 2.583 -21.965 1.589 385 HA TYR 49 HA TYR 49 0.907 -22.387 3.975 386 HB2 TYR 49 HB2 TYR 49 3.234 -24.150 3.172 387 HB3 TYR 49 HB1 TYR 49 2.329 -24.262 4.681 388 HD1 TYR 49 HD1 TYR 49 2.077 -24.584 0.990 389 HD2 TYR 49 HD2 TYR 49 0.186 -25.334 4.774 390 HE1 TYR 49 HE1 TYR 49 0.390 -26.009 -0.136 391 HE2 TYR 49 HE2 TYR 49 -1.502 -26.760 3.646 392 HH TYR 49 HH TYR 49 -2.471 -27.003 1.364 393 H PHE 50 H PHE 50 1.916 -21.794 5.936 394 HA PHE 50 HA PHE 50 4.225 -20.014 5.550 395 HB2 PHE 50 HB2 PHE 50 2.352 -18.872 6.508 396 HB3 PHE 50 HB1 PHE 50 2.092 -20.152 7.684 397 HD1 PHE 50 HD1 PHE 50 2.154 -18.385 9.450 398 HD2 PHE 50 HD2 PHE 50 5.570 -19.238 6.981 399 HE1 PHE 50 HE1 PHE 50 3.620 -17.204 11.061 400 HE2 PHE 50 HE2 PHE 50 7.027 -18.059 8.592 401 HZ PHE 50 HZ PHE 50 6.055 -17.040 10.633 402 H THR 51 H THR 51 6.015 -21.285 5.773 403 HA THR 51 HA THR 51 6.495 -23.533 7.186 404 HB THR 51 HB THR 51 8.440 -21.224 7.269 405 HG1 THR 51 HG1 THR 51 7.571 -22.874 5.168 406 HG21 THR 51 HG21 THR 51 9.881 -22.787 7.994 407 HG22 THR 51 HG22 THR 51 9.512 -23.808 6.604 408 HG23 THR 51 HG23 THR 51 8.549 -23.939 8.075 409 H THR 52 H THR 52 5.240 -23.679 9.066 410 HA THR 52 HA THR 52 6.514 -22.589 11.434 411 HB THR 52 HB THR 52 4.209 -21.776 12.269 412 HG1 THR 52 HG1 THR 52 3.332 -22.704 10.161 413 HG21 THR 52 HG21 THR 52 4.700 -19.570 11.541 414 HG22 THR 52 HG22 THR 52 5.423 -20.146 10.039 415 HG23 THR 52 HG23 THR 52 6.258 -20.395 11.572 416 H GLY 53 H GLY 53 6.901 -24.723 12.016 417 HA2 GLY 53 HA2 GLY 53 5.092 -26.023 13.647 418 HA3 GLY 53 HA1 GLY 53 4.876 -26.739 12.052 Start of MODEL 19 1 H1 GLU 1 H1 GLU 1 0.859 -31.987 8.962 2 H2 GLU 1 H2 GLU 1 1.149 -31.136 10.404 3 H3 GLU 1 H3 GLU 1 1.884 -30.636 8.957 4 HA GLU 1 HA GLU 1 -0.424 -30.270 8.052 5 HB2 GLU 1 HB2 GLU 1 -1.081 -30.322 11.011 6 HB3 GLU 1 HB1 GLU 1 -2.199 -30.031 9.678 7 HG2 GLU 1 HG2 GLU 1 -2.562 -32.296 10.199 8 HG3 GLU 1 HG1 GLU 1 -1.459 -32.367 8.826 9 H VAL 2 H VAL 2 1.038 -28.547 7.527 10 HA VAL 2 HA VAL 2 1.561 -26.507 9.538 11 HB VAL 2 HB VAL 2 2.636 -25.349 7.516 12 HG11 VAL 2 HG11 VAL 2 4.439 -27.324 7.482 13 HG12 VAL 2 HG12 VAL 2 3.468 -27.894 8.839 14 HG13 VAL 2 HG13 VAL 2 4.219 -26.300 8.902 15 HG21 VAL 2 HG21 VAL 2 2.431 -28.108 6.303 16 HG22 VAL 2 HG22 VAL 2 2.958 -26.612 5.533 17 HG23 VAL 2 HG23 VAL 2 1.256 -26.849 5.926 18 H ILE 3 H ILE 3 1.040 -24.247 9.139 19 HA ILE 3 HA ILE 3 -1.600 -23.646 8.927 20 HB ILE 3 HB ILE 3 0.904 -22.118 8.505 21 HG12 ILE 3 HG12 ILE 3 -1.613 -21.371 10.007 22 HG13 ILE 3 HG11 ILE 3 -0.428 -22.494 10.674 23 HG21 ILE 3 HG21 ILE 3 -0.497 -20.068 7.917 24 HG22 ILE 3 HG22 ILE 3 -1.793 -21.187 7.491 25 HG23 ILE 3 HG23 ILE 3 -0.264 -21.231 6.612 26 HD11 ILE 3 HD11 ILE 3 -0.312 -19.591 10.493 27 HD12 ILE 3 HD12 ILE 3 1.102 -20.341 9.752 28 HD13 ILE 3 HD13 ILE 3 0.697 -20.692 11.431 29 H LYS 4 H LYS 4 -3.084 -23.244 7.347 30 HA LYS 4 HA LYS 4 -2.274 -23.957 4.602 31 HB2 LYS 4 HB2 LYS 4 -4.340 -24.922 6.165 32 HB3 LYS 4 HB1 LYS 4 -5.143 -23.749 5.120 33 HG2 LYS 4 HG2 LYS 4 -5.185 -25.766 3.877 34 HG3 LYS 4 HG1 LYS 4 -3.845 -24.852 3.186 35 HD2 LYS 4 HD2 LYS 4 -2.658 -26.763 3.546 36 HD3 LYS 4 HD1 LYS 4 -2.578 -26.183 5.210 37 HE2 LYS 4 HE2 LYS 4 -3.377 -28.566 4.982 38 HE3 LYS 4 HE1 LYS 4 -4.495 -27.506 5.840 39 HZ1 LYS 4 HZ1 LYS 4 -5.934 -27.436 4.068 40 HZ2 LYS 4 HZ2 LYS 4 -5.362 -29.033 3.958 41 HZ3 LYS 4 HZ3 LYS 4 -4.743 -27.832 2.928 42 H LYS 5 H LYS 5 -1.930 -22.281 3.314 43 HA LYS 5 HA LYS 5 -3.794 -19.996 3.445 44 HB2 LYS 5 HB2 LYS 5 -1.855 -19.129 4.485 45 HB3 LYS 5 HB1 LYS 5 -0.778 -19.954 3.358 46 HG2 LYS 5 HG2 LYS 5 -0.992 -17.512 2.881 47 HG3 LYS 5 HG1 LYS 5 -1.520 -18.521 1.532 48 HD2 LYS 5 HD2 LYS 5 -3.828 -18.168 2.048 49 HD3 LYS 5 HD1 LYS 5 -3.438 -17.462 3.618 50 HE2 LYS 5 HE2 LYS 5 -2.144 -15.671 2.281 51 HE3 LYS 5 HE1 LYS 5 -3.027 -16.270 0.876 52 HZ1 LYS 5 HZ1 LYS 5 -4.784 -15.900 3.062 53 HZ2 LYS 5 HZ2 LYS 5 -4.825 -15.182 1.524 54 HZ3 LYS 5 HZ3 LYS 5 -3.921 -14.470 2.773 55 H ASP 6 H ASP 6 -4.937 -20.330 1.615 56 HA ASP 6 HA ASP 6 -3.421 -20.685 -0.902 57 HB2 ASP 6 HB2 ASP 6 -4.619 -22.709 -0.556 58 HB3 ASP 6 HB1 ASP 6 -6.064 -21.852 -0.033 59 H THR 7 H THR 7 -4.023 -19.454 -2.661 60 HA THR 7 HA THR 7 -6.037 -17.361 -2.126 61 HB THR 7 HB THR 7 -4.587 -15.778 -2.813 62 HG1 THR 7 HG1 THR 7 -3.843 -17.643 -4.815 63 HG21 THR 7 HG21 THR 7 -2.280 -16.284 -2.456 64 HG22 THR 7 HG22 THR 7 -2.518 -17.981 -2.867 65 HG23 THR 7 HG23 THR 7 -3.186 -17.334 -1.368 66 HA PRO 8 HA PRO 8 -7.801 -18.648 -6.019 67 HB2 PRO 8 HB2 PRO 8 -9.381 -16.567 -6.575 68 HB3 PRO 8 HB1 PRO 8 -9.598 -17.471 -5.062 69 HG2 PRO 8 HG2 PRO 8 -8.380 -14.805 -5.508 70 HG3 PRO 8 HG1 PRO 8 -9.288 -15.417 -4.117 71 HD2 PRO 8 HD2 PRO 8 -6.441 -15.270 -4.378 72 HD3 PRO 8 HD1 PRO 8 -7.367 -16.022 -3.060 73 H TYR 9 H TYR 9 -7.686 -18.414 -8.308 74 HA TYR 9 HA TYR 9 -6.090 -16.152 -9.331 75 HB2 TYR 9 HB2 TYR 9 -4.628 -18.136 -8.953 76 HB3 TYR 9 HB1 TYR 9 -5.626 -19.042 -10.088 77 HD1 TYR 9 HD1 TYR 9 -3.473 -16.014 -9.760 78 HD2 TYR 9 HD2 TYR 9 -5.322 -18.825 -12.429 79 HE1 TYR 9 HE1 TYR 9 -2.180 -15.068 -11.650 80 HE2 TYR 9 HE2 TYR 9 -4.029 -17.880 -14.321 81 HH TYR 9 HH TYR 9 -2.351 -16.501 -14.894 82 H LYS 10 H LYS 10 -8.467 -18.659 -9.876 83 HA LYS 10 HA LYS 10 -10.129 -18.852 -11.446 84 HB2 LYS 10 HB2 LYS 10 -10.378 -16.376 -11.024 85 HB3 LYS 10 HB1 LYS 10 -9.311 -16.102 -12.402 86 HG2 LYS 10 HG2 LYS 10 -11.258 -16.113 -13.593 87 HG3 LYS 10 HG1 LYS 10 -11.083 -17.866 -13.485 88 HD2 LYS 10 HD2 LYS 10 -12.532 -17.967 -11.560 89 HD3 LYS 10 HD1 LYS 10 -12.562 -16.208 -11.426 90 HE2 LYS 10 HE2 LYS 10 -14.548 -16.537 -12.562 91 HE3 LYS 10 HE1 LYS 10 -13.448 -16.393 -13.932 92 HZ1 LYS 10 HZ1 LYS 10 -14.181 -18.390 -14.527 93 HZ2 LYS 10 HZ2 LYS 10 -14.946 -18.656 -13.034 94 HZ3 LYS 10 HZ3 LYS 10 -13.298 -19.020 -13.225 95 H LYS 11 H LYS 11 -7.748 -16.845 -13.179 96 HA LYS 11 HA LYS 11 -6.205 -18.555 -14.528 97 HB2 LYS 11 HB2 LYS 11 -7.565 -18.973 -16.692 98 HB3 LYS 11 HB1 LYS 11 -7.860 -20.019 -15.304 99 HG2 LYS 11 HG2 LYS 11 -10.021 -19.374 -15.253 100 HG3 LYS 11 HG1 LYS 11 -9.532 -17.688 -15.082 101 HD2 LYS 11 HD2 LYS 11 -9.386 -17.410 -17.473 102 HD3 LYS 11 HD1 LYS 11 -9.624 -19.138 -17.738 103 HE2 LYS 11 HE2 LYS 11 -11.815 -18.446 -16.194 104 HE3 LYS 11 HE1 LYS 11 -11.612 -17.041 -17.240 105 HZ1 LYS 11 HZ1 LYS 11 -11.487 -19.756 -18.370 106 HZ2 LYS 11 HZ2 LYS 11 -11.896 -18.295 -19.134 107 HZ3 LYS 11 HZ3 LYS 11 -12.992 -19.034 -18.067 108 H ARG 12 H ARG 12 -6.439 -15.800 -13.891 109 HA ARG 12 HA ARG 12 -6.801 -14.301 -16.336 110 HB2 ARG 12 HB2 ARG 12 -6.342 -13.727 -13.505 111 HB3 ARG 12 HB1 ARG 12 -5.438 -12.658 -14.578 112 HG2 ARG 12 HG2 ARG 12 -8.413 -13.217 -14.781 113 HG3 ARG 12 HG1 ARG 12 -7.700 -11.764 -14.080 114 HD2 ARG 12 HD2 ARG 12 -7.694 -10.867 -16.143 115 HD3 ARG 12 HD1 ARG 12 -6.460 -12.044 -16.581 116 HE ARG 12 HE ARG 12 -8.815 -13.416 -16.861 117 HH11 ARG 12 HH11 ARG 12 -9.981 -13.473 -18.807 118 HH12 ARG 12 HH12 ARG 12 -9.808 -12.185 -19.952 119 HH21 ARG 12 HH21 ARG 12 -7.534 -10.419 -18.017 120 HH22 ARG 12 HH22 ARG 12 -8.421 -10.454 -19.504 121 H LYS 13 H LYS 13 -5.083 -12.960 -17.265 122 HA LYS 13 HA LYS 13 -3.098 -12.929 -18.451 123 HB2 LYS 13 HB2 LYS 13 -2.280 -13.195 -15.564 124 HB3 LYS 13 HB1 LYS 13 -1.081 -13.026 -16.848 125 HG2 LYS 13 HG2 LYS 13 -3.379 -11.117 -16.830 126 HG3 LYS 13 HG1 LYS 13 -2.106 -10.886 -15.631 127 HD2 LYS 13 HD2 LYS 13 -0.544 -10.306 -17.200 128 HD3 LYS 13 HD1 LYS 13 -1.196 -11.414 -18.409 129 HE2 LYS 13 HE2 LYS 13 -3.172 -9.845 -18.638 130 HE3 LYS 13 HE1 LYS 13 -2.290 -8.701 -17.626 131 HZ1 LYS 13 HZ1 LYS 13 -0.479 -8.738 -19.223 132 HZ2 LYS 13 HZ2 LYS 13 -1.928 -8.263 -19.970 133 HZ3 LYS 13 HZ3 LYS 13 -1.329 -9.836 -20.196 134 H PHE 14 H PHE 14 -4.385 -15.646 -17.873 135 HA PHE 14 HA PHE 14 -3.934 -17.850 -18.328 136 HB2 PHE 14 HB2 PHE 14 -1.306 -17.152 -19.551 137 HB3 PHE 14 HB1 PHE 14 -2.558 -18.252 -20.129 138 HD1 PHE 14 HD1 PHE 14 -4.944 -16.937 -20.471 139 HD2 PHE 14 HD2 PHE 14 -1.017 -15.234 -20.826 140 HE1 PHE 14 HE1 PHE 14 -5.854 -15.143 -21.923 141 HE2 PHE 14 HE2 PHE 14 -1.924 -13.440 -22.278 142 HZ PHE 14 HZ PHE 14 -4.344 -13.395 -22.826 143 HA PRO 15 HA PRO 15 -1.688 -19.584 -14.975 144 HB2 PRO 15 HB2 PRO 15 -0.519 -21.408 -17.042 145 HB3 PRO 15 HB1 PRO 15 -1.263 -21.805 -15.480 146 HG2 PRO 15 HG2 PRO 15 -2.553 -22.102 -17.823 147 HG3 PRO 15 HG1 PRO 15 -3.382 -21.703 -16.310 148 HD2 PRO 15 HD2 PRO 15 -2.948 -20.009 -18.681 149 HD3 PRO 15 HD1 PRO 15 -4.089 -19.793 -17.336 150 H TYR 16 H TYR 16 0.062 -18.633 -14.087 151 HA TYR 16 HA TYR 16 2.524 -18.417 -15.706 152 HB2 TYR 16 HB2 TYR 16 0.921 -16.265 -14.610 153 HB3 TYR 16 HB1 TYR 16 2.549 -16.245 -13.930 154 HD1 TYR 16 HD1 TYR 16 4.414 -16.927 -15.843 155 HD2 TYR 16 HD2 TYR 16 0.648 -14.972 -16.521 156 HE1 TYR 16 HE1 TYR 16 5.287 -15.979 -17.963 157 HE2 TYR 16 HE2 TYR 16 1.521 -14.025 -18.639 158 HH TYR 16 HH TYR 16 4.889 -14.583 -19.653 159 H LYS 17 H LYS 17 1.080 -19.640 -13.001 160 HA LYS 17 HA LYS 17 1.894 -20.696 -11.133 161 HB2 LYS 17 HB2 LYS 17 4.700 -20.141 -12.052 162 HB3 LYS 17 HB1 LYS 17 4.075 -21.539 -11.177 163 HG2 LYS 17 HG2 LYS 17 2.651 -21.983 -13.288 164 HG3 LYS 17 HG1 LYS 17 3.737 -20.850 -14.094 165 HD2 LYS 17 HD2 LYS 17 5.673 -22.243 -13.282 166 HD3 LYS 17 HD1 LYS 17 4.505 -23.428 -12.697 167 HE2 LYS 17 HE2 LYS 17 5.569 -23.238 -15.300 168 HE3 LYS 17 HE1 LYS 17 4.254 -24.286 -14.763 169 HZ1 LYS 17 HZ1 LYS 17 4.052 -21.555 -15.895 170 HZ2 LYS 17 HZ2 LYS 17 2.756 -22.324 -15.109 171 HZ3 LYS 17 HZ3 LYS 17 3.412 -22.992 -16.526 172 H SER 18 H SER 18 4.361 -18.202 -11.813 173 HA SER 18 HA SER 18 4.600 -17.423 -9.088 174 HB2 SER 18 HB2 SER 18 6.410 -17.089 -10.716 175 HB3 SER 18 HB1 SER 18 5.405 -15.949 -11.606 176 HG SER 18 HG SER 18 5.475 -15.320 -8.986 177 H GLU 19 H GLU 19 3.052 -15.851 -11.886 178 HA GLU 19 HA GLU 19 2.104 -13.549 -10.707 179 HB2 GLU 19 HB2 GLU 19 1.874 -14.215 -13.121 180 HB3 GLU 19 HB1 GLU 19 0.528 -15.250 -12.652 181 HG2 GLU 19 HG2 GLU 19 -0.660 -13.348 -13.158 182 HG3 GLU 19 HG1 GLU 19 -0.290 -12.987 -11.473 183 H CYS 20 H CYS 20 1.200 -16.801 -10.081 184 HA CYS 20 HA CYS 20 -1.289 -16.016 -8.741 185 HB2 CYS 20 HB2 CYS 20 -1.215 -18.051 -10.204 186 HB3 CYS 20 HB1 CYS 20 -0.099 -18.780 -9.047 187 H LEU 21 H LEU 21 1.739 -17.748 -7.985 188 HA LEU 21 HA LEU 21 1.256 -17.899 -5.186 189 HB2 LEU 21 HB2 LEU 21 3.002 -19.165 -6.664 190 HB3 LEU 21 HB1 LEU 21 4.020 -17.758 -6.364 191 HG LEU 21 HG LEU 21 3.535 -18.086 -3.884 192 HD11 LEU 21 HD11 LEU 21 2.020 -20.323 -5.072 193 HD12 LEU 21 HD12 LEU 21 1.815 -19.528 -3.513 194 HD13 LEU 21 HD13 LEU 21 3.044 -20.777 -3.710 195 HD21 LEU 21 HD21 LEU 21 5.611 -18.957 -3.995 196 HD22 LEU 21 HD22 LEU 21 5.332 -19.470 -5.660 197 HD23 LEU 21 HD23 LEU 21 4.903 -20.540 -4.324 198 H LYS 22 H LYS 22 2.445 -15.428 -7.300 199 HA LYS 22 HA LYS 22 3.884 -13.806 -5.532 200 HB2 LYS 22 HB2 LYS 22 3.832 -13.433 -7.952 201 HB3 LYS 22 HB1 LYS 22 2.123 -13.009 -7.862 202 HG2 LYS 22 HG2 LYS 22 2.609 -11.066 -6.506 203 HG3 LYS 22 HG1 LYS 22 4.305 -11.532 -6.366 204 HD2 LYS 22 HD2 LYS 22 4.822 -10.756 -8.445 205 HD3 LYS 22 HD1 LYS 22 3.302 -11.321 -9.138 206 HE2 LYS 22 HE2 LYS 22 2.128 -9.402 -8.450 207 HE3 LYS 22 HE1 LYS 22 3.340 -8.985 -7.237 208 HZ1 LYS 22 HZ1 LYS 22 4.157 -7.621 -8.773 209 HZ2 LYS 22 HZ2 LYS 22 3.241 -8.321 -10.022 210 HZ3 LYS 22 HZ3 LYS 22 4.732 -9.002 -9.572 211 H ALA 23 H ALA 23 0.419 -13.761 -6.359 212 HA ALA 23 HA ALA 23 -0.371 -11.645 -4.720 213 HB1 ALA 23 HB1 ALA 23 -1.728 -13.027 -6.459 214 HB2 ALA 23 HB2 ALA 23 -2.570 -12.386 -5.047 215 HB3 ALA 23 HB3 ALA 23 -2.093 -14.083 -5.093 216 H CYS 24 H CYS 24 0.152 -15.055 -3.983 217 HA CYS 24 HA CYS 24 -0.909 -15.018 -1.348 218 HB2 CYS 24 HB2 CYS 24 0.014 -16.967 -3.020 219 HB3 CYS 24 HB1 CYS 24 1.337 -16.858 -1.859 220 H ALA 25 H ALA 25 2.291 -14.323 -2.663 221 HA ALA 25 HA ALA 25 3.463 -14.016 -0.025 222 HB1 ALA 25 HB1 ALA 25 5.256 -12.934 -1.813 223 HB2 ALA 25 HB2 ALA 25 4.417 -14.138 -2.791 224 HB3 ALA 25 HB3 ALA 25 5.222 -14.621 -1.298 225 H THR 26 H THR 26 1.772 -12.063 -2.273 226 HA THR 26 HA THR 26 2.924 -9.547 -1.428 227 HB THR 26 HB THR 26 0.445 -10.152 -3.056 228 HG1 THR 26 HG1 THR 26 3.015 -9.259 -3.847 229 HG21 THR 26 HG21 THR 26 1.951 -7.569 -2.560 230 HG22 THR 26 HG22 THR 26 0.312 -7.942 -2.027 231 HG23 THR 26 HG23 THR 26 0.662 -7.770 -3.747 232 H SER 27 H SER 27 0.552 -11.682 -0.241 233 HA SER 27 HA SER 27 -1.469 -10.281 0.852 234 HB2 SER 27 HB2 SER 27 -1.177 -11.735 2.933 235 HB3 SER 27 HB1 SER 27 -1.313 -12.583 1.395 236 HG SER 27 HG SER 27 0.796 -12.391 3.142 237 H PHE 28 H PHE 28 1.903 -9.969 1.708 238 HA PHE 28 HA PHE 28 1.476 -7.457 2.987 239 HB2 PHE 28 HB2 PHE 28 0.695 -9.086 4.761 240 HB3 PHE 28 HB1 PHE 28 2.355 -9.679 4.835 241 HD1 PHE 28 HD1 PHE 28 0.165 -6.750 5.404 242 HD2 PHE 28 HD2 PHE 28 4.125 -8.363 5.819 243 HE1 PHE 28 HE1 PHE 28 0.774 -4.867 6.899 244 HE2 PHE 28 HE2 PHE 28 4.734 -6.479 7.314 245 HZ PHE 28 HZ PHE 28 3.060 -4.731 7.854 246 H THR 29 H THR 29 3.195 -6.403 2.245 247 HA THR 29 HA THR 29 5.759 -7.826 1.991 248 HB THR 29 HB THR 29 6.418 -5.913 0.560 249 HG1 THR 29 HG1 THR 29 4.744 -4.565 1.741 250 HG21 THR 29 HG21 THR 29 3.729 -6.905 -0.369 251 HG22 THR 29 HG22 THR 29 5.104 -8.001 -0.235 252 HG23 THR 29 HG23 THR 29 5.186 -6.613 -1.320 253 H GLY 30 H GLY 30 7.106 -7.612 3.652 254 HA2 GLY 30 HA2 GLY 30 7.635 -4.965 4.756 255 HA3 GLY 30 HA1 GLY 30 7.015 -6.161 5.890 256 H GLY 31 H GLY 31 8.494 -7.304 6.956 257 HA2 GLY 31 HA2 GLY 31 11.275 -7.050 6.466 258 HA3 GLY 31 HA1 GLY 31 10.526 -8.188 7.582 259 H ASP 32 H ASP 32 9.768 -10.228 6.745 260 HA ASP 32 HA ASP 32 10.190 -11.085 4.083 261 HB2 ASP 32 HB2 ASP 32 12.134 -12.712 4.886 262 HB3 ASP 32 HB1 ASP 32 12.483 -11.111 4.235 263 H GLU 33 H GLU 33 9.514 -13.223 3.757 264 HA GLU 33 HA GLU 33 7.948 -14.879 4.258 265 HB2 GLU 33 HB2 GLU 33 9.826 -15.563 6.501 266 HB3 GLU 33 HB1 GLU 33 9.003 -16.639 5.372 267 HG2 GLU 33 HG2 GLU 33 11.304 -14.770 4.750 268 HG3 GLU 33 HG1 GLU 33 11.341 -16.532 4.746 269 H SER 34 H SER 34 7.890 -16.084 7.013 270 HA SER 34 HA SER 34 6.608 -15.933 8.913 271 HB2 SER 34 HB2 SER 34 6.885 -12.938 8.689 272 HB3 SER 34 HB1 SER 34 6.648 -13.903 10.143 273 HG SER 34 HG SER 34 8.755 -14.922 9.248 274 H ARG 35 H ARG 35 5.098 -16.463 6.871 275 HA ARG 35 HA ARG 35 2.545 -15.700 7.445 276 HB2 ARG 35 HB2 ARG 35 2.127 -14.089 5.470 277 HB3 ARG 35 HB1 ARG 35 2.825 -13.427 6.945 278 HG2 ARG 35 HG2 ARG 35 5.051 -14.259 5.486 279 HG3 ARG 35 HG1 ARG 35 3.971 -13.595 4.262 280 HD2 ARG 35 HD2 ARG 35 5.134 -12.230 6.678 281 HD3 ARG 35 HD1 ARG 35 5.161 -11.705 4.996 282 HE ARG 35 HE ARG 35 2.566 -11.568 5.424 283 HH11 ARG 35 HH11 ARG 35 1.390 -9.997 6.565 284 HH12 ARG 35 HH12 ARG 35 2.138 -9.140 7.871 285 HH21 ARG 35 HH21 ARG 35 5.174 -10.785 7.564 286 HH22 ARG 35 HH22 ARG 35 4.279 -9.586 8.435 287 H ILE 36 H ILE 36 4.902 -16.544 5.040 288 HA ILE 36 HA ILE 36 3.073 -18.537 3.962 289 HB ILE 36 HB ILE 36 4.582 -16.862 1.985 290 HG12 ILE 36 HG12 ILE 36 3.042 -15.384 3.384 291 HG13 ILE 36 HG11 ILE 36 2.686 -15.423 1.661 292 HG21 ILE 36 HG21 ILE 36 2.076 -18.566 1.864 293 HG22 ILE 36 HG22 ILE 36 3.685 -19.064 1.345 294 HG23 ILE 36 HG23 ILE 36 2.843 -17.769 0.489 295 HD11 ILE 36 HD11 ILE 36 1.312 -17.522 3.201 296 HD12 ILE 36 HD12 ILE 36 0.678 -16.425 1.973 297 HD13 ILE 36 HD13 ILE 36 0.839 -15.882 3.643 298 H GLN 37 H GLN 37 6.325 -17.148 4.068 299 HA GLN 37 HA GLN 37 8.396 -18.107 3.814 300 HB2 GLN 37 HB2 GLN 37 7.065 -19.556 5.665 301 HB3 GLN 37 HB1 GLN 37 7.393 -20.813 4.472 302 HG2 GLN 37 HG2 GLN 37 9.332 -20.889 5.744 303 HG3 GLN 37 HG1 GLN 37 9.810 -19.772 4.470 304 HE21 GLN 37 HE21 GLN 37 7.624 -18.998 7.192 305 HE22 GLN 37 HE22 GLN 37 8.653 -17.846 7.894 306 H GLU 38 H GLU 38 6.252 -20.815 2.872 307 HA GLU 38 HA GLU 38 7.279 -20.636 0.132 308 HB2 GLU 38 HB2 GLU 38 8.604 -22.305 1.608 309 HB3 GLU 38 HB1 GLU 38 7.159 -23.307 1.503 310 HG2 GLU 38 HG2 GLU 38 8.506 -24.004 -0.315 311 HG3 GLU 38 HG1 GLU 38 7.299 -22.942 -1.036 312 H GLY 39 H GLY 39 5.938 -21.672 -1.402 313 HA2 GLY 39 HA2 GLY 39 3.456 -22.906 -0.569 314 HA3 GLY 39 HA1 GLY 39 3.261 -21.300 -1.265 315 H LYS 40 H LYS 40 2.142 -23.578 -2.421 316 HA LYS 40 HA LYS 40 3.793 -23.958 -4.839 317 HB2 LYS 40 HB2 LYS 40 3.298 -26.037 -3.574 318 HB3 LYS 40 HB1 LYS 40 1.576 -25.725 -3.783 319 HG2 LYS 40 HG2 LYS 40 1.963 -25.693 -6.273 320 HG3 LYS 40 HG1 LYS 40 3.613 -26.233 -5.967 321 HD2 LYS 40 HD2 LYS 40 1.076 -27.695 -5.178 322 HD3 LYS 40 HD1 LYS 40 2.191 -28.163 -6.462 323 HE2 LYS 40 HE2 LYS 40 3.964 -28.055 -4.479 324 HE3 LYS 40 HE1 LYS 40 2.529 -28.348 -3.496 325 HZ1 LYS 40 HZ1 LYS 40 2.411 -30.049 -5.700 326 HZ2 LYS 40 HZ2 LYS 40 2.628 -30.467 -4.068 327 HZ3 LYS 40 HZ3 LYS 40 3.976 -30.176 -5.060 328 HA PRO 41 HA PRO 41 0.300 -21.895 -6.769 329 HB2 PRO 41 HB2 PRO 41 1.277 -21.570 -9.212 330 HB3 PRO 41 HB1 PRO 41 2.099 -20.809 -7.831 331 HG2 PRO 41 HG2 PRO 41 2.824 -23.279 -9.334 332 HG3 PRO 41 HG1 PRO 41 3.864 -21.997 -8.700 333 HD2 PRO 41 HD2 PRO 41 3.349 -24.458 -7.425 334 HD3 PRO 41 HD1 PRO 41 4.061 -23.014 -6.669 335 H GLY 42 H GLY 42 -1.212 -22.188 -8.555 336 HA2 GLY 42 HA2 GLY 42 -1.249 -24.650 -10.061 337 HA3 GLY 42 HA1 GLY 42 -2.445 -24.596 -8.769 338 H PHE 43 H PHE 43 -3.257 -24.807 -11.393 339 HA PHE 43 HA PHE 43 -3.903 -22.216 -12.485 340 HB2 PHE 43 HB2 PHE 43 -5.582 -24.131 -13.654 341 HB3 PHE 43 HB1 PHE 43 -4.058 -23.525 -14.303 342 HD1 PHE 43 HD1 PHE 43 -5.755 -26.336 -12.754 343 HD2 PHE 43 HD2 PHE 43 -1.903 -24.700 -13.720 344 HE1 PHE 43 HE1 PHE 43 -4.725 -28.568 -12.425 345 HE2 PHE 43 HE2 PHE 43 -0.873 -26.932 -13.390 346 HZ PHE 43 HZ PHE 43 -2.283 -28.866 -12.742 347 H PHE 44 H PHE 44 -5.805 -21.102 -12.331 348 HA PHE 44 HA PHE 44 -7.827 -20.424 -11.469 349 HB2 PHE 44 HB2 PHE 44 -8.934 -22.130 -12.631 350 HB3 PHE 44 HB1 PHE 44 -8.184 -23.399 -11.665 351 HD1 PHE 44 HD1 PHE 44 -8.963 -23.893 -9.393 352 HD2 PHE 44 HD2 PHE 44 -10.857 -20.881 -11.799 353 HE1 PHE 44 HE1 PHE 44 -10.895 -23.867 -7.839 354 HE2 PHE 44 HE2 PHE 44 -12.788 -20.852 -10.243 355 HZ PHE 44 HZ PHE 44 -12.806 -22.345 -8.263 356 H LYS 45 H LYS 45 -5.510 -21.861 -9.713 357 HA LYS 45 HA LYS 45 -6.434 -20.863 -7.231 358 HB2 LYS 45 HB2 LYS 45 -6.950 -22.845 -6.032 359 HB3 LYS 45 HB1 LYS 45 -7.895 -22.921 -7.516 360 HG2 LYS 45 HG2 LYS 45 -6.002 -24.285 -8.520 361 HG3 LYS 45 HG1 LYS 45 -5.313 -24.377 -6.899 362 HD2 LYS 45 HD2 LYS 45 -8.066 -25.347 -7.724 363 HD3 LYS 45 HD1 LYS 45 -6.680 -26.366 -7.336 364 HE2 LYS 45 HE2 LYS 45 -7.692 -26.369 -5.269 365 HE3 LYS 45 HE1 LYS 45 -6.737 -24.896 -5.091 366 HZ1 LYS 45 HZ1 LYS 45 -9.208 -24.388 -6.406 367 HZ2 LYS 45 HZ2 LYS 45 -8.567 -23.674 -5.004 368 HZ3 LYS 45 HZ3 LYS 45 -9.465 -25.113 -4.893 369 H CYS 46 H CYS 46 -4.979 -21.442 -5.421 370 HA CYS 46 HA CYS 46 -2.476 -22.753 -6.054 371 HB2 CYS 46 HB2 CYS 46 -2.563 -19.767 -5.556 372 HB3 CYS 46 HB1 CYS 46 -1.095 -20.743 -5.532 373 H THR 47 H THR 47 -1.495 -23.513 -4.234 374 HA THR 47 HA THR 47 -2.737 -22.731 -1.666 375 HB THR 47 HB THR 47 -1.976 -24.970 -0.856 376 HG1 THR 47 HG1 THR 47 -1.676 -26.317 -2.981 377 HG21 THR 47 HG21 THR 47 -3.627 -26.253 -2.377 378 HG22 THR 47 HG22 THR 47 -3.868 -24.705 -3.186 379 HG23 THR 47 HG23 THR 47 -4.250 -24.872 -1.473 380 H CYS 48 H CYS 48 -1.522 -21.924 -0.086 381 HA CYS 48 HA CYS 48 1.419 -22.077 -0.344 382 HB2 CYS 48 HB2 CYS 48 0.292 -19.707 1.026 383 HB3 CYS 48 HB1 CYS 48 1.673 -19.829 -0.063 384 H TYR 49 H TYR 49 2.576 -22.205 1.648 385 HA TYR 49 HA TYR 49 0.881 -22.686 4.026 386 HB2 TYR 49 HB2 TYR 49 3.387 -24.270 3.543 387 HB3 TYR 49 HB1 TYR 49 2.004 -24.658 4.567 388 HD1 TYR 49 HD1 TYR 49 -0.252 -25.101 3.426 389 HD2 TYR 49 HD2 TYR 49 3.490 -25.059 1.319 390 HE1 TYR 49 HE1 TYR 49 -1.286 -26.371 1.563 391 HE2 TYR 49 HE2 TYR 49 2.456 -26.331 -0.545 392 HH TYR 49 HH TYR 49 -0.995 -27.239 -0.452 393 H PHE 50 H PHE 50 1.596 -21.735 5.879 394 HA PHE 50 HA PHE 50 4.024 -20.110 5.629 395 HB2 PHE 50 HB2 PHE 50 2.159 -18.823 6.340 396 HB3 PHE 50 HB1 PHE 50 1.677 -20.033 7.522 397 HD1 PHE 50 HD1 PHE 50 5.260 -19.286 7.150 398 HD2 PHE 50 HD2 PHE 50 1.663 -18.280 9.281 399 HE1 PHE 50 HE1 PHE 50 6.604 -18.151 8.886 400 HE2 PHE 50 HE2 PHE 50 3.018 -17.143 11.018 401 HZ PHE 50 HZ PHE 50 5.487 -17.079 10.822 402 H THR 51 H THR 51 5.718 -21.380 6.078 403 HA THR 51 HA THR 51 5.973 -23.536 7.740 404 HB THR 51 HB THR 51 8.066 -21.360 7.578 405 HG1 THR 51 HG1 THR 51 7.718 -23.520 5.794 406 HG21 THR 51 HG21 THR 51 7.949 -24.118 8.549 407 HG22 THR 51 HG22 THR 51 9.171 -22.880 8.834 408 HG23 THR 51 HG23 THR 51 9.237 -23.865 7.372 409 H THR 52 H THR 52 5.117 -23.705 9.724 410 HA THR 52 HA THR 52 6.023 -21.796 11.772 411 HB THR 52 HB THR 52 3.629 -22.032 12.746 412 HG1 THR 52 HG1 THR 52 2.181 -22.851 11.469 413 HG21 THR 52 HG21 THR 52 4.278 -19.879 12.082 414 HG22 THR 52 HG22 THR 52 2.857 -20.180 11.083 415 HG23 THR 52 HG23 THR 52 4.471 -20.356 10.395 416 H GLY 53 H GLY 53 7.069 -22.962 13.243 417 HA2 GLY 53 HA2 GLY 53 6.288 -25.766 13.688 418 HA3 GLY 53 HA1 GLY 53 7.829 -25.043 14.140 Start of MODEL 20 1 H1 GLU 1 H1 GLU 1 1.230 -30.146 6.822 2 H2 GLU 1 H2 GLU 1 0.021 -30.996 5.984 3 H3 GLU 1 H3 GLU 1 0.811 -31.717 7.303 4 HA GLU 1 HA GLU 1 -1.543 -30.263 7.342 5 HB2 GLU 1 HB2 GLU 1 0.319 -31.227 9.533 6 HB3 GLU 1 HB1 GLU 1 -1.335 -30.678 9.808 7 HG2 GLU 1 HG2 GLU 1 -2.255 -32.561 8.898 8 HG3 GLU 1 HG1 GLU 1 -0.991 -32.715 7.680 9 H VAL 2 H VAL 2 1.631 -29.092 7.462 10 HA VAL 2 HA VAL 2 1.678 -27.040 9.279 11 HB VAL 2 HB VAL 2 3.022 -25.788 7.473 12 HG11 VAL 2 HG11 VAL 2 4.582 -26.849 8.716 13 HG12 VAL 2 HG12 VAL 2 4.561 -28.113 7.487 14 HG13 VAL 2 HG13 VAL 2 3.553 -28.265 8.927 15 HG21 VAL 2 HG21 VAL 2 1.721 -27.203 5.676 16 HG22 VAL 2 HG22 VAL 2 2.939 -28.429 6.033 17 HG23 VAL 2 HG23 VAL 2 3.430 -26.847 5.425 18 H ILE 3 H ILE 3 1.085 -24.842 9.265 19 HA ILE 3 HA ILE 3 -1.422 -24.084 8.737 20 HB ILE 3 HB ILE 3 1.133 -22.527 8.586 21 HG12 ILE 3 HG12 ILE 3 -1.169 -21.777 10.306 22 HG13 ILE 3 HG11 ILE 3 -0.435 -23.342 10.652 23 HG21 ILE 3 HG21 ILE 3 -1.636 -21.559 7.851 24 HG22 ILE 3 HG22 ILE 3 -0.141 -21.372 6.934 25 HG23 ILE 3 HG23 ILE 3 -0.380 -20.464 8.427 26 HD11 ILE 3 HD11 ILE 3 1.436 -21.072 10.205 27 HD12 ILE 3 HD12 ILE 3 1.547 -22.417 11.342 28 HD13 ILE 3 HD13 ILE 3 0.501 -21.042 11.703 29 H LYS 4 H LYS 4 -2.734 -23.915 7.039 30 HA LYS 4 HA LYS 4 -1.542 -23.971 4.341 31 HB2 LYS 4 HB2 LYS 4 -3.015 -25.835 4.739 32 HB3 LYS 4 HB1 LYS 4 -4.283 -24.768 5.341 33 HG2 LYS 4 HG2 LYS 4 -3.282 -24.072 2.655 34 HG3 LYS 4 HG1 LYS 4 -4.098 -25.633 2.746 35 HD2 LYS 4 HD2 LYS 4 -5.314 -23.179 4.006 36 HD3 LYS 4 HD1 LYS 4 -5.547 -23.525 2.293 37 HE2 LYS 4 HE2 LYS 4 -5.994 -25.929 3.815 38 HE3 LYS 4 HE1 LYS 4 -6.975 -24.623 4.481 39 HZ1 LYS 4 HZ1 LYS 4 -8.010 -24.263 2.439 40 HZ2 LYS 4 HZ2 LYS 4 -7.950 -25.955 2.574 41 HZ3 LYS 4 HZ3 LYS 4 -6.845 -25.139 1.574 42 H LYS 5 H LYS 5 -1.628 -22.205 3.138 43 HA LYS 5 HA LYS 5 -3.798 -20.257 3.581 44 HB2 LYS 5 HB2 LYS 5 -0.865 -19.594 3.211 45 HB3 LYS 5 HB1 LYS 5 -2.178 -18.419 3.278 46 HG2 LYS 5 HG2 LYS 5 -1.985 -20.378 5.519 47 HG3 LYS 5 HG1 LYS 5 -0.778 -19.093 5.459 48 HD2 LYS 5 HD2 LYS 5 -2.386 -17.397 5.660 49 HD3 LYS 5 HD1 LYS 5 -3.699 -18.448 5.126 50 HE2 LYS 5 HE2 LYS 5 -3.487 -19.761 7.212 51 HE3 LYS 5 HE1 LYS 5 -2.197 -18.685 7.750 52 HZ1 LYS 5 HZ1 LYS 5 -3.637 -17.016 8.176 53 HZ2 LYS 5 HZ2 LYS 5 -4.728 -18.302 8.380 54 HZ3 LYS 5 HZ3 LYS 5 -4.695 -17.437 6.919 55 H ASP 6 H ASP 6 -4.931 -20.537 1.735 56 HA ASP 6 HA ASP 6 -3.452 -20.612 -0.818 57 HB2 ASP 6 HB2 ASP 6 -4.923 -22.510 -0.525 58 HB3 ASP 6 HB1 ASP 6 -6.275 -21.451 -0.126 59 H THR 7 H THR 7 -3.608 -18.963 -2.222 60 HA THR 7 HA THR 7 -5.441 -16.766 -1.525 61 HB THR 7 HB THR 7 -2.795 -16.585 -1.860 62 HG1 THR 7 HG1 THR 7 -3.171 -14.467 -2.035 63 HG21 THR 7 HG21 THR 7 -3.758 -15.830 -4.608 64 HG22 THR 7 HG22 THR 7 -3.208 -17.473 -4.276 65 HG23 THR 7 HG23 THR 7 -2.109 -16.112 -4.051 66 HA PRO 8 HA PRO 8 -7.461 -17.465 -5.429 67 HB2 PRO 8 HB2 PRO 8 -8.751 -15.148 -5.777 68 HB3 PRO 8 HB1 PRO 8 -9.059 -16.147 -4.342 69 HG2 PRO 8 HG2 PRO 8 -7.529 -13.626 -4.592 70 HG3 PRO 8 HG1 PRO 8 -8.455 -14.258 -3.222 71 HD2 PRO 8 HD2 PRO 8 -5.620 -14.431 -3.618 72 HD3 PRO 8 HD1 PRO 8 -6.575 -15.160 -2.310 73 H TYR 9 H TYR 9 -7.336 -17.164 -7.662 74 HA TYR 9 HA TYR 9 -5.600 -15.019 -8.690 75 HB2 TYR 9 HB2 TYR 9 -4.259 -17.106 -8.343 76 HB3 TYR 9 HB1 TYR 9 -5.328 -17.927 -9.479 77 HD1 TYR 9 HD1 TYR 9 -3.212 -14.843 -9.201 78 HD2 TYR 9 HD2 TYR 9 -4.801 -17.913 -11.749 79 HE1 TYR 9 HE1 TYR 9 -1.874 -13.963 -11.096 80 HE2 TYR 9 HE2 TYR 9 -3.466 -17.034 -13.643 81 HH TYR 9 HH TYR 9 -1.275 -15.662 -13.866 82 H LYS 10 H LYS 10 -7.780 -17.708 -9.468 83 HA LYS 10 HA LYS 10 -9.562 -17.808 -10.925 84 HB2 LYS 10 HB2 LYS 10 -9.514 -15.166 -10.337 85 HB3 LYS 10 HB1 LYS 10 -9.167 -15.110 -12.067 86 HG2 LYS 10 HG2 LYS 10 -11.146 -16.422 -12.563 87 HG3 LYS 10 HG1 LYS 10 -11.461 -16.665 -10.845 88 HD2 LYS 10 HD2 LYS 10 -12.658 -14.760 -10.816 89 HD3 LYS 10 HD1 LYS 10 -11.202 -13.863 -11.245 90 HE2 LYS 10 HE2 LYS 10 -11.669 -14.490 -13.666 91 HE3 LYS 10 HE1 LYS 10 -13.243 -15.072 -13.123 92 HZ1 LYS 10 HZ1 LYS 10 -13.983 -12.992 -12.736 93 HZ2 LYS 10 HZ2 LYS 10 -12.813 -12.578 -13.896 94 HZ3 LYS 10 HZ3 LYS 10 -12.470 -12.410 -12.241 95 H LYS 11 H LYS 11 -7.193 -15.633 -12.470 96 HA LYS 11 HA LYS 11 -5.729 -17.180 -14.058 97 HB2 LYS 11 HB2 LYS 11 -7.095 -17.347 -16.227 98 HB3 LYS 11 HB1 LYS 11 -7.463 -18.507 -14.956 99 HG2 LYS 11 HG2 LYS 11 -9.602 -17.787 -14.948 100 HG3 LYS 11 HG1 LYS 11 -9.045 -16.182 -14.473 101 HD2 LYS 11 HD2 LYS 11 -8.775 -15.511 -16.775 102 HD3 LYS 11 HD1 LYS 11 -9.070 -17.156 -17.342 103 HE2 LYS 11 HE2 LYS 11 -11.371 -17.049 -16.444 104 HE3 LYS 11 HE1 LYS 11 -11.078 -15.397 -15.898 105 HZ1 LYS 11 HZ1 LYS 11 -11.038 -14.599 -18.028 106 HZ2 LYS 11 HZ2 LYS 11 -12.182 -15.844 -18.195 107 HZ3 LYS 11 HZ3 LYS 11 -10.581 -16.084 -18.709 108 H ARG 12 H ARG 12 -5.937 -14.505 -13.083 109 HA ARG 12 HA ARG 12 -6.523 -12.476 -14.799 110 HB2 ARG 12 HB2 ARG 12 -5.116 -12.625 -12.487 111 HB3 ARG 12 HB1 ARG 12 -3.818 -12.267 -13.626 112 HG2 ARG 12 HG2 ARG 12 -5.617 -10.492 -14.514 113 HG3 ARG 12 HG1 ARG 12 -6.165 -10.602 -12.841 114 HD2 ARG 12 HD2 ARG 12 -3.713 -10.261 -12.179 115 HD3 ARG 12 HD1 ARG 12 -3.436 -9.796 -13.855 116 HE ARG 12 HE ARG 12 -5.628 -8.338 -12.763 117 HH11 ARG 12 HH11 ARG 12 -5.277 -6.156 -12.244 118 HH12 ARG 12 HH12 ARG 12 -3.660 -5.565 -12.055 119 HH21 ARG 12 HH21 ARG 12 -2.181 -8.631 -12.721 120 HH22 ARG 12 HH22 ARG 12 -1.907 -6.968 -12.324 121 H LYS 13 H LYS 13 -6.308 -12.774 -16.970 122 HA LYS 13 HA LYS 13 -5.268 -12.784 -19.019 123 HB2 LYS 13 HB2 LYS 13 -3.725 -11.164 -17.580 124 HB3 LYS 13 HB1 LYS 13 -2.567 -12.479 -17.789 125 HG2 LYS 13 HG2 LYS 13 -2.125 -11.307 -19.724 126 HG3 LYS 13 HG1 LYS 13 -3.436 -12.330 -20.314 127 HD2 LYS 13 HD2 LYS 13 -4.237 -10.267 -20.980 128 HD3 LYS 13 HD1 LYS 13 -4.933 -10.341 -19.361 129 HE2 LYS 13 HE2 LYS 13 -3.182 -8.980 -18.449 130 HE3 LYS 13 HE1 LYS 13 -2.228 -9.107 -19.928 131 HZ1 LYS 13 HZ1 LYS 13 -3.208 -7.196 -20.475 132 HZ2 LYS 13 HZ2 LYS 13 -4.428 -7.361 -19.304 133 HZ3 LYS 13 HZ3 LYS 13 -4.585 -8.127 -20.812 134 H PHE 14 H PHE 14 -2.297 -13.676 -19.027 135 HA PHE 14 HA PHE 14 -2.885 -16.475 -19.488 136 HB2 PHE 14 HB2 PHE 14 -0.581 -14.646 -19.994 137 HB3 PHE 14 HB1 PHE 14 -0.267 -16.380 -19.922 138 HD1 PHE 14 HD1 PHE 14 -0.838 -17.801 -21.726 139 HD2 PHE 14 HD2 PHE 14 -2.396 -13.801 -21.579 140 HE1 PHE 14 HE1 PHE 14 -1.718 -18.059 -24.029 141 HE2 PHE 14 HE2 PHE 14 -3.276 -14.059 -23.883 142 HZ PHE 14 HZ PHE 14 -2.936 -16.188 -25.108 143 HA PRO 15 HA PRO 15 -1.580 -17.791 -15.453 144 HB2 PRO 15 HB2 PRO 15 -1.048 -20.425 -16.040 145 HB3 PRO 15 HB1 PRO 15 -2.682 -19.775 -15.811 146 HG2 PRO 15 HG2 PRO 15 -1.232 -20.409 -18.323 147 HG3 PRO 15 HG1 PRO 15 -2.949 -20.593 -17.928 148 HD2 PRO 15 HD2 PRO 15 -1.969 -18.533 -19.458 149 HD3 PRO 15 HD1 PRO 15 -3.449 -18.411 -18.481 150 H TYR 16 H TYR 16 0.343 -18.240 -14.305 151 HA TYR 16 HA TYR 16 2.766 -18.953 -15.728 152 HB2 TYR 16 HB2 TYR 16 2.148 -16.280 -15.707 153 HB3 TYR 16 HB1 TYR 16 3.163 -16.433 -14.273 154 HD1 TYR 16 HD1 TYR 16 3.019 -17.413 -17.885 155 HD2 TYR 16 HD2 TYR 16 5.497 -16.518 -14.493 156 HE1 TYR 16 HE1 TYR 16 5.033 -17.537 -19.325 157 HE2 TYR 16 HE2 TYR 16 7.512 -16.642 -15.932 158 HH TYR 16 HH TYR 16 7.931 -18.028 -18.390 159 H LYS 17 H LYS 17 0.984 -19.606 -13.292 160 HA LYS 17 HA LYS 17 1.260 -20.332 -11.126 161 HB2 LYS 17 HB2 LYS 17 4.067 -20.759 -12.179 162 HB3 LYS 17 HB1 LYS 17 3.439 -21.438 -10.677 163 HG2 LYS 17 HG2 LYS 17 1.964 -22.872 -11.779 164 HG3 LYS 17 HG1 LYS 17 1.930 -21.877 -13.236 165 HD2 LYS 17 HD2 LYS 17 4.488 -23.209 -12.363 166 HD3 LYS 17 HD1 LYS 17 3.281 -24.107 -13.286 167 HE2 LYS 17 HE2 LYS 17 3.320 -22.126 -14.931 168 HE3 LYS 17 HE1 LYS 17 4.803 -21.634 -14.113 169 HZ1 LYS 17 HZ1 LYS 17 5.326 -23.010 -15.997 170 HZ2 LYS 17 HZ2 LYS 17 4.305 -24.245 -15.437 171 HZ3 LYS 17 HZ3 LYS 17 5.713 -23.849 -14.575 172 H SER 18 H SER 18 4.503 -18.957 -11.622 173 HA SER 18 HA SER 18 4.877 -17.839 -9.155 174 HB2 SER 18 HB2 SER 18 6.747 -17.647 -10.499 175 HB3 SER 18 HB1 SER 18 5.822 -17.093 -11.891 176 HG SER 18 HG SER 18 6.797 -15.684 -9.688 177 H GLU 19 H GLU 19 3.336 -16.259 -11.952 178 HA GLU 19 HA GLU 19 2.772 -13.793 -10.776 179 HB2 GLU 19 HB2 GLU 19 2.462 -14.433 -13.204 180 HB3 GLU 19 HB1 GLU 19 0.962 -15.228 -12.725 181 HG2 GLU 19 HG2 GLU 19 0.451 -12.970 -13.479 182 HG3 GLU 19 HG1 GLU 19 0.180 -13.071 -11.739 183 H CYS 20 H CYS 20 1.311 -16.901 -10.305 184 HA CYS 20 HA CYS 20 -0.994 -15.765 -8.896 185 HB2 CYS 20 HB2 CYS 20 -1.502 -17.630 -10.335 186 HB3 CYS 20 HB1 CYS 20 -0.222 -18.603 -9.610 187 H LEU 21 H LEU 21 1.841 -17.807 -8.293 188 HA LEU 21 HA LEU 21 1.385 -18.305 -5.564 189 HB2 LEU 21 HB2 LEU 21 3.179 -19.288 -7.160 190 HB3 LEU 21 HB1 LEU 21 4.136 -17.876 -6.711 191 HG LEU 21 HG LEU 21 2.889 -19.741 -4.680 192 HD11 LEU 21 HD11 LEU 21 5.776 -19.688 -5.594 193 HD12 LEU 21 HD12 LEU 21 4.594 -20.851 -6.197 194 HD13 LEU 21 HD13 LEU 21 5.022 -20.835 -4.486 195 HD21 LEU 21 HD21 LEU 21 4.502 -17.268 -4.622 196 HD22 LEU 21 HD22 LEU 21 5.096 -18.546 -3.564 197 HD23 LEU 21 HD23 LEU 21 3.446 -17.950 -3.385 198 H LYS 22 H LYS 22 2.848 -15.575 -7.254 199 HA LYS 22 HA LYS 22 3.979 -14.211 -5.101 200 HB2 LYS 22 HB2 LYS 22 4.381 -13.395 -7.314 201 HB3 LYS 22 HB1 LYS 22 2.656 -13.181 -7.616 202 HG2 LYS 22 HG2 LYS 22 2.505 -11.331 -6.163 203 HG3 LYS 22 HG1 LYS 22 4.018 -11.732 -5.349 204 HD2 LYS 22 HD2 LYS 22 5.276 -11.189 -7.398 205 HD3 LYS 22 HD1 LYS 22 3.766 -10.801 -8.225 206 HE2 LYS 22 HE2 LYS 22 3.358 -9.119 -6.318 207 HE3 LYS 22 HE1 LYS 22 5.061 -9.343 -5.919 208 HZ1 LYS 22 HZ1 LYS 22 3.846 -8.015 -8.197 209 HZ2 LYS 22 HZ2 LYS 22 5.221 -8.954 -8.538 210 HZ3 LYS 22 HZ3 LYS 22 5.311 -7.691 -7.405 211 H ALA 23 H ALA 23 0.688 -13.860 -6.456 212 HA ALA 23 HA ALA 23 -0.418 -11.989 -4.836 213 HB1 ALA 23 HB1 ALA 23 -1.447 -14.439 -6.125 214 HB2 ALA 23 HB2 ALA 23 -2.071 -12.790 -6.176 215 HB3 ALA 23 HB3 ALA 23 -2.428 -13.825 -4.794 216 H CYS 24 H CYS 24 0.273 -15.345 -3.997 217 HA CYS 24 HA CYS 24 -0.901 -15.393 -1.439 218 HB2 CYS 24 HB2 CYS 24 0.536 -17.172 -3.014 219 HB3 CYS 24 HB1 CYS 24 1.588 -16.909 -1.622 220 H ALA 25 H ALA 25 2.331 -14.432 -2.527 221 HA ALA 25 HA ALA 25 3.267 -13.843 0.135 222 HB1 ALA 25 HB1 ALA 25 4.785 -14.542 -1.709 223 HB2 ALA 25 HB2 ALA 25 5.264 -13.012 -0.972 224 HB3 ALA 25 HB3 ALA 25 4.439 -13.021 -2.531 225 H THR 26 H THR 26 1.431 -12.185 -2.237 226 HA THR 26 HA THR 26 2.087 -9.547 -1.140 227 HB THR 26 HB THR 26 0.009 -9.978 -3.250 228 HG1 THR 26 HG1 THR 26 1.649 -11.228 -4.020 229 HG21 THR 26 HG21 THR 26 0.647 -7.731 -2.234 230 HG22 THR 26 HG22 THR 26 0.753 -7.830 -3.992 231 HG23 THR 26 HG23 THR 26 2.217 -7.927 -3.012 232 H SER 27 H SER 27 -0.223 -12.044 -0.786 233 HA SER 27 HA SER 27 -2.635 -10.989 -0.260 234 HB2 SER 27 HB2 SER 27 -2.840 -13.070 0.555 235 HB3 SER 27 HB1 SER 27 -1.104 -13.190 0.828 236 HG SER 27 HG SER 27 -3.136 -12.624 2.571 237 H PHE 28 H PHE 28 -0.018 -10.968 2.174 238 HA PHE 28 HA PHE 28 -1.229 -8.517 3.303 239 HB2 PHE 28 HB2 PHE 28 -1.638 -10.462 4.775 240 HB3 PHE 28 HB1 PHE 28 0.100 -10.757 4.847 241 HD1 PHE 28 HD1 PHE 28 -2.389 -7.998 5.386 242 HD2 PHE 28 HD2 PHE 28 1.345 -9.772 6.557 243 HE1 PHE 28 HE1 PHE 28 -2.180 -6.347 7.226 244 HE2 PHE 28 HE2 PHE 28 1.552 -8.121 8.396 245 HZ PHE 28 HZ PHE 28 -0.210 -6.409 8.730 246 H THR 29 H THR 29 1.768 -10.454 3.567 247 HA THR 29 HA THR 29 3.970 -9.838 3.221 248 HB THR 29 HB THR 29 3.503 -7.006 2.631 249 HG1 THR 29 HG1 THR 29 2.352 -9.017 0.997 250 HG21 THR 29 HG21 THR 29 5.507 -8.654 2.164 251 HG22 THR 29 HG22 THR 29 5.099 -7.404 0.988 252 HG23 THR 29 HG23 THR 29 4.567 -9.066 0.730 253 H GLY 30 H GLY 30 5.005 -7.159 3.757 254 HA2 GLY 30 HA2 GLY 30 5.291 -5.643 5.547 255 HA3 GLY 30 HA1 GLY 30 4.260 -6.663 6.547 256 H GLY 31 H GLY 31 6.234 -8.766 5.031 257 HA2 GLY 31 HA2 GLY 31 8.728 -8.476 6.335 258 HA3 GLY 31 HA1 GLY 31 7.685 -9.514 7.301 259 H ASP 32 H ASP 32 9.904 -9.441 4.798 260 HA ASP 32 HA ASP 32 9.119 -11.312 2.939 261 HB2 ASP 32 HB2 ASP 32 11.679 -12.019 3.146 262 HB3 ASP 32 HB1 ASP 32 11.199 -10.475 2.444 263 H GLU 33 H GLU 33 8.751 -13.452 2.903 264 HA GLU 33 HA GLU 33 8.378 -15.587 3.669 265 HB2 GLU 33 HB2 GLU 33 10.892 -14.984 5.246 266 HB3 GLU 33 HB1 GLU 33 10.190 -16.587 5.027 267 HG2 GLU 33 HG2 GLU 33 10.310 -15.676 2.440 268 HG3 GLU 33 HG1 GLU 33 11.755 -14.951 3.142 269 H SER 34 H SER 34 6.627 -14.029 4.788 270 HA SER 34 HA SER 34 6.441 -15.038 7.533 271 HB2 SER 34 HB2 SER 34 7.340 -12.698 7.645 272 HB3 SER 34 HB1 SER 34 5.885 -12.146 6.820 273 HG SER 34 HG SER 34 6.266 -12.855 9.423 274 H ARG 35 H ARG 35 4.702 -16.290 7.354 275 HA ARG 35 HA ARG 35 2.334 -16.506 7.386 276 HB2 ARG 35 HB2 ARG 35 2.209 -13.977 6.866 277 HB3 ARG 35 HB1 ARG 35 2.158 -14.473 5.173 278 HG2 ARG 35 HG2 ARG 35 0.236 -15.997 5.774 279 HG3 ARG 35 HG1 ARG 35 0.217 -15.233 7.365 280 HD2 ARG 35 HD2 ARG 35 -0.303 -13.099 6.445 281 HD3 ARG 35 HD1 ARG 35 0.075 -13.633 4.809 282 HE ARG 35 HE ARG 35 -2.377 -14.208 6.306 283 HH11 ARG 35 HH11 ARG 35 -4.043 -15.096 5.043 284 HH12 ARG 35 HH12 ARG 35 -3.712 -15.621 3.426 285 HH21 ARG 35 HH21 ARG 35 -0.359 -14.744 3.547 286 HH22 ARG 35 HH22 ARG 35 -1.627 -15.419 2.578 287 H ILE 36 H ILE 36 4.713 -16.695 5.035 288 HA ILE 36 HA ILE 36 3.250 -18.835 3.670 289 HB ILE 36 HB ILE 36 4.830 -17.054 1.892 290 HG12 ILE 36 HG12 ILE 36 3.360 -15.529 3.321 291 HG13 ILE 36 HG11 ILE 36 3.058 -15.465 1.587 292 HG21 ILE 36 HG21 ILE 36 2.293 -18.689 1.691 293 HG22 ILE 36 HG22 ILE 36 3.861 -19.046 0.968 294 HG23 ILE 36 HG23 ILE 36 2.904 -17.687 0.375 295 HD11 ILE 36 HD11 ILE 36 0.947 -16.199 1.846 296 HD12 ILE 36 HD12 ILE 36 1.165 -15.985 3.583 297 HD13 ILE 36 HD13 ILE 36 1.476 -17.555 2.842 298 H GLN 37 H GLN 37 6.279 -17.111 2.958 299 HA GLN 37 HA GLN 37 8.475 -17.807 3.041 300 HB2 GLN 37 HB2 GLN 37 7.693 -18.696 5.339 301 HB3 GLN 37 HB1 GLN 37 7.586 -20.265 4.545 302 HG2 GLN 37 HG2 GLN 37 10.104 -18.868 3.978 303 HG3 GLN 37 HG1 GLN 37 9.867 -19.206 5.690 304 HE21 GLN 37 HE21 GLN 37 9.752 -20.837 2.483 305 HE22 GLN 37 HE22 GLN 37 10.210 -22.358 3.081 306 H GLU 38 H GLU 38 6.124 -20.426 2.552 307 HA GLU 38 HA GLU 38 7.375 -21.075 0.005 308 HB2 GLU 38 HB2 GLU 38 8.665 -22.479 1.507 309 HB3 GLU 38 HB1 GLU 38 7.188 -23.093 2.249 310 HG2 GLU 38 HG2 GLU 38 6.494 -24.064 0.103 311 HG3 GLU 38 HG1 GLU 38 7.945 -23.426 -0.668 312 H GLY 39 H GLY 39 5.966 -21.957 -1.428 313 HA2 GLY 39 HA2 GLY 39 3.501 -23.208 -0.648 314 HA3 GLY 39 HA1 GLY 39 3.260 -21.571 -1.249 315 H LYS 40 H LYS 40 2.134 -23.715 -2.573 316 HA LYS 40 HA LYS 40 3.843 -24.028 -4.961 317 HB2 LYS 40 HB2 LYS 40 1.910 -25.813 -3.604 318 HB3 LYS 40 HB1 LYS 40 1.854 -25.820 -5.368 319 HG2 LYS 40 HG2 LYS 40 3.449 -27.497 -4.720 320 HG3 LYS 40 HG1 LYS 40 4.370 -26.128 -5.344 321 HD2 LYS 40 HD2 LYS 40 4.606 -25.310 -2.967 322 HD3 LYS 40 HD1 LYS 40 3.886 -26.832 -2.438 323 HE2 LYS 40 HE2 LYS 40 6.411 -26.832 -2.440 324 HE3 LYS 40 HE1 LYS 40 5.688 -28.105 -3.423 325 HZ1 LYS 40 HZ1 LYS 40 7.515 -26.257 -4.262 326 HZ2 LYS 40 HZ2 LYS 40 6.046 -25.687 -4.893 327 HZ3 LYS 40 HZ3 LYS 40 6.576 -27.259 -5.257 328 HA PRO 41 HA PRO 41 0.652 -21.823 -7.159 329 HB2 PRO 41 HB2 PRO 41 1.312 -22.342 -9.674 330 HB3 PRO 41 HB1 PRO 41 2.511 -21.610 -8.585 331 HG2 PRO 41 HG2 PRO 41 2.286 -24.420 -9.533 332 HG3 PRO 41 HG1 PRO 41 3.725 -23.439 -9.230 333 HD2 PRO 41 HD2 PRO 41 2.565 -25.325 -7.438 334 HD3 PRO 41 HD1 PRO 41 3.858 -24.162 -7.071 335 H GLY 42 H GLY 42 -1.136 -21.994 -8.690 336 HA2 GLY 42 HA2 GLY 42 -2.083 -24.563 -9.584 337 HA3 GLY 42 HA1 GLY 42 -3.005 -23.923 -8.226 338 H PHE 43 H PHE 43 -3.789 -24.370 -11.063 339 HA PHE 43 HA PHE 43 -4.083 -21.767 -12.262 340 HB2 PHE 43 HB2 PHE 43 -5.627 -24.284 -12.921 341 HB3 PHE 43 HB1 PHE 43 -5.339 -22.893 -13.967 342 HD1 PHE 43 HD1 PHE 43 -2.873 -22.312 -14.517 343 HD2 PHE 43 HD2 PHE 43 -4.129 -26.099 -12.926 344 HE1 PHE 43 HE1 PHE 43 -0.763 -23.346 -15.315 345 HE2 PHE 43 HE2 PHE 43 -2.020 -27.133 -13.724 346 HZ PHE 43 HZ PHE 43 -0.337 -25.758 -14.917 347 H PHE 44 H PHE 44 -5.696 -20.322 -11.958 348 HA PHE 44 HA PHE 44 -7.674 -19.395 -11.234 349 HB2 PHE 44 HB2 PHE 44 -8.841 -22.054 -10.554 350 HB3 PHE 44 HB1 PHE 44 -9.594 -20.658 -11.321 351 HD1 PHE 44 HD1 PHE 44 -7.264 -20.238 -13.357 352 HD2 PHE 44 HD2 PHE 44 -9.600 -23.658 -12.216 353 HE1 PHE 44 HE1 PHE 44 -6.875 -21.247 -15.587 354 HE2 PHE 44 HE2 PHE 44 -9.209 -24.668 -14.445 355 HZ PHE 44 HZ PHE 44 -7.847 -23.462 -16.131 356 H LYS 45 H LYS 45 -5.478 -20.895 -9.449 357 HA LYS 45 HA LYS 45 -6.079 -19.679 -7.022 358 HB2 LYS 45 HB2 LYS 45 -6.720 -21.778 -5.711 359 HB3 LYS 45 HB1 LYS 45 -7.987 -21.050 -6.697 360 HG2 LYS 45 HG2 LYS 45 -7.774 -22.696 -8.387 361 HG3 LYS 45 HG1 LYS 45 -6.209 -23.234 -7.784 362 HD2 LYS 45 HD2 LYS 45 -7.433 -24.898 -6.818 363 HD3 LYS 45 HD1 LYS 45 -7.765 -23.680 -5.589 364 HE2 LYS 45 HE2 LYS 45 -9.492 -24.024 -8.050 365 HE3 LYS 45 HE1 LYS 45 -9.810 -24.870 -6.535 366 HZ1 LYS 45 HZ1 LYS 45 -9.489 -22.376 -5.664 367 HZ2 LYS 45 HZ2 LYS 45 -10.996 -23.034 -6.092 368 HZ3 LYS 45 HZ3 LYS 45 -10.143 -22.067 -7.198 369 H CYS 46 H CYS 46 -4.601 -20.263 -5.324 370 HA CYS 46 HA CYS 46 -2.505 -22.194 -6.056 371 HB2 CYS 46 HB2 CYS 46 -2.095 -19.268 -5.460 372 HB3 CYS 46 HB1 CYS 46 -0.812 -20.453 -5.228 373 H THR 47 H THR 47 -1.590 -23.236 -4.348 374 HA THR 47 HA THR 47 -2.726 -22.605 -1.691 375 HB THR 47 HB THR 47 -2.010 -24.957 -1.127 376 HG1 THR 47 HG1 THR 47 -1.671 -25.105 -3.937 377 HG21 THR 47 HG21 THR 47 -3.994 -24.418 -3.340 378 HG22 THR 47 HG22 THR 47 -4.314 -24.605 -1.615 379 HG23 THR 47 HG23 THR 47 -3.831 -26.001 -2.578 380 H CYS 48 H CYS 48 -1.428 -22.088 -0.012 381 HA CYS 48 HA CYS 48 1.478 -22.437 -0.311 382 HB2 CYS 48 HB2 CYS 48 0.548 -19.879 0.882 383 HB3 CYS 48 HB1 CYS 48 1.991 -20.219 -0.072 384 H TYR 49 H TYR 49 2.652 -22.319 1.706 385 HA TYR 49 HA TYR 49 0.941 -22.736 4.087 386 HB2 TYR 49 HB2 TYR 49 3.555 -24.165 3.578 387 HB3 TYR 49 HB1 TYR 49 2.364 -24.502 4.835 388 HD1 TYR 49 HD1 TYR 49 0.122 -25.436 4.216 389 HD2 TYR 49 HD2 TYR 49 3.299 -25.024 1.354 390 HE1 TYR 49 HE1 TYR 49 -1.049 -27.002 2.691 391 HE2 TYR 49 HE2 TYR 49 2.128 -26.591 -0.170 392 HH TYR 49 HH TYR 49 0.340 -27.859 -0.483 393 H PHE 50 H PHE 50 1.790 -21.963 6.066 394 HA PHE 50 HA PHE 50 3.860 -19.910 5.699 395 HB2 PHE 50 HB2 PHE 50 1.903 -18.982 6.664 396 HB3 PHE 50 HB1 PHE 50 1.723 -20.325 7.784 397 HD1 PHE 50 HD1 PHE 50 1.658 -18.904 9.757 398 HD2 PHE 50 HD2 PHE 50 5.030 -18.811 7.092 399 HE1 PHE 50 HE1 PHE 50 2.974 -17.670 11.456 400 HE2 PHE 50 HE2 PHE 50 6.340 -17.584 8.791 401 HZ PHE 50 HZ PHE 50 5.315 -17.011 10.974 402 H THR 51 H THR 51 5.822 -20.820 5.970 403 HA THR 51 HA THR 51 6.421 -22.974 7.697 404 HB THR 51 HB THR 51 8.240 -20.835 6.565 405 HG1 THR 51 HG1 THR 51 7.721 -23.486 5.712 406 HG21 THR 51 HG21 THR 51 9.918 -21.808 7.696 407 HG22 THR 51 HG22 THR 51 9.494 -23.377 7.013 408 HG23 THR 51 HG23 THR 51 8.745 -22.840 8.516 409 H THR 52 H THR 52 6.017 -22.839 9.830 410 HA THR 52 HA THR 52 7.465 -20.819 11.365 411 HB THR 52 HB THR 52 5.497 -19.596 11.339 412 HG1 THR 52 HG1 THR 52 4.442 -21.121 13.330 413 HG21 THR 52 HG21 THR 52 3.870 -20.656 10.159 414 HG22 THR 52 HG22 THR 52 3.290 -21.149 11.748 415 HG23 THR 52 HG23 THR 52 4.300 -22.242 10.801 416 H GLY 53 H GLY 53 8.243 -21.622 13.235 417 HA2 GLY 53 HA2 GLY 53 7.921 -23.002 15.227 418 HA3 GLY 53 HA1 GLY 53 7.164 -24.207 14.189
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