NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
21806 | 2i85 | 7220 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 H SER 1 -8.063 18.577 15.691 2 HA SER 1 HA SER 1 -6.240 16.417 15.376 3 HB3 SER 1 2HB SER 1 -5.714 16.369 17.659 4 HG SER 1 HG SER 1 -7.410 16.357 19.269 5 H LYS 2 H LYS 2 -7.661 16.382 13.536 6 HA LYS 2 HA LYS 2 -10.445 15.453 13.915 7 HB3 LYS 2 2HB LYS 2 -9.145 15.636 11.199 8 HG3 LYS 2 2HG LYS 2 -11.834 16.284 12.433 9 HD3 LYS 2 2HD LYS 2 -10.731 17.478 9.857 10 HE3 LYS 2 2HE LYS 2 -13.473 16.874 10.780 11 HZ1 LYS 2 3HZ LYS 2 -14.346 19.013 9.996 12 HZ2 LYS 2 1HZ LYS 2 -13.463 19.222 11.348 13 HZ3 LYS 2 2HZ LYS 2 -12.843 19.641 9.892 14 H SER 3 H SER 3 -11.181 13.510 12.685 15 HA SER 3 HA SER 3 -9.255 11.391 12.038 16 HB3 SER 3 2HB SER 3 -10.485 9.769 13.649 17 HG SER 3 HG SER 3 -8.992 10.257 15.296 18 H ILE 4 H ILE 4 -10.420 11.991 10.026 19 HA ILE 4 HA ILE 4 -13.041 10.593 9.657 20 HB ILE 4 HB ILE 4 -12.850 11.222 7.294 21 HG13 ILE 4 2HG1 ILE 4 -11.131 12.188 6.265 22 HG21 ILE 4 1HG2 ILE 4 -14.193 12.501 8.791 23 HG22 ILE 4 2HG2 ILE 4 -12.809 13.503 9.259 24 HG23 ILE 4 3HG2 ILE 4 -13.436 13.563 7.592 25 HD11 ILE 4 3HD1 ILE 4 -9.466 13.755 7.331 26 HD12 ILE 4 1HD1 ILE 4 -11.121 14.380 7.221 27 HD13 ILE 4 2HD1 ILE 4 -10.499 13.785 8.778 28 H VAL 5 H VAL 5 -12.457 9.488 7.117 29 HA VAL 5 HA VAL 5 -10.553 7.276 7.510 30 HB VAL 5 HB VAL 5 -12.619 5.778 6.764 31 HG11 VAL 5 1HG1 VAL 5 -11.159 5.376 8.695 32 HG12 VAL 5 2HG1 VAL 5 -12.139 6.497 9.668 33 HG13 VAL 5 3HG1 VAL 5 -12.849 4.993 9.031 34 HG21 VAL 5 3HG2 VAL 5 -14.689 6.247 7.900 35 HG22 VAL 5 1HG2 VAL 5 -14.031 7.712 8.642 36 HG23 VAL 5 2HG2 VAL 5 -14.312 7.651 6.886 37 H LEU 6 H LEU 6 -9.394 7.685 5.742 38 HA LEU 6 HA LEU 6 -10.712 7.581 3.046 39 HB3 LEU 6 2HB LEU 6 -8.508 8.612 2.249 40 HG LEU 6 HG LEU 6 -10.152 10.355 4.129 41 HD11 LEU 6 1HD1 LEU 6 -7.912 11.313 3.656 42 HD12 LEU 6 2HD1 LEU 6 -8.165 11.068 1.922 43 HD13 LEU 6 3HD1 LEU 6 -9.174 12.223 2.823 44 HD21 LEU 6 3HD2 LEU 6 -11.145 11.165 1.986 45 HD22 LEU 6 1HD2 LEU 6 -10.221 9.936 1.098 46 HD23 LEU 6 2HD2 LEU 6 -11.491 9.456 2.251 47 H GLU 7 H GLU 7 -8.812 6.803 1.483 48 HA GLU 7 HA GLU 7 -8.246 4.833 0.531 49 HB3 GLU 7 2HB GLU 7 -6.560 4.266 2.962 50 HG3 GLU 7 2HG GLU 7 -5.250 4.618 0.372 51 HA PRO 8 HA PRO 8 -10.846 2.255 3.567 52 HB3 PRO 8 2HB PRO 8 -12.762 3.536 3.445 53 HG3 PRO 8 2HG PRO 8 -13.308 4.769 1.508 54 HD3 PRO 8 2HD PRO 8 -11.133 5.440 1.815 55 H ILE 9 H ILE 9 -9.664 0.403 3.081 56 HA ILE 9 HA ILE 9 -10.220 -0.986 0.495 57 HB ILE 9 HB ILE 9 -8.147 -1.930 2.437 58 HG13 ILE 9 2HG1 ILE 9 -6.389 -0.671 1.275 59 HG21 ILE 9 1HG2 ILE 9 -8.741 -3.412 0.607 60 HG22 ILE 9 2HG2 ILE 9 -8.450 -2.123 -0.578 61 HG23 ILE 9 3HG2 ILE 9 -7.106 -2.788 0.365 62 HD11 ILE 9 3HD1 ILE 9 -6.967 1.395 0.069 63 HD12 ILE 9 1HD1 ILE 9 -7.398 -0.040 -0.847 64 HD13 ILE 9 2HD1 ILE 9 -8.660 0.899 -0.012 65 H TYR 10 H TYR 10 -11.964 -2.165 0.640 66 HA TYR 10 HA TYR 10 -12.359 -4.033 2.945 67 HB3 TYR 10 2HB TYR 10 -14.722 -3.944 2.548 68 HD1 TYR 10 2HD TYR 10 -13.405 -2.750 4.732 69 HD2 TYR 10 1HD TYR 10 -15.215 -0.777 1.341 70 HE1 TYR 10 2HE TYR 10 -13.742 -0.697 6.102 71 HE2 TYR 10 1HE TYR 10 -15.585 1.259 2.725 72 HH TYR 10 HH TYR 10 -14.566 1.447 6.154 73 H TRP 11 H TRP 11 -10.726 -5.208 1.754 74 HA TRP 11 HA TRP 11 -10.122 -7.119 0.754 75 HB3 TRP 11 2HB TRP 11 -11.714 -8.753 0.130 76 HD1 TRP 11 HD TRP 11 -11.211 -7.540 3.133 77 HE1 TRP 11 1HE TRP 11 -13.022 -7.701 4.933 78 HE3 TRP 11 3HE TRP 11 -15.268 -8.306 0.117 79 HZ2 TRP 11 2HZ TRP 11 -15.899 -7.942 5.049 80 HZ3 TRP 11 3HZ TRP 11 -17.551 -8.442 1.093 81 HH2 TRP 11 HH TRP 11 -17.873 -8.256 3.550 82 H ASN 12 H ASN 12 -12.470 -5.642 -1.458 83 HA ASN 12 HA ASN 12 -10.528 -4.619 -3.282 84 HB3 ASN 12 2HB ASN 12 -12.107 -6.995 -4.392 85 HD21 ASN 12 2HD2 ASN 12 -12.531 -6.079 -6.457 86 HD22 ASN 12 1HD2 ASN 12 -11.245 -5.484 -7.502 87 H SER 13 H SER 13 -12.107 -2.996 -2.250 88 HA SER 13 HA SER 13 -14.728 -2.825 -3.683 89 HB3 SER 13 2HB SER 13 -13.899 -1.173 -1.287 90 HG SER 13 HG SER 13 -16.247 -1.213 -1.101 91 H SER 14 H SER 14 -15.465 -0.585 -4.188 92 HA SER 14 HA SER 14 -13.584 0.748 -5.965 93 HB3 SER 14 2HB SER 14 -16.219 1.919 -5.031 94 HG SER 14 HG SER 14 -16.137 2.506 -7.325 95 H ASN 15 H ASN 15 -12.573 2.716 -5.698 96 HA ASN 15 HA ASN 15 -12.499 3.885 -2.940 97 HB3 ASN 15 2HB ASN 15 -10.070 4.233 -4.609 98 HD21 ASN 15 2HD2 ASN 15 -10.135 1.767 -2.172 99 HD22 ASN 15 1HD2 ASN 15 -9.550 2.773 -0.866 100 H SER 16 H SER 16 -11.570 6.224 -2.999 101 HA SER 16 HA SER 16 -13.296 7.891 -4.570 102 HB3 SER 16 2HB SER 16 -11.247 8.237 -2.532 103 HG SER 16 HG SER 16 -10.722 10.391 -3.128 104 H LYS 17 H LYS 17 -9.907 6.975 -5.030 105 HA LYS 17 HA LYS 17 -9.623 8.410 -7.558 106 HB3 LYS 17 2HB LYS 17 -7.334 7.285 -7.507 107 HG3 LYS 17 2HG LYS 17 -6.609 8.340 -5.309 108 HD3 LYS 17 2HD LYS 17 -8.134 9.969 -7.380 109 HE3 LYS 17 2HE LYS 17 -6.591 10.931 -4.940 110 HZ1 LYS 17 3HZ LYS 17 -6.878 13.132 -5.946 111 HZ2 LYS 17 1HZ LYS 17 -5.931 12.216 -6.904 112 HZ3 LYS 17 2HZ LYS 17 -7.489 12.487 -7.311 113 H PHE 18 H PHE 18 -10.350 5.084 -6.714 114 HA PHE 18 HA PHE 18 -10.628 3.176 -7.978 115 HB3 PHE 18 2HB PHE 18 -12.341 5.272 -9.326 116 HD1 PHE 18 2HD PHE 18 -12.714 1.594 -8.512 117 HD2 PHE 18 1HD PHE 18 -12.923 4.684 -11.517 118 HE1 PHE 18 2HE PHE 18 -13.510 -0.074 -10.179 119 HE2 PHE 18 1HE PHE 18 -13.707 3.021 -13.184 120 HZ PHE 18 HZ PHE 18 -13.997 0.638 -12.516 121 H LEU 19 H LEU 19 -8.232 3.395 -8.542 122 HA LEU 19 HA LEU 19 -6.473 3.581 -9.961 123 HB3 LEU 19 2HB LEU 19 -7.149 1.278 -9.929 124 HG LEU 19 HG LEU 19 -9.065 1.864 -11.972 125 HD11 LEU 19 1HD1 LEU 19 -7.145 1.666 -13.608 126 HD12 LEU 19 2HD1 LEU 19 -6.846 0.036 -13.000 127 HD13 LEU 19 3HD1 LEU 19 -8.381 0.419 -13.813 128 HD21 LEU 19 3HD2 LEU 19 -9.527 -0.539 -11.868 129 HD22 LEU 19 1HD2 LEU 19 -7.986 -0.817 -11.020 130 HD23 LEU 19 2HD2 LEU 19 -9.282 0.126 -10.241 131 HA PRO 20 HA PRO 20 -8.391 6.620 -12.831 132 HB3 PRO 20 2HB PRO 20 -8.321 8.277 -11.244 133 HG3 PRO 20 2HG PRO 20 -6.706 8.281 -9.537 134 HD3 PRO 20 2HD PRO 20 -7.324 6.029 -9.366 135 H GLY 21 H GLY 21 -5.422 5.145 -12.753 136 HA2 GLY 21 2HA GLY 21 -4.377 4.808 -15.026 137 H GLN 22 H GLN 22 -3.716 6.094 -11.969 138 HA GLN 22 HA GLN 22 -0.830 5.307 -12.045 139 HB3 GLN 22 2HB GLN 22 -2.352 7.512 -10.670 140 HG3 GLN 22 2HG GLN 22 0.308 6.401 -9.691 141 HE21 GLN 22 2HE2 GLN 22 1.358 8.526 -10.185 142 HE22 GLN 22 1HE2 GLN 22 0.968 9.881 -9.142 143 H GLY 23 H GLY 23 -3.849 4.969 -10.152 144 HA2 GLY 23 2HA GLY 23 -4.033 2.567 -9.279 145 H LEU 24 H LEU 24 -2.633 4.237 -6.543 146 HA LEU 24 HA LEU 24 -5.279 5.312 -5.764 147 HB3 LEU 24 2HB LEU 24 -3.953 3.634 -3.668 148 HG LEU 24 HG LEU 24 -6.643 4.622 -4.335 149 HD11 LEU 24 1HD1 LEU 24 -6.958 2.428 -5.399 150 HD12 LEU 24 2HD1 LEU 24 -6.394 1.615 -3.920 151 HD13 LEU 24 3HD1 LEU 24 -7.900 2.550 -3.905 152 HD21 LEU 24 3HD2 LEU 24 -7.123 3.964 -2.049 153 HD22 LEU 24 1HD2 LEU 24 -5.623 3.008 -1.975 154 HD23 LEU 24 2HD2 LEU 24 -5.555 4.781 -2.130 155 H VAL 25 H VAL 25 -4.925 7.342 -5.236 156 HA VAL 25 HA VAL 25 -2.334 8.308 -4.206 157 HB VAL 25 HB VAL 25 -4.983 9.739 -4.644 158 HG11 VAL 25 1HG1 VAL 25 -3.727 10.997 -2.998 159 HG12 VAL 25 2HG1 VAL 25 -2.232 10.846 -3.953 160 HG13 VAL 25 3HG1 VAL 25 -3.592 11.825 -4.546 161 HG21 VAL 25 3HG2 VAL 25 -3.854 10.696 -6.630 162 HG22 VAL 25 1HG2 VAL 25 -2.402 9.747 -6.256 163 HG23 VAL 25 2HG2 VAL 25 -3.899 8.933 -6.752 164 H LEU 26 H LEU 26 -1.867 8.784 -2.142 165 HA LEU 26 HA LEU 26 -3.930 8.325 -0.022 166 HB3 LEU 26 2HB LEU 26 -1.572 8.425 1.332 167 HG LEU 26 HG LEU 26 -1.349 5.997 1.263 168 HD11 LEU 26 1HD1 LEU 26 -3.031 7.055 2.743 169 HD12 LEU 26 2HD1 LEU 26 -4.271 6.827 1.490 170 HD13 LEU 26 3HD1 LEU 26 -3.484 5.422 2.231 171 HD21 LEU 26 3HD2 LEU 26 -2.766 4.570 -0.051 172 HD22 LEU 26 1HD2 LEU 26 -3.636 5.954 -0.746 173 HD23 LEU 26 2HD2 LEU 26 -1.939 5.676 -1.153 174 H TYR 27 H TYR 27 -3.850 9.726 1.795 175 HA TYR 27 HA TYR 27 -3.143 12.552 1.132 176 HB3 TYR 27 2HB TYR 27 -5.059 12.739 3.081 177 HD1 TYR 27 2HD TYR 27 -4.387 14.861 1.820 178 HD2 TYR 27 1HD TYR 27 -6.782 11.709 0.095 179 HE1 TYR 27 2HE TYR 27 -5.295 16.471 0.154 180 HE2 TYR 27 1HE TYR 27 -7.716 13.332 -1.557 181 HH TYR 27 HH TYR 27 -6.730 16.779 -1.612 182 HA PRO 28 HA PRO 28 -0.556 11.502 4.714 183 HB3 PRO 28 2HB PRO 28 1.278 11.254 3.386 184 HG3 PRO 28 2HG PRO 28 1.498 12.486 1.376 185 HD3 PRO 28 2HD PRO 28 -0.657 11.619 1.086 186 H GLN 29 H GLN 29 -2.514 12.941 5.391 187 HA GLN 29 HA GLN 29 -1.604 15.620 6.344 188 HB3 GLN 29 2HB GLN 29 -4.387 15.804 5.976 189 HG3 GLN 29 2HG GLN 29 -3.789 17.139 3.915 190 HE21 GLN 29 2HE2 GLN 29 -3.636 19.401 4.326 191 HE22 GLN 29 1HE2 GLN 29 -3.184 20.013 5.910 192 H ILE 30 H ILE 30 -1.935 16.109 8.363 193 HA ILE 30 HA ILE 30 -2.753 14.077 10.274 194 HB ILE 30 HB ILE 30 -2.171 17.003 10.792 195 HG13 ILE 30 2HG1 ILE 30 0.115 16.439 11.315 196 HG21 ILE 30 1HG2 ILE 30 -3.297 15.866 12.661 197 HG22 ILE 30 2HG2 ILE 30 -2.115 14.549 12.609 198 HG23 ILE 30 3HG2 ILE 30 -1.609 16.179 13.080 199 HD11 ILE 30 3HD1 ILE 30 1.173 14.315 10.613 200 HD12 ILE 30 1HD1 ILE 30 0.063 14.074 11.971 201 HD13 ILE 30 2HD1 ILE 30 -0.419 13.609 10.325 202 H GLY 31 H GLY 31 -4.718 13.637 10.895 203 HA2 GLY 31 2HA GLY 31 -6.916 14.689 11.683 204 H ASP 32 H ASP 32 -5.618 12.762 9.149 205 HA ASP 32 HA ASP 32 -8.202 11.384 8.613 206 HB3 ASP 32 2HB ASP 32 -5.716 11.846 6.943 207 H LYS 33 H LYS 33 -7.982 9.095 7.962 208 HA LYS 33 HA LYS 33 -5.839 7.532 9.241 209 HB3 LYS 33 2HB LYS 33 -7.273 6.195 10.594 210 HG3 LYS 33 2HG LYS 33 -8.456 8.979 11.036 211 HD3 LYS 33 2HD LYS 33 -8.571 8.257 13.387 212 HE3 LYS 33 2HE LYS 33 -10.228 7.267 11.256 213 HZ1 LYS 33 3HZ LYS 33 -11.116 5.309 12.376 214 HZ2 LYS 33 1HZ LYS 33 -9.541 5.039 12.030 215 HZ3 LYS 33 2HZ LYS 33 -9.997 5.399 13.562 216 H LEU 34 H LEU 34 -5.729 5.436 8.414 217 HA LEU 34 HA LEU 34 -7.599 4.712 6.246 218 HB3 LEU 34 2HB LEU 34 -6.227 5.476 4.728 219 HG LEU 34 HG LEU 34 -3.794 5.424 4.562 220 HD11 LEU 34 1HD1 LEU 34 -5.227 7.469 5.123 221 HD12 LEU 34 2HD1 LEU 34 -4.551 7.336 6.752 222 HD13 LEU 34 3HD1 LEU 34 -3.487 7.568 5.360 223 HD21 LEU 34 3HD2 LEU 34 -2.357 5.442 6.495 224 HD22 LEU 34 1HD2 LEU 34 -3.740 5.132 7.565 225 HD23 LEU 34 2HD2 LEU 34 -3.234 3.900 6.390 226 H ASP 35 H ASP 35 -8.132 2.782 6.136 227 HA ASP 35 HA ASP 35 -6.855 0.720 7.857 228 HB3 ASP 35 2HB ASP 35 -8.774 1.236 9.018 229 H ILE 36 H ILE 36 -5.904 -0.723 6.701 230 HA ILE 36 HA ILE 36 -7.069 -1.577 4.122 231 HB ILE 36 HB ILE 36 -4.656 -0.981 4.174 232 HG13 ILE 36 2HG1 ILE 36 -5.830 -2.457 2.499 233 HG21 ILE 36 1HG2 ILE 36 -4.123 -2.081 6.415 234 HG22 ILE 36 2HG2 ILE 36 -4.185 -3.646 5.577 235 HG23 ILE 36 3HG2 ILE 36 -3.001 -2.411 5.105 236 HD11 ILE 36 3HD1 ILE 36 -3.882 -3.200 1.361 237 HD12 ILE 36 1HD1 ILE 36 -3.447 -1.699 2.201 238 HD13 ILE 36 2HD1 ILE 36 -2.953 -3.269 2.858 239 H ILE 37 H ILE 37 -8.242 -3.370 4.031 240 HA ILE 37 HA ILE 37 -7.924 -5.551 6.032 241 HB ILE 37 HB ILE 37 -10.549 -4.285 5.157 242 HG13 ILE 37 2HG1 ILE 37 -9.149 -3.269 7.191 243 HG21 ILE 37 1HG2 ILE 37 -10.785 -6.724 5.224 244 HG22 ILE 37 2HG2 ILE 37 -10.053 -6.780 6.837 245 HG23 ILE 37 3HG2 ILE 37 -11.633 -6.013 6.589 246 HD11 ILE 37 3HD1 ILE 37 -11.200 -2.749 8.404 247 HD12 ILE 37 1HD1 ILE 37 -11.373 -2.508 6.656 248 HD13 ILE 37 2HD1 ILE 37 -12.099 -3.932 7.434 249 H CYS 38 H CYS 38 -7.489 -7.352 4.916 250 HA CYS 38 HA CYS 38 -8.885 -7.866 2.353 251 HB3 CYS 38 2HB CYS 38 -6.534 -7.024 1.975 252 HA PRO 39 HA PRO 39 -9.542 -11.627 4.705 253 HB3 PRO 39 2HB PRO 39 -11.677 -11.489 3.799 254 HG3 PRO 39 2HG PRO 39 -12.030 -10.788 1.617 255 HD3 PRO 39 2HD PRO 39 -10.456 -9.162 1.926 256 H LYS 40 H LYS 40 -8.427 -11.865 1.365 257 HA LYS 40 HA LYS 40 -7.221 -13.270 0.129 258 HB3 LYS 40 2HB LYS 40 -5.973 -14.909 2.275 259 HG3 LYS 40 2HG LYS 40 -3.930 -13.490 1.286 260 HD3 LYS 40 2HD LYS 40 -4.188 -14.991 -0.954 261 HE3 LYS 40 2HE LYS 40 -2.938 -15.308 1.599 262 HZ1 LYS 40 3HZ LYS 40 -2.884 -17.765 1.651 263 HZ2 LYS 40 1HZ LYS 40 -4.410 -17.238 1.913 264 HZ3 LYS 40 2HZ LYS 40 -4.017 -17.848 0.470 265 H VAL 41 H VAL 41 -7.068 -15.375 -0.697 266 HA VAL 41 HA VAL 41 -9.300 -17.210 -0.290 267 HB VAL 41 HB VAL 41 -8.541 -17.092 -2.471 268 HG11 VAL 41 1HG1 VAL 41 -6.339 -16.096 -2.296 269 HG12 VAL 41 2HG1 VAL 41 -5.670 -17.619 -1.648 270 HG13 VAL 41 3HG1 VAL 41 -6.294 -17.534 -3.303 271 HG21 VAL 41 3HG2 VAL 41 -7.869 -19.331 -3.080 272 HG22 VAL 41 1HG2 VAL 41 -7.244 -19.643 -1.458 273 HG23 VAL 41 2HG2 VAL 41 -8.983 -19.400 -1.715 274 H ASP 42 H ASP 42 -9.450 -18.547 1.378 275 HA ASP 42 HA ASP 42 -7.254 -20.288 2.190 276 HB3 ASP 42 2HB ASP 42 -6.473 -18.607 3.541 277 H SER 43 H SER 43 -9.893 -19.333 4.314 278 HA SER 43 HA SER 43 -11.079 -22.011 4.503 279 HB3 SER 43 2HB SER 43 -11.635 -19.263 5.709 280 HG SER 43 HG SER 43 -13.009 -20.386 7.140 281 H LYS 44 H LYS 44 -11.834 -18.823 3.122 282 HA LYS 44 HA LYS 44 -14.562 -19.476 2.325 283 HB3 LYS 44 2HB LYS 44 -14.632 -17.257 1.434 284 HG3 LYS 44 2HG LYS 44 -13.827 -15.780 3.147 285 HD3 LYS 44 2HD LYS 44 -14.492 -18.449 4.479 286 HE3 LYS 44 2HE LYS 44 -13.627 -15.974 5.596 287 HZ1 LYS 44 3HZ LYS 44 -15.550 -15.513 7.005 288 HZ2 LYS 44 1HZ LYS 44 -15.952 -15.241 5.446 289 HZ3 LYS 44 2HZ LYS 44 -16.471 -16.596 6.204 290 H THR 45 H THR 45 -11.513 -19.856 0.839 291 HA THR 45 HA THR 45 -10.741 -20.368 -1.228 292 HB THR 45 HB THR 45 -12.944 -22.408 -1.320 293 HG1 THR 45 1HG THR 45 -11.705 -23.552 0.216 294 HG21 THR 45 3HG2 THR 45 -11.041 -23.877 -1.949 295 HG22 THR 45 1HG2 THR 45 -11.147 -22.507 -3.056 296 HG23 THR 45 2HG2 THR 45 -9.912 -22.517 -1.782 297 H VAL 46 H VAL 46 -11.896 -18.126 -1.761 298 HA VAL 46 HA VAL 46 -13.521 -18.447 -4.267 299 HB VAL 46 HB VAL 46 -13.962 -15.846 -3.603 300 HG11 VAL 46 1HG1 VAL 46 -15.642 -17.466 -4.254 301 HG12 VAL 46 2HG1 VAL 46 -15.535 -18.271 -2.668 302 HG13 VAL 46 3HG1 VAL 46 -16.159 -16.607 -2.797 303 HG21 VAL 46 3HG2 VAL 46 -14.508 -15.596 -1.275 304 HG22 VAL 46 1HG2 VAL 46 -14.020 -17.253 -0.917 305 HG23 VAL 46 2HG2 VAL 46 -12.798 -16.037 -1.379 306 H GLY 47 H GLY 47 -10.822 -16.479 -2.906 307 HA2 GLY 47 2HA GLY 47 -10.242 -15.045 -5.299 308 H GLN 48 H GLN 48 -9.604 -18.390 -4.488 309 HA GLN 48 HA GLN 48 -8.515 -20.120 -5.493 310 HB3 GLN 48 2HB GLN 48 -8.848 -20.067 -8.092 311 HG3 GLN 48 2HG GLN 48 -11.040 -20.052 -6.001 312 HE21 GLN 48 2HE2 GLN 48 -13.180 -20.347 -6.647 313 HE22 GLN 48 1HE2 GLN 48 -13.665 -20.423 -8.338 314 H TYR 49 H TYR 49 -6.482 -19.552 -4.625 315 HA TYR 49 HA TYR 49 -4.285 -18.976 -4.621 316 HB3 TYR 49 2HB TYR 49 -4.684 -20.566 -7.108 317 HD1 TYR 49 1HD TYR 49 -1.666 -19.445 -5.088 318 HD2 TYR 49 2HD TYR 49 -3.378 -20.271 -8.969 319 HE1 TYR 49 1HE TYR 49 0.469 -18.756 -6.196 320 HE2 TYR 49 2HE TYR 49 -1.260 -19.566 -10.062 321 HH TYR 49 HH TYR 49 0.838 -18.682 -9.753 322 H GLU 50 H GLU 50 -5.092 -16.746 -4.492 323 HA GLU 50 HA GLU 50 -3.431 -15.176 -6.297 324 HB3 GLU 50 2HB GLU 50 -5.554 -13.411 -6.057 325 HG3 GLU 50 2HG GLU 50 -6.110 -13.834 -8.385 326 H TYR 51 H TYR 51 -2.185 -13.946 -5.221 327 HA TYR 51 HA TYR 51 -2.919 -12.649 -2.695 328 HB3 TYR 51 2HB TYR 51 -1.989 -14.927 -2.102 329 HD1 TYR 51 1HD TYR 51 1.139 -12.961 -2.185 330 HD2 TYR 51 2HD TYR 51 -0.965 -16.352 -3.838 331 HE1 TYR 51 1HE TYR 51 3.285 -13.855 -3.095 332 HE2 TYR 51 2HE TYR 51 1.185 -17.247 -4.727 333 HH TYR 51 HH TYR 51 3.443 -16.925 -4.930 334 H TYR 52 H TYR 52 -1.480 -10.914 -2.227 335 HA TYR 52 HA TYR 52 0.226 -9.948 -4.485 336 HB3 TYR 52 2HB TYR 52 -0.895 -7.768 -4.389 337 HD1 TYR 52 1HD TYR 52 -1.010 -10.077 -6.378 338 HD2 TYR 52 2HD TYR 52 -4.087 -8.039 -4.140 339 HE1 TYR 52 1HE TYR 52 -2.667 -10.635 -8.133 340 HE2 TYR 52 2HE TYR 52 -5.739 -8.589 -5.914 341 HH TYR 52 HH TYR 52 -6.094 -9.605 -7.948 342 H LYS 53 H LYS 53 1.578 -8.158 -3.914 343 HA LYS 53 HA LYS 53 2.242 -7.869 -1.038 344 HB3 LYS 53 2HB LYS 53 3.451 -9.755 -1.450 345 HG3 LYS 53 2HG LYS 53 4.503 -8.609 -4.068 346 HD3 LYS 53 2HD LYS 53 5.357 -10.946 -2.333 347 HE3 LYS 53 2HE LYS 53 5.477 -10.783 -5.373 348 HZ1 LYS 53 3HZ LYS 53 6.705 -12.876 -5.134 349 HZ2 LYS 53 1HZ LYS 53 7.560 -11.644 -4.499 350 HZ3 LYS 53 2HZ LYS 53 6.790 -12.693 -3.509 351 H VAL 54 H VAL 54 1.494 -5.877 -1.198 352 HA VAL 54 HA VAL 54 2.640 -3.711 -2.797 353 HB VAL 54 HB VAL 54 0.838 -3.962 -0.417 354 HG11 VAL 54 1HG1 VAL 54 2.290 -2.279 0.523 355 HG12 VAL 54 2HG1 VAL 54 2.273 -1.419 -1.027 356 HG13 VAL 54 3HG1 VAL 54 0.796 -1.511 -0.048 357 HG21 VAL 54 3HG2 VAL 54 -0.615 -2.567 -1.722 358 HG22 VAL 54 1HG2 VAL 54 0.714 -2.079 -2.790 359 HG23 VAL 54 2HG2 VAL 54 0.095 -3.734 -2.849 360 H TYR 55 H TYR 55 4.494 -2.609 -2.476 361 HA TYR 55 HA TYR 55 5.917 -2.730 0.137 362 HB3 TYR 55 2HB TYR 55 8.023 -3.169 -1.310 363 HD1 TYR 55 1HD TYR 55 7.672 -4.244 1.119 364 HD2 TYR 55 2HD TYR 55 6.489 -6.051 -2.615 365 HE1 TYR 55 1HE TYR 55 8.126 -6.520 2.060 366 HE2 TYR 55 2HE TYR 55 6.965 -8.304 -1.673 367 HH TYR 55 HH TYR 55 7.734 -9.508 0.139 368 H MET 56 H MET 56 6.908 -0.876 0.638 369 HA MET 56 HA MET 56 6.699 1.447 -1.069 370 HB3 MET 56 2HB MET 56 6.456 1.818 1.260 371 HG3 MET 56 2HG MET 56 9.109 0.417 1.560 372 HE1 MET 56 3HE MET 56 10.683 1.439 4.777 373 HE2 MET 56 1HE MET 56 9.646 0.045 4.412 374 HE3 MET 56 2HE MET 56 10.825 0.608 3.212 375 H VAL 57 H VAL 57 8.011 2.213 -2.548 376 HA VAL 57 HA VAL 57 10.894 1.808 -2.569 377 HB VAL 57 HB VAL 57 10.980 0.820 -4.781 378 HG11 VAL 57 1HG1 VAL 57 11.183 -0.684 -2.819 379 HG12 VAL 57 2HG1 VAL 57 9.465 -1.108 -3.025 380 HG13 VAL 57 3HG1 VAL 57 10.626 -1.468 -4.315 381 HG21 VAL 57 3HG2 VAL 57 9.070 -0.399 -5.772 382 HG22 VAL 57 1HG2 VAL 57 7.998 0.287 -4.537 383 HG23 VAL 57 2HG2 VAL 57 8.796 1.345 -5.728 384 H ASP 58 H ASP 58 11.932 3.114 -4.241 385 HA ASP 58 HA ASP 58 10.701 5.655 -4.634 386 HB3 ASP 58 2HB ASP 58 12.695 6.194 -5.923 387 H LYS 59 H LYS 59 10.415 6.809 -6.750 388 HA LYS 59 HA LYS 59 8.723 5.564 -8.637 389 HB3 LYS 59 2HB LYS 59 9.090 8.067 -8.308 390 HG3 LYS 59 2HG LYS 59 11.339 7.545 -10.318 391 HD3 LYS 59 2HD LYS 59 10.571 10.217 -9.142 392 HE3 LYS 59 2HE LYS 59 11.970 9.730 -11.771 393 HZ1 LYS 59 3HZ LYS 59 13.260 11.627 -11.025 394 HZ2 LYS 59 1HZ LYS 59 11.680 11.996 -10.848 395 HZ3 LYS 59 2HZ LYS 59 12.586 11.600 -9.544 396 H ASP 60 H ASP 60 12.221 5.514 -8.526 397 HA ASP 60 HA ASP 60 12.783 4.689 -11.199 398 HB3 ASP 60 2HB ASP 60 14.360 3.867 -8.730 399 H GLN 61 H GLN 61 11.868 2.856 -8.312 400 HA GLN 61 HA GLN 61 12.099 0.217 -9.576 401 HB3 GLN 61 2HB GLN 61 10.903 -0.418 -7.408 402 HG3 GLN 61 2HG GLN 61 12.727 0.000 -5.872 403 HE21 GLN 61 2HE2 GLN 61 15.437 0.144 -6.666 404 HE22 GLN 61 1HE2 GLN 61 15.713 -1.202 -7.768 405 H ALA 62 H ALA 62 9.485 2.584 -8.903 406 HA ALA 62 HA ALA 62 7.348 1.071 -10.056 407 HB1 ALA 62 3HB ALA 62 6.147 3.110 -10.106 408 HB2 ALA 62 1HB ALA 62 7.227 3.292 -8.715 409 HB3 ALA 62 2HB ALA 62 7.605 4.090 -10.250 410 H ASP 63 H ASP 63 9.940 2.925 -11.584 411 HA ASP 63 HA ASP 63 8.856 2.844 -14.239 412 HB3 ASP 63 2HB ASP 63 11.816 3.083 -13.716 413 H ARG 64 H ARG 64 11.217 0.783 -12.527 414 HA ARG 64 HA ARG 64 11.567 -1.096 -14.756 415 HB3 ARG 64 2HB ARG 64 12.539 -2.496 -12.702 416 HG3 ARG 64 2HG ARG 64 14.670 -1.319 -12.772 417 HD3 ARG 64 2HD ARG 64 13.909 -1.098 -15.628 418 HE ARG 64 HE ARG 64 16.060 -2.267 -14.131 419 HH11 ARG 64 1HH2 ARG 64 14.291 -2.857 -17.100 420 HH12 ARG 64 2HH2 ARG 64 15.586 -3.792 -17.795 421 HH21 ARG 64 1HH1 ARG 64 17.665 -3.498 -15.077 422 HH22 ARG 64 2HH1 ARG 64 17.439 -4.141 -16.675 423 H CYS 65 H CYS 65 9.202 -0.805 -12.286 424 HA CYS 65 HA CYS 65 7.536 -2.071 -11.549 425 HB3 CYS 65 2HB CYS 65 7.523 -4.147 -13.677 426 H THR 66 H THR 66 9.993 -2.485 -10.490 427 HA THR 66 HA THR 66 9.749 -5.294 -9.586 428 HB THR 66 HB THR 66 12.231 -5.460 -9.444 429 HG1 THR 66 1HG THR 66 13.480 -3.997 -10.523 430 HG21 THR 66 3HG2 THR 66 12.638 -5.957 -11.753 431 HG22 THR 66 1HG2 THR 66 10.912 -6.275 -11.489 432 HG23 THR 66 2HG2 THR 66 11.415 -4.792 -12.305 433 H ILE 67 H ILE 67 10.405 -5.722 -7.452 434 HA ILE 67 HA ILE 67 10.208 -3.330 -5.676 435 HB ILE 67 HB ILE 67 10.149 -6.219 -4.745 436 HG13 ILE 67 2HG1 ILE 67 7.701 -6.118 -4.669 437 HG21 ILE 67 1HG2 ILE 67 10.561 -4.619 -2.997 438 HG22 ILE 67 2HG2 ILE 67 9.210 -3.594 -3.544 439 HG23 ILE 67 3HG2 ILE 67 8.918 -5.210 -2.873 440 HD11 ILE 67 3HD1 ILE 67 6.407 -4.578 -6.026 441 HD12 ILE 67 1HD1 ILE 67 7.330 -3.623 -4.869 442 HD13 ILE 67 2HD1 ILE 67 7.870 -3.742 -6.555 443 H LYS 68 H LYS 68 11.813 -2.993 -3.995 444 HA LYS 68 HA LYS 68 14.548 -3.789 -4.741 445 HB3 LYS 68 2HB LYS 68 14.240 -2.445 -2.120 446 HG3 LYS 68 2HG LYS 68 15.481 -0.615 -3.376 447 HD3 LYS 68 2HD LYS 68 16.661 -3.420 -3.554 448 HE3 LYS 68 2HE LYS 68 17.774 -1.620 -5.001 449 HZ1 LYS 68 3HZ LYS 68 19.283 -0.190 -3.755 450 HZ2 LYS 68 1HZ LYS 68 17.758 0.178 -3.312 451 HZ3 LYS 68 2HZ LYS 68 18.709 -0.712 -2.320 452 H LYS 69 H LYS 69 15.667 -5.521 -3.826 453 HA LYS 69 HA LYS 69 14.477 -7.410 -2.096 454 HB3 LYS 69 2HB LYS 69 16.492 -7.775 -3.582 455 HG3 LYS 69 2HG LYS 69 17.957 -6.589 -1.183 456 HD3 LYS 69 2HD LYS 69 19.462 -7.266 -3.640 457 HE3 LYS 69 2HE LYS 69 20.170 -8.301 -0.915 458 HZ1 LYS 69 3HZ LYS 69 22.291 -7.305 -1.483 459 HZ2 LYS 69 1HZ LYS 69 21.793 -8.185 -2.764 460 HZ3 LYS 69 2HZ LYS 69 21.675 -6.553 -2.789 461 H GLU 70 H GLU 70 15.922 -4.421 -1.200 462 HA GLU 70 HA GLU 70 16.295 -5.022 1.634 463 HB3 GLU 70 2HB GLU 70 16.709 -2.623 1.857 464 HG3 GLU 70 2HG GLU 70 18.115 -3.512 -0.680 465 H ASN 71 H ASN 71 13.517 -4.899 -0.082 466 HA ASN 71 HA ASN 71 11.677 -3.639 1.699 467 HB3 ASN 71 2HB ASN 71 11.150 -4.356 -0.619 468 HD21 ASN 71 2HD2 ASN 71 9.512 -6.389 -1.372 469 HD22 ASN 71 1HD2 ASN 71 10.410 -7.897 -1.442 470 H THR 72 H THR 72 10.044 -4.940 2.824 471 HA THR 72 HA THR 72 10.408 -7.352 4.200 472 HB THR 72 HB THR 72 11.846 -5.083 5.432 473 HG1 THR 72 1HG THR 72 13.006 -6.709 6.256 474 HG21 THR 72 3HG2 THR 72 11.470 -5.769 7.770 475 HG22 THR 72 1HG2 THR 72 10.038 -5.020 7.079 476 HG23 THR 72 2HG2 THR 72 10.106 -6.792 7.263 477 HA PRO 73 HA PRO 73 6.690 -5.066 6.040 478 HB3 PRO 73 2HB PRO 73 7.319 -2.987 6.782 479 HG3 PRO 73 2HG PRO 73 8.670 -1.575 5.514 480 HD3 PRO 73 2HD PRO 73 9.984 -3.449 5.250 481 H LEU 74 H LEU 74 6.316 -6.649 4.227 482 HA LEU 74 HA LEU 74 5.037 -5.809 1.794 483 HB3 LEU 74 2HB LEU 74 6.082 -8.152 2.772 484 HG LEU 74 HG LEU 74 3.674 -8.670 3.766 485 HD11 LEU 74 1HD1 LEU 74 2.757 -8.011 1.330 486 HD12 LEU 74 2HD1 LEU 74 3.250 -9.624 0.922 487 HD13 LEU 74 3HD1 LEU 74 2.039 -9.357 2.212 488 HD21 LEU 74 3HD2 LEU 74 3.992 -11.029 3.214 489 HD22 LEU 74 1HD2 LEU 74 5.100 -10.590 1.890 490 HD23 LEU 74 2HD2 LEU 74 5.554 -10.279 3.576 491 H LEU 75 H LEU 75 2.932 -5.524 1.281 492 HA LEU 75 HA LEU 75 0.815 -5.988 3.291 493 HB3 LEU 75 2HB LEU 75 0.332 -3.481 1.850 494 HG LEU 75 HG LEU 75 1.053 -3.520 4.779 495 HD11 LEU 75 1HD1 LEU 75 0.552 -1.420 3.638 496 HD12 LEU 75 2HD1 LEU 75 -1.006 -2.044 3.080 497 HD13 LEU 75 3HD1 LEU 75 -0.719 -1.780 4.815 498 HD21 LEU 75 3HD2 LEU 75 -1.381 -3.992 5.317 499 HD22 LEU 75 1HD2 LEU 75 -1.538 -4.679 3.687 500 HD23 LEU 75 2HD2 LEU 75 -0.421 -5.378 4.872 501 H ASN 76 H ASN 76 -1.284 -4.852 1.748 502 HA ASN 76 HA ASN 76 -2.702 -5.153 0.052 503 HB3 ASN 76 2HB ASN 76 -0.993 -7.064 -1.523 504 HD21 ASN 76 2HD2 ASN 76 -4.016 -6.157 -1.522 505 HD22 ASN 76 1HD2 ASN 76 -4.164 -5.539 -3.154 506 H CYS 77 H CYS 77 -1.051 -8.365 0.311 507 HA CYS 77 HA CYS 77 -2.555 -9.668 2.147 508 HB3 CYS 77 2HB CYS 77 -3.900 -10.916 -0.140 509 H ALA 78 H ALA 78 -0.537 -10.798 2.473 510 HA ALA 78 HA ALA 78 0.570 -12.458 0.313 511 HB1 ALA 78 3HB ALA 78 2.182 -13.086 2.280 512 HB2 ALA 78 1HB ALA 78 2.252 -11.499 1.542 513 HB3 ALA 78 2HB ALA 78 1.421 -11.722 3.106 514 H LYS 79 H LYS 79 1.063 -14.680 0.491 515 HA LYS 79 HA LYS 79 -0.914 -16.454 1.629 516 HB3 LYS 79 2HB LYS 79 1.035 -18.179 1.109 517 HG3 LYS 79 2HG LYS 79 -0.497 -16.657 -1.029 518 HD3 LYS 79 2HD LYS 79 1.391 -18.145 -1.885 519 HE3 LYS 79 2HE LYS 79 -0.467 -20.349 -0.870 520 HZ1 LYS 79 3HZ LYS 79 1.235 -21.803 -1.765 521 HZ2 LYS 79 1HZ LYS 79 0.711 -20.836 -2.970 522 HZ3 LYS 79 2HZ LYS 79 2.156 -20.547 -2.257 523 HA PRO 80 HA PRO 80 1.896 -17.579 5.204 524 HB3 PRO 80 2HB PRO 80 4.034 -17.933 4.416 525 HG3 PRO 80 2HG PRO 80 5.149 -16.339 3.024 526 HD3 PRO 80 2HD PRO 80 3.181 -16.956 1.924 527 H ASP 81 H ASP 81 0.066 -15.676 5.240 528 HA ASP 81 HA ASP 81 0.504 -14.285 7.713 529 HB3 ASP 81 2HB ASP 81 -0.332 -12.195 5.824 530 H GLN 82 H GLN 82 -1.552 -15.184 5.053 531 HA GLN 82 HA GLN 82 -3.735 -15.441 4.765 532 HB3 GLN 82 2HB GLN 82 -4.305 -15.290 7.726 533 HG3 GLN 82 2HG GLN 82 -5.176 -17.444 5.778 534 HE21 GLN 82 2HE2 GLN 82 -7.947 -16.409 6.171 535 HE22 GLN 82 1HE2 GLN 82 -8.406 -16.869 7.821 536 H ASP 83 H ASP 83 -5.797 -14.117 6.751 537 HA ASP 83 HA ASP 83 -6.335 -11.783 5.231 538 HB3 ASP 83 2HB ASP 83 -8.058 -12.987 6.530 539 H ILE 84 H ILE 84 -5.507 -9.791 5.287 540 HA ILE 84 HA ILE 84 -3.802 -9.032 7.613 541 HB ILE 84 HB ILE 84 -3.002 -9.047 4.943 542 HG13 ILE 84 2HG1 ILE 84 -1.914 -7.500 7.339 543 HG21 ILE 84 1HG2 ILE 84 -4.319 -6.887 4.534 544 HG22 ILE 84 2HG2 ILE 84 -3.263 -6.110 5.721 545 HG23 ILE 84 3HG2 ILE 84 -2.587 -6.812 4.236 546 HD11 ILE 84 3HD1 ILE 84 -0.269 -9.346 7.429 547 HD12 ILE 84 1HD1 ILE 84 -1.900 -9.980 7.685 548 HD13 ILE 84 2HD1 ILE 84 -1.116 -10.166 6.103 549 H LYS 85 H LYS 85 -4.307 -7.442 8.803 550 HA LYS 85 HA LYS 85 -6.195 -5.403 7.877 551 HB3 LYS 85 2HB LYS 85 -7.566 -7.128 8.997 552 HG3 LYS 85 2HG LYS 85 -5.792 -7.590 10.881 553 HD3 LYS 85 2HD LYS 85 -7.505 -5.851 12.609 554 HE3 LYS 85 2HE LYS 85 -4.556 -6.590 12.431 555 HZ1 LYS 85 3HZ LYS 85 -4.303 -5.369 14.515 556 HZ2 LYS 85 1HZ LYS 85 -4.697 -4.356 13.303 557 HZ3 LYS 85 2HZ LYS 85 -5.826 -4.781 14.413 558 H PHE 86 H PHE 86 -5.448 -3.472 8.311 559 HA PHE 86 HA PHE 86 -3.964 -2.919 10.771 560 HB3 PHE 86 2HB PHE 86 -2.380 -1.648 8.761 561 HD1 PHE 86 2HD PHE 86 -1.922 -1.330 11.425 562 HD2 PHE 86 1HD PHE 86 -0.858 -4.787 9.066 563 HE1 PHE 86 2HE PHE 86 -0.188 -1.938 13.096 564 HE2 PHE 86 1HE PHE 86 0.895 -5.376 10.726 565 HZ PHE 86 HZ PHE 86 1.219 -3.963 12.750 566 H THR 87 H THR 87 -4.476 -0.960 11.514 567 HA THR 87 HA THR 87 -5.569 1.058 9.614 568 HB THR 87 HB THR 87 -7.426 0.176 10.856 569 HG1 THR 87 1HG THR 87 -8.156 2.172 11.527 570 HG21 THR 87 3HG2 THR 87 -7.749 0.504 13.227 571 HG22 THR 87 1HG2 THR 87 -6.304 -0.490 12.989 572 HG23 THR 87 2HG2 THR 87 -6.139 1.233 13.407 573 H ILE 88 H ILE 88 -4.483 2.800 9.516 574 HA ILE 88 HA ILE 88 -2.656 3.607 11.745 575 HB ILE 88 HB ILE 88 -2.234 3.573 8.764 576 HG13 ILE 88 2HG1 ILE 88 -1.169 1.893 10.128 577 HG21 ILE 88 1HG2 ILE 88 -2.127 6.011 9.263 578 HG22 ILE 88 2HG2 ILE 88 -0.918 5.687 10.533 579 HG23 ILE 88 3HG2 ILE 88 -0.584 5.346 8.817 580 HD11 ILE 88 3HD1 ILE 88 1.204 2.196 9.788 581 HD12 ILE 88 1HD1 ILE 88 0.361 2.868 8.375 582 HD13 ILE 88 2HD1 ILE 88 1.029 3.943 9.630 583 H LYS 89 H LYS 89 -2.867 5.534 12.518 584 HA LYS 89 HA LYS 89 -4.938 7.376 11.414 585 HB3 LYS 89 2HB LYS 89 -5.781 6.051 13.296 586 HG3 LYS 89 2HG LYS 89 -4.119 7.589 15.267 587 HD3 LYS 89 2HD LYS 89 -5.126 4.737 15.456 588 HE3 LYS 89 2HE LYS 89 -5.021 6.926 17.568 589 HZ1 LYS 89 3HZ LYS 89 -5.083 5.047 19.062 590 HZ2 LYS 89 1HZ LYS 89 -6.330 4.870 18.025 591 HZ3 LYS 89 2HZ LYS 89 -4.981 3.967 17.846 592 H PHE 90 H PHE 90 -4.232 9.333 10.996 593 HA PHE 90 HA PHE 90 -1.436 10.019 11.470 594 HB3 PHE 90 2HB PHE 90 -2.108 12.147 10.374 595 HD1 PHE 90 2HD PHE 90 -3.201 8.768 9.000 596 HD2 PHE 90 1HD PHE 90 -0.802 12.335 8.545 597 HE1 PHE 90 2HE PHE 90 -2.038 7.751 7.064 598 HE2 PHE 90 1HE PHE 90 0.327 11.330 6.601 599 HZ PHE 90 HZ PHE 90 -0.347 9.066 5.799 600 H GLN 91 H GLN 91 -1.597 9.851 13.793 601 HA GLN 91 HA GLN 91 -2.986 11.944 15.271 602 HB3 GLN 91 2HB GLN 91 -0.867 10.283 16.591 603 HG3 GLN 91 2HG GLN 91 -2.539 11.633 17.906 604 HE21 GLN 91 2HE2 GLN 91 -4.542 12.616 17.226 605 HE22 GLN 91 1HE2 GLN 91 -5.946 11.658 16.785 606 H GLU 92 H GLU 92 -1.854 13.426 16.777 607 HA GLU 92 HA GLU 92 -0.102 15.062 15.266 608 HB3 GLU 92 2HB GLU 92 -0.239 15.489 18.228 609 HG3 GLU 92 2HG GLU 92 -1.465 17.412 16.321 610 H PHE 93 H PHE 93 0.553 12.957 18.034 611 HA PHE 93 HA PHE 93 3.456 12.881 17.483 612 HB3 PHE 93 2HB PHE 93 3.206 12.838 20.301 613 HD1 PHE 93 2HD PHE 93 3.327 15.878 18.068 614 HD2 PHE 93 1HD PHE 93 5.503 13.191 20.650 615 HE1 PHE 93 2HE PHE 93 5.370 17.257 17.778 616 HE2 PHE 93 1HE PHE 93 7.534 14.597 20.394 617 HZ PHE 93 HZ PHE 93 7.480 16.615 18.937 618 H SER 94 H SER 94 4.361 10.885 17.956 619 HA SER 94 HA SER 94 2.541 8.784 19.066 620 HB3 SER 94 2HB SER 94 4.340 8.271 16.708 621 HG SER 94 HG SER 94 2.599 6.486 16.861 622 HA PRO 95 HA PRO 95 6.423 8.614 21.477 623 HB3 PRO 95 2HB PRO 95 5.260 9.355 23.320 624 HG3 PRO 95 2HG PRO 95 2.965 8.899 23.616 625 HD3 PRO 95 2HD PRO 95 2.918 9.697 21.424 626 H ASN 96 H ASN 96 4.236 6.161 20.373 627 HA ASN 96 HA ASN 96 5.696 3.873 21.404 628 HB3 ASN 96 2HB ASN 96 3.777 3.863 19.037 629 HD21 ASN 96 2HD2 ASN 96 3.590 1.697 18.426 630 HD22 ASN 96 1HD2 ASN 96 3.803 0.350 19.538 631 H LEU 97 H LEU 97 5.494 5.400 18.132 632 HA LEU 97 HA LEU 97 8.280 4.926 17.620 633 HB3 LEU 97 2HB LEU 97 6.529 3.508 15.592 634 HG LEU 97 HG LEU 97 8.324 1.820 15.563 635 HD11 LEU 97 1HD1 LEU 97 8.442 3.597 13.898 636 HD12 LEU 97 2HD1 LEU 97 9.476 4.573 14.991 637 HD13 LEU 97 3HD1 LEU 97 10.041 3.023 14.365 638 HD21 LEU 97 3HD2 LEU 97 10.447 2.085 16.614 639 HD22 LEU 97 1HD2 LEU 97 10.030 3.678 17.260 640 HD23 LEU 97 2HD2 LEU 97 9.208 2.224 17.869 641 H TRP 98 H TRP 98 9.003 6.486 16.285 642 HA TRP 98 HA TRP 98 7.355 8.508 15.184 643 HB3 TRP 98 2HB TRP 98 9.976 8.329 13.892 644 HD1 TRP 98 HD TRP 98 8.120 10.081 16.814 645 HE1 TRP 98 1HE TRP 98 8.501 12.600 16.671 646 HE3 TRP 98 3HE TRP 98 11.335 10.199 12.811 647 HZ2 TRP 98 2HZ TRP 98 10.136 14.438 15.142 648 HZ3 TRP 98 3HZ TRP 98 12.310 12.355 12.052 649 HH2 TRP 98 HH TRP 98 11.723 14.471 13.211 650 H GLY 99 H GLY 99 7.718 5.431 13.878 651 HA2 GLY 99 2HA GLY 99 7.478 5.989 11.044 652 H LEU 100 H LEU 100 5.134 5.917 13.727 653 HA LEU 100 HA LEU 100 2.790 6.062 11.911 654 HB3 LEU 100 2HB LEU 100 1.580 6.532 14.085 655 HG LEU 100 HG LEU 100 3.178 3.945 14.277 656 HD11 LEU 100 1HD1 LEU 100 1.901 4.577 16.292 657 HD12 LEU 100 2HD1 LEU 100 0.438 4.830 15.311 658 HD13 LEU 100 3HD1 LEU 100 1.131 3.203 15.488 659 HD21 LEU 100 3HD2 LEU 100 1.170 2.935 13.132 660 HD22 LEU 100 1HD2 LEU 100 0.613 4.581 12.748 661 HD23 LEU 100 2HD2 LEU 100 2.139 3.958 12.076 662 H GLU 101 H GLU 101 5.029 8.296 13.347 663 HA GLU 101 HA GLU 101 3.293 10.636 12.787 664 HB3 GLU 101 2HB GLU 101 5.488 11.887 13.139 665 HG3 GLU 101 2HG GLU 101 4.445 10.239 15.466 666 H PHE 102 H PHE 102 3.863 12.171 11.169 667 HA PHE 102 HA PHE 102 5.349 11.100 8.814 668 HB3 PHE 102 2HB PHE 102 3.609 12.025 7.357 669 HD1 PHE 102 2HD PHE 102 3.825 9.608 6.788 670 HD2 PHE 102 1HD PHE 102 1.365 10.952 10.071 671 HE1 PHE 102 2HE PHE 102 2.707 7.386 6.866 672 HE2 PHE 102 1HE PHE 102 0.245 8.734 10.138 673 HZ PHE 102 HZ PHE 102 0.932 6.951 8.548 674 H GLN 103 H GLN 103 6.333 12.655 7.517 675 HA GLN 103 HA GLN 103 6.849 15.265 8.897 676 HB3 GLN 103 2HB GLN 103 9.044 15.212 7.861 677 HG3 GLN 103 2HG GLN 103 8.269 13.340 9.895 678 HE21 GLN 103 2HE2 GLN 103 11.313 12.899 8.025 679 HE22 GLN 103 1HE2 GLN 103 11.102 11.165 7.823 680 H LYS 104 H LYS 104 7.208 17.095 7.621 681 HA LYS 104 HA LYS 104 5.656 17.176 5.087 682 HB3 LYS 104 2HB LYS 104 5.740 19.630 5.419 683 HG3 LYS 104 2HG LYS 104 4.192 17.800 6.825 684 HD3 LYS 104 2HD LYS 104 4.812 20.004 8.792 685 HE3 LYS 104 2HE LYS 104 3.896 17.148 9.308 686 HZ1 LYS 104 3HZ LYS 104 2.925 18.159 11.253 687 HZ2 LYS 104 1HZ LYS 104 4.483 18.637 11.206 688 HZ3 LYS 104 2HZ LYS 104 3.295 19.668 10.763 689 H ASN 105 H ASN 105 6.481 18.686 3.398 690 HA ASN 105 HA ASN 105 7.824 18.745 1.583 691 HB3 ASN 105 2HB ASN 105 10.329 19.323 2.141 692 HD21 ASN 105 2HD2 ASN 105 10.605 21.296 1.301 693 HD22 ASN 105 1HD2 ASN 105 9.414 22.585 1.393 694 H LYS 106 H LYS 106 7.141 16.206 2.371 695 HA LYS 106 HA LYS 106 9.417 14.542 1.375 696 HB3 LYS 106 2HB LYS 106 7.916 12.842 3.015 697 HG3 LYS 106 2HG LYS 106 10.324 12.675 2.932 698 HD3 LYS 106 2HD LYS 106 10.316 15.423 4.189 699 HE3 LYS 106 2HE LYS 106 12.132 13.116 4.853 700 HZ1 LYS 106 3HZ LYS 106 13.812 14.785 5.495 701 HZ2 LYS 106 1HZ LYS 106 13.628 14.724 3.879 702 HZ3 LYS 106 2HZ LYS 106 12.978 15.963 4.729 703 H ASP 107 H ASP 107 8.849 12.717 0.269 704 HA ASP 107 HA ASP 107 6.075 12.417 -0.706 705 HB3 ASP 107 2HB ASP 107 8.540 13.006 -2.366 706 H TYR 108 H TYR 108 5.495 10.370 -0.775 707 HA TYR 108 HA TYR 108 7.561 8.204 -0.585 708 HB3 TYR 108 2HB TYR 108 5.506 6.991 0.543 709 HD1 TYR 108 1HD TYR 108 6.875 10.136 2.116 710 HD2 TYR 108 2HD TYR 108 6.868 5.818 2.002 711 HE1 TYR 108 1HE TYR 108 8.351 10.073 4.129 712 HE2 TYR 108 2HE TYR 108 8.323 5.757 4.016 713 HH TYR 108 HH TYR 108 9.452 6.995 5.595 714 H TYR 109 H TYR 109 7.394 6.569 -1.883 715 HA TYR 109 HA TYR 109 5.047 6.230 -3.677 716 HB3 TYR 109 2HB TYR 109 7.022 5.148 -5.142 717 HD1 TYR 109 1HD TYR 109 6.321 8.803 -4.402 718 HD2 TYR 109 2HD TYR 109 6.460 5.604 -7.299 719 HE1 TYR 109 1HE TYR 109 5.511 10.356 -6.159 720 HE2 TYR 109 2HE TYR 109 5.667 7.167 -9.061 721 HH TYR 109 HH TYR 109 5.001 9.316 -9.552 722 H ILE 110 H ILE 110 4.475 4.167 -4.079 723 HA ILE 110 HA ILE 110 5.807 1.843 -2.827 724 HB ILE 110 HB ILE 110 2.888 2.589 -2.373 725 HG13 ILE 110 2HG1 ILE 110 4.049 4.043 -0.891 726 HG21 ILE 110 1HG2 ILE 110 3.287 0.146 -2.497 727 HG22 ILE 110 2HG2 ILE 110 4.307 0.290 -1.041 728 HG23 ILE 110 3HG2 ILE 110 2.587 0.733 -1.015 729 HD11 ILE 110 3HD1 ILE 110 3.673 3.386 1.377 730 HD12 ILE 110 1HD1 ILE 110 2.317 2.727 0.422 731 HD13 ILE 110 2HD1 ILE 110 3.653 1.670 0.947 732 H ILE 111 H ILE 111 5.358 -0.042 -4.023 733 HA ILE 111 HA ILE 111 3.369 0.204 -6.228 734 HB ILE 111 HB ILE 111 4.728 -0.341 -7.956 735 HG13 ILE 111 2HG1 ILE 111 5.829 -2.293 -7.111 736 HG21 ILE 111 1HG2 ILE 111 5.203 1.951 -7.260 737 HG22 ILE 111 2HG2 ILE 111 6.545 1.412 -6.241 738 HG23 ILE 111 3HG2 ILE 111 6.623 1.223 -7.981 739 HD11 ILE 111 3HD1 ILE 111 7.879 -2.249 -8.252 740 HD12 ILE 111 1HD1 ILE 111 6.853 -1.104 -9.120 741 HD13 ILE 111 2HD1 ILE 111 8.104 -0.519 -7.991 742 H SER 112 H SER 112 2.819 -1.883 -7.191 743 HA SER 112 HA SER 112 3.441 -4.281 -5.547 744 HB3 SER 112 2HB SER 112 0.594 -3.571 -6.305 745 HG SER 112 HG SER 112 0.197 -5.163 -4.697 746 H THR 113 H THR 113 2.633 -6.220 -6.543 747 HA THR 113 HA THR 113 3.011 -6.186 -9.510 748 HB THR 113 HB THR 113 4.344 -8.218 -9.235 749 HG1 THR 113 1HG THR 113 4.936 -8.933 -7.273 750 HG21 THR 113 3HG2 THR 113 6.345 -7.186 -8.324 751 HG22 THR 113 1HG2 THR 113 5.431 -5.926 -9.175 752 HG23 THR 113 2HG2 THR 113 5.392 -6.020 -7.405 753 H SER 114 H SER 114 0.472 -6.095 -8.474 754 HA SER 114 HA SER 114 -0.860 -8.511 -8.074 755 HB3 SER 114 2HB SER 114 -1.751 -5.816 -9.076 756 HG SER 114 HG SER 114 -3.880 -6.496 -8.608 757 H ASN 115 H ASN 115 0.602 -7.719 -11.050 758 HA ASN 115 HA ASN 115 -1.130 -9.339 -12.738 759 HB3 ASN 115 2HB ASN 115 1.815 -8.966 -13.311 760 HD21 ASN 115 2HD2 ASN 115 2.198 -9.321 -15.541 761 HD22 ASN 115 1HD2 ASN 115 0.896 -9.464 -16.703 762 H GLY 116 H GLY 116 1.349 -10.023 -10.402 763 HA2 GLY 116 2HA GLY 116 2.695 -11.783 -9.896 764 H SER 117 H SER 117 3.339 -11.168 -12.448 765 HA SER 117 HA SER 117 3.075 -13.089 -14.512 766 HB3 SER 117 2HB SER 117 5.443 -11.265 -13.910 767 HG SER 117 HG SER 117 5.691 -11.427 -16.214 768 H LEU 118 H LEU 118 4.604 -14.754 -15.287 769 HA LEU 118 HA LEU 118 5.445 -16.524 -13.250 770 HB3 LEU 118 2HB LEU 118 6.464 -16.486 -16.117 771 HG LEU 118 HG LEU 118 6.114 -18.903 -16.081 772 HD11 LEU 118 1HD1 LEU 118 8.383 -17.948 -15.443 773 HD12 LEU 118 2HD1 LEU 118 7.976 -18.358 -13.761 774 HD13 LEU 118 3HD1 LEU 118 8.053 -19.624 -14.981 775 HD21 LEU 118 3HD2 LEU 118 5.728 -20.178 -14.054 776 HD22 LEU 118 1HD2 LEU 118 5.668 -18.701 -13.077 777 HD23 LEU 118 2HD2 LEU 118 4.407 -19.021 -14.290 778 H GLU 119 H GLU 119 7.416 -14.134 -15.082 779 HA GLU 119 HA GLU 119 9.928 -14.836 -13.853 780 HB3 GLU 119 2HB GLU 119 10.620 -12.529 -14.493 781 HG3 GLU 119 2HG GLU 119 9.187 -13.587 -16.908 782 H GLY 120 H GLY 120 7.240 -12.931 -12.666 783 HA2 GLY 120 2HA GLY 120 8.781 -11.964 -10.288 784 H LEU 121 H LEU 121 7.129 -14.635 -10.802 785 HA LEU 121 HA LEU 121 4.801 -14.518 -9.247 786 HB3 LEU 121 2HB LEU 121 6.021 -16.347 -10.883 787 HG LEU 121 HG LEU 121 7.155 -17.385 -8.703 788 HD11 LEU 121 1HD1 LEU 121 4.974 -17.467 -7.409 789 HD12 LEU 121 2HD1 LEU 121 4.343 -18.583 -8.625 790 HD13 LEU 121 3HD1 LEU 121 5.729 -19.051 -7.614 791 HD21 LEU 121 3HD2 LEU 121 6.963 -19.606 -9.665 792 HD22 LEU 121 1HD2 LEU 121 5.615 -19.066 -10.699 793 HD23 LEU 121 2HD2 LEU 121 7.248 -18.387 -10.915 794 H ASP 122 H ASP 122 8.056 -15.250 -8.304 795 HA ASP 122 HA ASP 122 7.452 -15.000 -5.377 796 HB3 ASP 122 2HB ASP 122 9.390 -16.867 -6.794 797 H ASN 123 H ASN 123 9.750 -14.441 -8.074 798 HA ASN 123 HA ASN 123 11.569 -12.824 -6.572 799 HB3 ASN 123 2HB ASN 123 11.062 -12.421 -9.530 800 HD21 ASN 123 2HD2 ASN 123 13.073 -11.877 -10.683 801 HD22 ASN 123 1HD2 ASN 123 14.520 -11.494 -9.757 802 H GLN 124 H GLN 124 11.939 -10.550 -7.125 803 HA GLN 124 HA GLN 124 9.676 -8.946 -6.336 804 HB3 GLN 124 2HB GLN 124 11.882 -8.812 -5.353 805 HG3 GLN 124 2HG GLN 124 13.016 -7.298 -7.716 806 HE21 GLN 124 2HE2 GLN 124 15.490 -8.395 -7.851 807 HE22 GLN 124 1HE2 GLN 124 16.286 -8.328 -6.284 808 H GLU 125 H GLU 125 8.761 -9.719 -8.820 809 HA GLU 125 HA GLU 125 9.170 -7.277 -10.507 810 HB3 GLU 125 2HB GLU 125 9.509 -8.505 -12.500 811 HG3 GLU 125 2HG GLU 125 11.248 -9.901 -10.416 812 H GLY 126 H GLY 126 7.555 -6.830 -12.091 813 HA2 GLY 126 2HA GLY 126 5.033 -8.374 -12.039 814 H GLY 127 H GLY 127 3.350 -7.289 -13.316 815 HA2 GLY 127 2HA GLY 127 4.302 -5.503 -15.543 816 H VAL 128 H VAL 128 2.280 -5.696 -12.870 817 HA VAL 128 HA VAL 128 -0.131 -4.459 -13.994 818 HB VAL 128 HB VAL 128 0.644 -5.627 -11.419 819 HG11 VAL 128 1HG1 VAL 128 0.529 -3.441 -10.466 820 HG12 VAL 128 2HG1 VAL 128 -1.008 -3.086 -11.296 821 HG13 VAL 128 3HG1 VAL 128 -0.933 -4.296 -10.034 822 HG21 VAL 128 3HG2 VAL 128 -1.765 -6.150 -11.364 823 HG22 VAL 128 1HG2 VAL 128 -2.051 -5.075 -12.705 824 HG23 VAL 128 2HG2 VAL 128 -1.099 -6.515 -12.960 825 H CYS 129 H CYS 129 2.650 -3.253 -12.010 826 HA CYS 129 HA CYS 129 1.745 -0.579 -11.894 827 HB3 CYS 129 2HB CYS 129 3.783 -1.806 -10.759 828 H GLN 130 H GLN 130 3.085 -2.356 -14.550 829 HA GLN 130 HA GLN 130 3.768 -0.147 -16.266 830 HB3 GLN 130 2HB GLN 130 3.266 -2.824 -17.465 831 HG3 GLN 130 2HG GLN 130 5.942 -1.432 -17.188 832 HE21 GLN 130 2HE2 GLN 130 5.131 -1.408 -20.385 833 HE22 GLN 130 1HE2 GLN 130 5.678 -3.019 -20.829 834 H THR 131 H THR 131 0.752 -1.830 -15.632 835 HA THR 131 HA THR 131 -0.550 -0.524 -18.000 836 HB THR 131 HB THR 131 -0.817 -3.455 -17.247 837 HG1 THR 131 1HG THR 131 0.041 -3.744 -19.320 838 HG21 THR 131 3HG2 THR 131 -2.235 -3.589 -19.316 839 HG22 THR 131 1HG2 THR 131 -2.989 -2.667 -18.019 840 HG23 THR 131 2HG2 THR 131 -2.243 -1.812 -19.387 841 H ARG 132 H ARG 132 -1.573 -2.627 -15.208 842 HA ARG 132 HA ARG 132 -4.153 -1.339 -14.802 843 HB3 ARG 132 2HB ARG 132 -3.469 -2.134 -12.296 844 HG3 ARG 132 2HG ARG 132 -5.288 -3.227 -13.548 845 HD3 ARG 132 2HD ARG 132 -3.053 -4.540 -14.986 846 HE ARG 132 HE ARG 132 -3.470 -6.659 -14.271 847 HH11 ARG 132 1HH2 ARG 132 -6.602 -5.087 -14.171 848 HH12 ARG 132 2HH2 ARG 132 -7.390 -6.520 -13.569 849 HH21 ARG 132 1HH1 ARG 132 -4.536 -8.426 -13.481 850 HH22 ARG 132 2HH1 ARG 132 -6.250 -8.354 -13.205 851 H ALA 133 H ALA 133 -0.925 -0.622 -13.850 852 HA ALA 133 HA ALA 133 0.153 0.813 -12.562 853 HB1 ALA 133 3HB ALA 133 -0.441 3.098 -12.504 854 HB2 ALA 133 1HB ALA 133 -0.843 2.484 -14.103 855 HB3 ALA 133 2HB ALA 133 -2.138 2.752 -12.919 856 H MET 134 H MET 134 0.154 -0.544 -10.793 857 HA MET 134 HA MET 134 -1.645 0.302 -8.564 858 HB3 MET 134 2HB MET 134 -0.180 -2.340 -8.649 859 HG3 MET 134 2HG MET 134 -2.425 -1.167 -6.986 860 HE1 MET 134 3HE MET 134 -4.007 -4.047 -5.204 861 HE2 MET 134 1HE MET 134 -2.888 -2.802 -4.605 862 HE3 MET 134 2HE MET 134 -4.141 -2.381 -5.799 863 H LYS 135 H LYS 135 -0.231 2.156 -8.632 864 HA LYS 135 HA LYS 135 1.770 1.682 -6.516 865 HB3 LYS 135 2HB LYS 135 3.070 2.188 -8.550 866 HG3 LYS 135 2HG LYS 135 2.902 4.964 -8.764 867 HD3 LYS 135 2HD LYS 135 1.660 2.995 -10.736 868 HE3 LYS 135 2HE LYS 135 2.377 5.891 -10.731 869 HZ1 LYS 135 3HZ LYS 135 3.031 5.844 -13.062 870 HZ2 LYS 135 1HZ LYS 135 4.121 5.027 -12.168 871 HZ3 LYS 135 2HZ LYS 135 3.040 4.209 -13.088 872 H ILE 136 H ILE 136 2.161 3.587 -5.215 873 HA ILE 136 HA ILE 136 -0.240 5.330 -4.979 874 HB ILE 136 HB ILE 136 -0.529 5.078 -2.776 875 HG13 ILE 136 2HG1 ILE 136 2.389 4.680 -2.475 876 HG21 ILE 136 1HG2 ILE 136 -0.979 2.888 -3.820 877 HG22 ILE 136 2HG2 ILE 136 0.631 2.323 -3.315 878 HG23 ILE 136 3HG2 ILE 136 -0.581 2.768 -2.104 879 HD11 ILE 136 3HD1 ILE 136 2.125 5.988 -0.484 880 HD12 ILE 136 1HD1 ILE 136 1.228 6.824 -1.750 881 HD13 ILE 136 2HD1 ILE 136 0.370 5.859 -0.539 882 H LEU 137 H LEU 137 0.078 7.375 -4.164 883 HA LEU 137 HA LEU 137 2.849 8.420 -3.987 884 HB3 LEU 137 2HB LEU 137 0.889 8.933 -6.119 885 HG LEU 137 HG LEU 137 0.578 11.105 -4.863 886 HD11 LEU 137 1HD1 LEU 137 2.945 11.419 -4.012 887 HD12 LEU 137 2HD1 LEU 137 3.478 11.588 -5.685 888 HD13 LEU 137 3HD1 LEU 137 2.361 12.768 -4.984 889 HD21 LEU 137 3HD2 LEU 137 0.961 12.475 -6.883 890 HD22 LEU 137 1HD2 LEU 137 1.972 11.174 -7.566 891 HD23 LEU 137 2HD2 LEU 137 0.230 10.913 -7.267 892 H MET 138 H MET 138 3.095 9.703 -2.353 893 HA MET 138 HA MET 138 0.779 10.846 -0.826 894 HB3 MET 138 2HB MET 138 2.850 10.671 0.990 895 HG3 MET 138 2HG MET 138 0.986 8.356 0.442 896 HE1 MET 138 3HE MET 138 2.704 6.384 3.166 897 HE2 MET 138 1HE MET 138 1.488 6.324 1.876 898 HE3 MET 138 2HE MET 138 3.130 6.917 1.525 899 H LYS 139 H LYS 139 0.742 12.969 -1.365 900 HA LYS 139 HA LYS 139 3.296 14.518 -1.624 901 HB3 LYS 139 2HB LYS 139 0.485 15.058 -2.650 902 HG3 LYS 139 2HG LYS 139 2.513 16.705 -3.899 903 HD3 LYS 139 2HD LYS 139 1.122 18.591 -2.747 904 HE3 LYS 139 2HE LYS 139 -1.041 17.535 -4.131 905 HZ1 LYS 139 3HZ LYS 139 -0.094 18.727 -6.044 906 HZ2 LYS 139 1HZ LYS 139 0.038 19.618 -4.687 907 HZ3 LYS 139 2HZ LYS 139 1.352 18.860 -5.297 908 H VAL 140 H VAL 140 3.891 15.492 0.165 909 HA VAL 140 HA VAL 140 2.008 17.282 1.584 910 HB VAL 140 HB VAL 140 1.892 15.458 3.016 911 HG11 VAL 140 1HG1 VAL 140 3.808 14.087 2.319 912 HG12 VAL 140 2HG1 VAL 140 4.910 15.209 3.138 913 HG13 VAL 140 3HG1 VAL 140 3.732 14.275 4.069 914 HG21 VAL 140 3HG2 VAL 140 2.880 16.262 5.109 915 HG22 VAL 140 1HG2 VAL 140 3.769 17.489 4.183 916 HG23 VAL 140 2HG2 VAL 140 1.998 17.487 4.186 917 H GLY 141 H GLY 141 2.802 19.112 0.952 918 HA2 GLY 141 2HA GLY 141 5.722 19.759 1.152 919 H GLN 142 H GLN 142 4.169 22.567 1.119 920 HA GLN 142 HA GLN 142 4.526 23.501 3.766 921 HB3 GLN 142 2HB GLN 142 2.651 25.175 2.893 922 HG3 GLN 142 2HG GLN 142 5.492 24.809 1.925 923 HE21 GLN 142 2HE2 GLN 142 6.312 27.302 1.366 924 HE22 GLN 142 1HE2 GLN 142 5.501 27.900 -0.078 Start of MODEL 2 1 H1 SER 1 H SER 1 -9.740 12.256 14.713 2 HA SER 1 HA SER 1 -9.762 15.081 14.381 3 HB3 SER 1 2HB SER 1 -7.474 13.852 12.799 4 HG SER 1 HG SER 1 -7.029 16.157 12.596 5 H LYS 2 H LYS 2 -11.526 15.192 13.143 6 HA LYS 2 HA LYS 2 -11.927 13.313 10.832 7 HB3 LYS 2 2HB LYS 2 -14.253 14.940 11.621 8 HG3 LYS 2 2HG LYS 2 -14.146 12.717 10.234 9 HD3 LYS 2 2HD LYS 2 -14.329 11.716 13.125 10 HE3 LYS 2 2HE LYS 2 -14.458 9.518 11.394 11 HZ1 LYS 2 3HZ LYS 2 -16.740 9.330 12.191 12 HZ2 LYS 2 1HZ LYS 2 -15.766 9.751 13.426 13 HZ3 LYS 2 2HZ LYS 2 -16.740 10.868 12.733 14 H SER 3 H SER 3 -11.842 14.157 8.872 15 HA SER 3 HA SER 3 -12.474 17.004 8.320 16 HB3 SER 3 2HB SER 3 -10.398 17.361 7.052 17 HG SER 3 HG SER 3 -9.056 17.703 8.818 18 H ILE 4 H ILE 4 -11.429 13.853 7.002 19 HA ILE 4 HA ILE 4 -13.212 14.188 4.652 20 HB ILE 4 HB ILE 4 -11.150 12.973 3.390 21 HG13 ILE 4 2HG1 ILE 4 -9.066 13.528 3.942 22 HG21 ILE 4 1HG2 ILE 4 -12.451 14.713 2.468 23 HG22 ILE 4 2HG2 ILE 4 -11.747 15.926 3.561 24 HG23 ILE 4 3HG2 ILE 4 -10.749 15.165 2.302 25 HD11 ILE 4 3HD1 ILE 4 -8.334 15.446 5.367 26 HD12 ILE 4 1HD1 ILE 4 -8.954 15.853 3.758 27 HD13 ILE 4 2HD1 ILE 4 -9.966 16.133 5.187 28 H VAL 5 H VAL 5 -10.901 11.840 6.102 29 HA VAL 5 HA VAL 5 -11.005 9.609 6.511 30 HB VAL 5 HB VAL 5 -13.977 10.118 6.848 31 HG11 VAL 5 1HG1 VAL 5 -13.612 7.735 6.717 32 HG12 VAL 5 2HG1 VAL 5 -12.208 7.834 7.780 33 HG13 VAL 5 3HG1 VAL 5 -13.833 8.165 8.411 34 HG21 VAL 5 3HG2 VAL 5 -13.369 10.297 9.263 35 HG22 VAL 5 1HG2 VAL 5 -11.652 10.286 8.823 36 HG23 VAL 5 2HG2 VAL 5 -12.710 11.606 8.283 37 H LEU 6 H LEU 6 -10.240 8.604 4.673 38 HA LEU 6 HA LEU 6 -11.821 8.216 2.244 39 HB3 LEU 6 2HB LEU 6 -10.020 6.559 1.714 40 HG LEU 6 HG LEU 6 -8.209 7.955 1.302 41 HD11 LEU 6 1HD1 LEU 6 -10.191 8.350 -0.101 42 HD12 LEU 6 2HD1 LEU 6 -10.699 9.672 0.977 43 HD13 LEU 6 3HD1 LEU 6 -9.181 9.797 0.072 44 HD21 LEU 6 3HD2 LEU 6 -7.744 10.046 2.159 45 HD22 LEU 6 1HD2 LEU 6 -9.337 10.237 2.938 46 HD23 LEU 6 2HD2 LEU 6 -8.142 9.081 3.580 47 H GLU 7 H GLU 7 -12.315 6.040 1.421 48 HA GLU 7 HA GLU 7 -14.015 4.675 3.303 49 HB3 GLU 7 2HB GLU 7 -14.429 3.090 1.368 50 HG3 GLU 7 2HG GLU 7 -14.850 5.994 0.612 51 HA PRO 8 HA PRO 8 -11.110 1.502 4.599 52 HB3 PRO 8 2HB PRO 8 -12.360 1.326 6.534 53 HG3 PRO 8 2HG PRO 8 -14.658 1.672 6.555 54 HD3 PRO 8 2HD PRO 8 -14.107 3.534 5.272 55 H ILE 9 H ILE 9 -10.255 -0.102 3.440 56 HA ILE 9 HA ILE 9 -11.643 -1.314 1.142 57 HB ILE 9 HB ILE 9 -8.901 -2.041 2.200 58 HG13 ILE 9 2HG1 ILE 9 -7.848 -0.409 0.740 59 HG21 ILE 9 1HG2 ILE 9 -9.751 -3.563 0.565 60 HG22 ILE 9 2HG2 ILE 9 -10.188 -2.238 -0.535 61 HG23 ILE 9 3HG2 ILE 9 -8.480 -2.594 -0.192 62 HD11 ILE 9 3HD1 ILE 9 -9.161 1.534 -0.107 63 HD12 ILE 9 1HD1 ILE 9 -9.464 0.029 -0.987 64 HD13 ILE 9 2HD1 ILE 9 -10.660 0.642 0.190 65 H TYR 10 H TYR 10 -12.927 -3.057 1.460 66 HA TYR 10 HA TYR 10 -12.456 -4.819 3.837 67 HB3 TYR 10 2HB TYR 10 -15.137 -4.439 2.513 68 HD1 TYR 10 2HD TYR 10 -15.177 -6.981 3.511 69 HD2 TYR 10 1HD TYR 10 -14.859 -3.402 5.913 70 HE1 TYR 10 2HE TYR 10 -15.935 -8.246 5.495 71 HE2 TYR 10 1HE TYR 10 -15.663 -4.679 7.894 72 HH TYR 10 HH TYR 10 -16.439 -8.172 7.728 73 H TRP 11 H TRP 11 -10.889 -5.607 2.035 74 HA TRP 11 HA TRP 11 -10.130 -7.135 0.550 75 HB3 TRP 11 2HB TRP 11 -12.830 -8.460 0.939 76 HD1 TRP 11 HD TRP 11 -9.511 -9.094 -0.839 77 HE1 TRP 11 1HE TRP 11 -9.662 -11.402 -1.955 78 HE3 TRP 11 3HE TRP 11 -13.935 -10.648 1.193 79 HZ2 TRP 11 2HZ TRP 11 -11.526 -13.630 -1.978 80 HZ3 TRP 11 3HZ TRP 11 -14.917 -12.843 0.570 81 HH2 TRP 11 HH TRP 11 -13.764 -14.308 -1.033 82 H ASN 12 H ASN 12 -13.537 -6.699 -0.233 83 HA ASN 12 HA ASN 12 -12.976 -6.126 -3.103 84 HB3 ASN 12 2HB ASN 12 -14.631 -7.910 -2.538 85 HD21 ASN 12 2HD2 ASN 12 -17.059 -8.250 -2.279 86 HD22 ASN 12 1HD2 ASN 12 -17.808 -7.412 -0.923 87 H SER 13 H SER 13 -15.055 -4.503 -3.682 88 HA SER 13 HA SER 13 -15.926 -2.435 -3.723 89 HB3 SER 13 2HB SER 13 -15.002 -1.702 -0.959 90 HG SER 13 HG SER 13 -17.236 -1.007 -0.936 91 H SER 14 H SER 14 -12.679 -2.597 -2.406 92 HA SER 14 HA SER 14 -10.796 -1.358 -2.638 93 HB3 SER 14 2HB SER 14 -10.260 -0.477 -4.807 94 HG SER 14 HG SER 14 -11.181 -2.289 -6.129 95 H ASN 15 H ASN 15 -10.231 1.205 -3.675 96 HA ASN 15 HA ASN 15 -11.551 2.932 -1.665 97 HB3 ASN 15 2HB ASN 15 -9.649 4.290 -3.432 98 HD21 ASN 15 2HD2 ASN 15 -7.603 3.338 -1.175 99 HD22 ASN 15 1HD2 ASN 15 -8.092 4.358 0.166 100 H SER 16 H SER 16 -12.190 5.217 -2.446 101 HA SER 16 HA SER 16 -14.152 5.249 -4.543 102 HB3 SER 16 2HB SER 16 -12.700 7.273 -2.887 103 HG SER 16 HG SER 16 -13.699 8.957 -4.048 104 H LYS 17 H LYS 17 -10.704 6.145 -4.561 105 HA LYS 17 HA LYS 17 -10.585 6.907 -7.344 106 HB3 LYS 17 2HB LYS 17 -8.093 6.857 -6.941 107 HG3 LYS 17 2HG LYS 17 -7.960 8.426 -5.008 108 HD3 LYS 17 2HD LYS 17 -10.141 8.914 -7.075 109 HE3 LYS 17 2HE LYS 17 -9.002 11.028 -5.230 110 HZ1 LYS 17 3HZ LYS 17 -10.948 12.221 -6.069 111 HZ2 LYS 17 1HZ LYS 17 -10.038 11.748 -7.341 112 HZ3 LYS 17 2HZ LYS 17 -11.416 10.947 -6.970 113 H PHE 18 H PHE 18 -10.056 3.790 -5.781 114 HA PHE 18 HA PHE 18 -9.334 1.773 -6.646 115 HB3 PHE 18 2HB PHE 18 -11.805 2.563 -8.191 116 HD1 PHE 18 2HD PHE 18 -9.852 -0.541 -7.148 117 HD2 PHE 18 1HD PHE 18 -12.592 1.284 -9.938 118 HE1 PHE 18 2HE PHE 18 -9.810 -2.595 -8.541 119 HE2 PHE 18 1HE PHE 18 -12.523 -0.758 -11.338 120 HZ PHE 18 HZ PHE 18 -11.148 -2.707 -10.633 121 H LEU 19 H LEU 19 -7.311 3.156 -7.520 122 HA LEU 19 HA LEU 19 -5.746 3.487 -9.165 123 HB3 LEU 19 2HB LEU 19 -6.823 0.825 -10.109 124 HG LEU 19 HG LEU 19 -4.088 2.126 -10.424 125 HD11 LEU 19 1HD1 LEU 19 -3.724 0.044 -9.294 126 HD12 LEU 19 2HD1 LEU 19 -4.866 -0.814 -10.368 127 HD13 LEU 19 3HD1 LEU 19 -3.308 -0.207 -10.998 128 HD21 LEU 19 3HD2 LEU 19 -4.221 0.982 -12.680 129 HD22 LEU 19 1HD2 LEU 19 -5.936 0.687 -12.353 130 HD23 LEU 19 2HD2 LEU 19 -5.289 2.348 -12.470 131 HA PRO 20 HA PRO 20 -8.843 5.375 -12.032 132 HB3 PRO 20 2HB PRO 20 -9.247 7.133 -10.594 133 HG3 PRO 20 2HG PRO 20 -7.617 7.868 -9.056 134 HD3 PRO 20 2HD PRO 20 -7.433 5.586 -8.625 135 H GLY 21 H GLY 21 -5.391 5.588 -11.779 136 HA2 GLY 21 2HA GLY 21 -4.708 5.098 -14.395 137 H GLN 22 H GLN 22 -3.785 6.731 -11.408 138 HA GLN 22 HA GLN 22 -0.918 5.932 -11.854 139 HB3 GLN 22 2HB GLN 22 -0.496 7.414 -9.856 140 HG3 GLN 22 2HG GLN 22 -1.688 8.827 -12.277 141 HE21 GLN 22 2HE2 GLN 22 -1.954 10.979 -11.461 142 HE22 GLN 22 1HE2 GLN 22 -0.686 11.797 -10.559 143 H GLY 23 H GLY 23 -3.515 5.791 -9.337 144 HA2 GLY 23 2HA GLY 23 -3.563 3.185 -8.699 145 H LEU 24 H LEU 24 -2.133 5.126 -6.150 146 HA LEU 24 HA LEU 24 -4.816 5.709 -4.961 147 HB3 LEU 24 2HB LEU 24 -2.485 4.260 -3.698 148 HG LEU 24 HG LEU 24 -3.337 5.967 -2.084 149 HD11 LEU 24 1HD1 LEU 24 -5.718 6.048 -2.763 150 HD12 LEU 24 2HD1 LEU 24 -5.910 4.357 -2.255 151 HD13 LEU 24 3HD1 LEU 24 -5.544 5.624 -1.059 152 HD21 LEU 24 3HD2 LEU 24 -3.680 4.353 -0.234 153 HD22 LEU 24 1HD2 LEU 24 -3.883 3.047 -1.425 154 HD23 LEU 24 2HD2 LEU 24 -2.329 3.901 -1.277 155 H VAL 25 H VAL 25 -4.999 7.723 -4.290 156 HA VAL 25 HA VAL 25 -2.573 9.464 -3.980 157 HB VAL 25 HB VAL 25 -5.470 10.121 -4.639 158 HG11 VAL 25 1HG1 VAL 25 -4.658 11.872 -3.130 159 HG12 VAL 25 2HG1 VAL 25 -3.138 12.002 -4.046 160 HG13 VAL 25 3HG1 VAL 25 -4.681 12.493 -4.779 161 HG21 VAL 25 3HG2 VAL 25 -4.452 11.054 -6.701 162 HG22 VAL 25 1HG2 VAL 25 -2.843 10.549 -6.140 163 HG23 VAL 25 2HG2 VAL 25 -4.074 9.333 -6.541 164 H LEU 26 H LEU 26 -2.028 10.056 -2.030 165 HA LEU 26 HA LEU 26 -3.895 9.698 0.278 166 HB3 LEU 26 2HB LEU 26 -1.566 10.308 1.423 167 HG LEU 26 HG LEU 26 -0.801 7.936 1.396 168 HD11 LEU 26 1HD1 LEU 26 -2.350 8.808 3.110 169 HD12 LEU 26 2HD1 LEU 26 -3.724 8.410 2.073 170 HD13 LEU 26 3HD1 LEU 26 -2.693 7.119 2.717 171 HD21 LEU 26 3HD2 LEU 26 -2.166 6.201 0.457 172 HD22 LEU 26 1HD2 LEU 26 -3.378 7.363 -0.118 173 HD23 LEU 26 2HD2 LEU 26 -1.764 7.320 -0.862 174 H TYR 27 H TYR 27 -4.326 11.393 1.667 175 HA TYR 27 HA TYR 27 -4.320 14.022 0.475 176 HB3 TYR 27 2HB TYR 27 -5.131 14.551 2.965 177 HD1 TYR 27 1HD TYR 27 -6.003 15.672 0.592 178 HD2 TYR 27 2HD TYR 27 -7.526 12.134 2.508 179 HE1 TYR 27 1HE TYR 27 -8.170 15.965 -0.593 180 HE2 TYR 27 2HE TYR 27 -9.690 12.403 1.300 181 HH TYR 27 HH TYR 27 -10.903 13.703 -0.168 182 HA PRO 28 HA PRO 28 -0.467 15.359 2.444 183 HB3 PRO 28 2HB PRO 28 -0.009 16.410 0.454 184 HG3 PRO 28 2HG PRO 28 -1.695 17.363 -0.887 185 HD3 PRO 28 2HD PRO 28 -2.717 15.303 -0.521 186 H GLN 29 H GLN 29 -3.386 15.848 3.550 187 HA GLN 29 HA GLN 29 -2.739 18.019 5.490 188 HB3 GLN 29 2HB GLN 29 -4.405 18.968 4.173 189 HG3 GLN 29 2HG GLN 29 -5.935 16.331 4.158 190 HE21 GLN 29 2HE2 GLN 29 -6.738 17.888 1.406 191 HE22 GLN 29 1HE2 GLN 29 -8.159 18.736 1.984 192 H ILE 30 H ILE 30 -2.322 17.188 7.366 193 HA ILE 30 HA ILE 30 -3.000 14.588 8.368 194 HB ILE 30 HB ILE 30 -2.030 17.115 9.743 195 HG13 ILE 30 2HG1 ILE 30 0.184 16.178 9.670 196 HG21 ILE 30 1HG2 ILE 30 -3.035 15.692 11.438 197 HG22 ILE 30 2HG2 ILE 30 -2.127 14.291 10.844 198 HG23 ILE 30 3HG2 ILE 30 -1.276 15.653 11.586 199 HD11 ILE 30 3HD1 ILE 30 0.718 14.202 8.220 200 HD12 ILE 30 1HD1 ILE 30 -0.067 13.746 9.734 201 HD13 ILE 30 2HD1 ILE 30 -0.994 13.767 8.213 202 H GLY 31 H GLY 31 -5.034 14.107 8.336 203 HA2 GLY 31 2HA GLY 31 -6.874 14.572 10.374 204 H ASP 32 H ASP 32 -6.142 13.517 7.165 205 HA ASP 32 HA ASP 32 -8.575 11.983 6.702 206 HB3 ASP 32 2HB ASP 32 -6.980 12.897 4.937 207 H LYS 33 H LYS 33 -8.292 9.583 6.279 208 HA LYS 33 HA LYS 33 -6.348 8.027 7.683 209 HB3 LYS 33 2HB LYS 33 -7.594 8.546 9.695 210 HG3 LYS 33 2HG LYS 33 -10.083 7.564 8.259 211 HD3 LYS 33 2HD LYS 33 -10.596 8.836 10.780 212 HE3 LYS 33 2HE LYS 33 -12.124 7.170 9.858 213 HZ1 LYS 33 3HZ LYS 33 -11.507 4.800 10.019 214 HZ2 LYS 33 1HZ LYS 33 -10.559 5.536 8.928 215 HZ3 LYS 33 2HZ LYS 33 -9.975 5.176 10.404 216 H LEU 34 H LEU 34 -6.471 5.838 7.192 217 HA LEU 34 HA LEU 34 -8.456 4.923 5.202 218 HB3 LEU 34 2HB LEU 34 -6.969 4.465 3.504 219 HG LEU 34 HG LEU 34 -7.096 7.081 3.942 220 HD11 LEU 34 1HD1 LEU 34 -5.231 7.229 5.567 221 HD12 LEU 34 2HD1 LEU 34 -4.141 6.489 4.380 222 HD13 LEU 34 3HD1 LEU 34 -4.856 8.095 4.082 223 HD21 LEU 34 3HD2 LEU 34 -5.826 7.492 1.928 224 HD22 LEU 34 1HD2 LEU 34 -4.996 5.934 2.082 225 HD23 LEU 34 2HD2 LEU 34 -6.735 6.001 1.737 226 H ASP 35 H ASP 35 -8.828 2.803 5.394 227 HA ASP 35 HA ASP 35 -7.111 1.099 7.177 228 HB3 ASP 35 2HB ASP 35 -9.232 -0.106 7.628 229 H ILE 36 H ILE 36 -6.091 -0.419 5.948 230 HA ILE 36 HA ILE 36 -7.477 -1.476 3.532 231 HB ILE 36 HB ILE 36 -5.384 -0.293 3.063 232 HG13 ILE 36 2HG1 ILE 36 -6.327 -2.021 1.610 233 HG21 ILE 36 1HG2 ILE 36 -4.098 -0.853 5.091 234 HG22 ILE 36 2HG2 ILE 36 -3.967 -2.532 4.544 235 HG23 ILE 36 3HG2 ILE 36 -3.216 -1.216 3.616 236 HD11 ILE 36 3HD1 ILE 36 -4.423 -2.524 0.261 237 HD12 ILE 36 1HD1 ILE 36 -4.141 -0.918 0.971 238 HD13 ILE 36 2HD1 ILE 36 -3.316 -2.347 1.627 239 H ILE 37 H ILE 37 -8.388 -3.404 3.841 240 HA ILE 37 HA ILE 37 -7.089 -5.408 5.640 241 HB ILE 37 HB ILE 37 -10.067 -4.816 5.418 242 HG13 ILE 37 2HG1 ILE 37 -8.150 -3.611 7.178 243 HG21 ILE 37 1HG2 ILE 37 -9.754 -7.198 5.654 244 HG22 ILE 37 2HG2 ILE 37 -8.595 -6.966 6.982 245 HG23 ILE 37 3HG2 ILE 37 -10.309 -6.552 7.195 246 HD11 ILE 37 3HD1 ILE 37 -10.107 -2.558 8.203 247 HD12 ILE 37 1HD1 ILE 37 -10.288 -2.576 6.440 248 HD13 ILE 37 2HD1 ILE 37 -11.184 -3.744 7.439 249 H CYS 38 H CYS 38 -6.710 -7.268 4.610 250 HA CYS 38 HA CYS 38 -8.570 -8.156 2.537 251 HB3 CYS 38 2HB CYS 38 -6.350 -6.976 1.626 252 HA PRO 39 HA PRO 39 -7.737 -11.977 4.896 253 HB3 PRO 39 2HB PRO 39 -10.053 -12.189 4.845 254 HG3 PRO 39 2HG PRO 39 -11.341 -11.628 2.954 255 HD3 PRO 39 2HD PRO 39 -10.164 -9.655 3.348 256 H LYS 40 H LYS 40 -7.583 -14.289 4.042 257 HA LYS 40 HA LYS 40 -5.391 -14.428 2.047 258 HB3 LYS 40 2HB LYS 40 -4.593 -15.299 3.995 259 HG3 LYS 40 2HG LYS 40 -6.532 -15.221 5.459 260 HD3 LYS 40 2HD LYS 40 -7.341 -17.963 4.407 261 HE3 LYS 40 2HE LYS 40 -9.478 -17.406 5.596 262 HZ1 LYS 40 3HZ LYS 40 -8.663 -17.702 7.824 263 HZ2 LYS 40 1HZ LYS 40 -7.750 -18.618 6.833 264 HZ3 LYS 40 2HZ LYS 40 -7.165 -17.200 7.443 265 H VAL 41 H VAL 41 -5.252 -16.667 1.013 266 HA VAL 41 HA VAL 41 -7.756 -17.040 -0.579 267 HB VAL 41 HB VAL 41 -4.970 -17.682 -1.578 268 HG11 VAL 41 1HG1 VAL 41 -6.981 -18.659 -2.786 269 HG12 VAL 41 2HG1 VAL 41 -7.653 -17.030 -2.918 270 HG13 VAL 41 3HG1 VAL 41 -6.166 -17.451 -3.780 271 HG21 VAL 41 3HG2 VAL 41 -5.168 -15.501 -2.833 272 HG22 VAL 41 1HG2 VAL 41 -6.470 -15.051 -1.707 273 HG23 VAL 41 2HG2 VAL 41 -4.821 -15.338 -1.113 274 H ASP 42 H ASP 42 -8.618 -18.507 0.898 275 HA ASP 42 HA ASP 42 -7.949 -21.271 0.265 276 HB3 ASP 42 2HB ASP 42 -8.094 -21.718 2.938 277 H SER 43 H SER 43 -9.832 -20.764 3.206 278 HA SER 43 HA SER 43 -12.065 -22.051 2.125 279 HB3 SER 43 2HB SER 43 -13.306 -21.152 4.133 280 HG SER 43 HG SER 43 -11.992 -22.282 5.562 281 H LYS 44 H LYS 44 -11.366 -18.629 2.005 282 HA LYS 44 HA LYS 44 -14.021 -17.773 1.147 283 HB3 LYS 44 2HB LYS 44 -12.693 -15.660 0.494 284 HG3 LYS 44 2HG LYS 44 -12.184 -14.955 2.805 285 HD3 LYS 44 2HD LYS 44 -14.741 -15.741 1.843 286 HE3 LYS 44 2HE LYS 44 -14.468 -17.551 3.728 287 HZ1 LYS 44 3HZ LYS 44 -15.149 -16.691 5.882 288 HZ2 LYS 44 1HZ LYS 44 -13.758 -15.941 5.466 289 HZ3 LYS 44 2HZ LYS 44 -15.188 -15.156 5.339 290 H THR 45 H THR 45 -10.980 -18.347 -0.590 291 HA THR 45 HA THR 45 -12.354 -18.525 -3.224 292 HB THR 45 HB THR 45 -10.652 -16.746 -4.041 293 HG1 THR 45 1HG THR 45 -10.056 -15.259 -2.460 294 HG21 THR 45 3HG2 THR 45 -12.164 -14.958 -3.735 295 HG22 THR 45 1HG2 THR 45 -13.115 -16.433 -3.919 296 HG23 THR 45 2HG2 THR 45 -12.903 -15.738 -2.314 297 H VAL 46 H VAL 46 -11.115 -20.634 -1.995 298 HA VAL 46 HA VAL 46 -8.579 -21.222 -2.084 299 HB VAL 46 HB VAL 46 -10.838 -22.697 -1.872 300 HG11 VAL 46 1HG1 VAL 46 -10.963 -23.247 -4.311 301 HG12 VAL 46 2HG1 VAL 46 -9.397 -24.075 -4.164 302 HG13 VAL 46 3HG1 VAL 46 -10.795 -24.652 -3.261 303 HG21 VAL 46 3HG2 VAL 46 -9.438 -24.609 -1.305 304 HG22 VAL 46 1HG2 VAL 46 -8.010 -23.774 -1.990 305 HG23 VAL 46 2HG2 VAL 46 -8.888 -23.090 -0.589 306 H GLY 47 H GLY 47 -10.311 -20.984 -5.112 307 HA2 GLY 47 2HA GLY 47 -7.783 -20.566 -6.544 308 H GLN 48 H GLN 48 -9.692 -18.706 -5.753 309 HA GLN 48 HA GLN 48 -10.918 -17.752 -8.328 310 HB3 GLN 48 2HB GLN 48 -12.846 -16.924 -6.975 311 HG3 GLN 48 2HG GLN 48 -13.938 -19.035 -6.324 312 HE21 GLN 48 2HE2 GLN 48 -11.952 -20.434 -8.869 313 HE22 GLN 48 1HE2 GLN 48 -13.115 -20.076 -10.136 314 H TYR 49 H TYR 49 -8.610 -17.050 -6.098 315 HA TYR 49 HA TYR 49 -8.540 -14.197 -6.778 316 HB3 TYR 49 2HB TYR 49 -8.383 -15.015 -3.866 317 HD1 TYR 49 1HD TYR 49 -9.864 -12.264 -6.014 318 HD2 TYR 49 2HD TYR 49 -7.301 -13.247 -2.684 319 HE1 TYR 49 1HE TYR 49 -9.545 -9.839 -5.526 320 HE2 TYR 49 2HE TYR 49 -6.986 -10.836 -2.210 321 HH TYR 49 HH TYR 49 -7.549 -8.694 -2.790 322 H GLU 50 H GLU 50 -6.397 -13.342 -5.538 323 HA GLU 50 HA GLU 50 -4.295 -15.381 -5.295 324 HB3 GLU 50 2HB GLU 50 -3.063 -13.289 -6.771 325 HG3 GLU 50 2HG GLU 50 -2.838 -15.986 -6.775 326 H TYR 51 H TYR 51 -2.199 -14.258 -4.624 327 HA TYR 51 HA TYR 51 -2.850 -12.210 -2.558 328 HB3 TYR 51 2HB TYR 51 -1.891 -14.246 -1.720 329 HD1 TYR 51 1HD TYR 51 1.148 -12.577 -3.108 330 HD2 TYR 51 2HD TYR 51 -1.130 -16.235 -2.787 331 HE1 TYR 51 1HE TYR 51 3.037 -13.845 -4.117 332 HE2 TYR 51 2HE TYR 51 0.791 -17.507 -3.728 333 HH TYR 51 HH TYR 51 2.921 -17.372 -4.542 334 H TYR 52 H TYR 52 -1.285 -10.550 -2.166 335 HA TYR 52 HA TYR 52 0.587 -9.788 -4.272 336 HB3 TYR 52 2HB TYR 52 -1.430 -8.814 -5.202 337 HD1 TYR 52 1HD TYR 52 -0.944 -6.167 -2.630 338 HD2 TYR 52 2HD TYR 52 -3.576 -9.234 -4.147 339 HE1 TYR 52 1HE TYR 52 -2.860 -5.144 -1.398 340 HE2 TYR 52 2HE TYR 52 -5.475 -8.208 -2.924 341 HH TYR 52 HH TYR 52 -6.175 -6.471 -1.574 342 H LYS 53 H LYS 53 1.673 -7.676 -3.641 343 HA LYS 53 HA LYS 53 1.709 -7.006 -0.812 344 HB3 LYS 53 2HB LYS 53 3.055 -8.983 -0.656 345 HG3 LYS 53 2HG LYS 53 5.423 -8.858 -1.758 346 HD3 LYS 53 2HD LYS 53 3.129 -9.789 -3.512 347 HE3 LYS 53 2HE LYS 53 5.955 -9.702 -3.887 348 HZ1 LYS 53 3HZ LYS 53 6.399 -12.051 -4.151 349 HZ2 LYS 53 1HZ LYS 53 6.066 -11.751 -2.575 350 HZ3 LYS 53 2HZ LYS 53 4.939 -12.463 -3.525 351 H VAL 54 H VAL 54 2.525 -5.097 -0.346 352 HA VAL 54 HA VAL 54 3.150 -3.287 -2.670 353 HB VAL 54 HB VAL 54 1.558 -2.737 -0.155 354 HG11 VAL 54 1HG1 VAL 54 2.595 -0.781 -0.787 355 HG12 VAL 54 2HG1 VAL 54 2.138 -0.964 -2.511 356 HG13 VAL 54 3HG1 VAL 54 0.910 -0.626 -1.266 357 HG21 VAL 54 3HG2 VAL 54 -0.437 -2.560 -1.533 358 HG22 VAL 54 1HG2 VAL 54 0.487 -2.934 -2.991 359 HG23 VAL 54 2HG2 VAL 54 0.246 -4.175 -1.745 360 H TYR 55 H TYR 55 4.922 -1.989 -2.509 361 HA TYR 55 HA TYR 55 6.372 -1.774 0.108 362 HB3 TYR 55 2HB TYR 55 7.457 -2.778 -2.535 363 HD1 TYR 55 1HD TYR 55 8.600 -2.142 1.064 364 HD2 TYR 55 2HD TYR 55 9.524 -1.948 -3.148 365 HE1 TYR 55 1HE TYR 55 10.815 -1.096 1.550 366 HE2 TYR 55 2HE TYR 55 11.865 -1.345 -2.608 367 HH TYR 55 HH TYR 55 13.208 -0.422 -1.007 368 H MET 56 H MET 56 7.439 0.065 0.498 369 HA MET 56 HA MET 56 7.033 2.423 -1.041 370 HB3 MET 56 2HB MET 56 7.237 2.691 1.272 371 HG3 MET 56 2HG MET 56 9.880 1.232 1.070 372 HE1 MET 56 3HE MET 56 9.664 2.585 5.279 373 HE2 MET 56 1HE MET 56 8.229 1.998 4.404 374 HE3 MET 56 2HE MET 56 9.680 0.979 4.511 375 H VAL 57 H VAL 57 7.979 2.996 -2.913 376 HA VAL 57 HA VAL 57 10.866 2.572 -3.328 377 HB VAL 57 HB VAL 57 8.869 0.871 -4.626 378 HG11 VAL 57 1HG1 VAL 57 8.908 2.483 -6.518 379 HG12 VAL 57 2HG1 VAL 57 10.658 2.442 -6.482 380 HG13 VAL 57 3HG1 VAL 57 9.792 0.988 -6.930 381 HG21 VAL 57 3HG2 VAL 57 10.830 -0.393 -5.214 382 HG22 VAL 57 1HG2 VAL 57 11.882 1.040 -5.082 383 HG23 VAL 57 2HG2 VAL 57 11.169 0.346 -3.632 384 H ASP 58 H ASP 58 11.793 4.021 -4.699 385 HA ASP 58 HA ASP 58 10.812 6.607 -4.937 386 HB3 ASP 58 2HB ASP 58 12.642 7.032 -6.408 387 H LYS 59 H LYS 59 9.569 7.747 -6.529 388 HA LYS 59 HA LYS 59 7.786 6.466 -8.300 389 HB3 LYS 59 2HB LYS 59 9.027 9.241 -8.291 390 HG3 LYS 59 2HG LYS 59 6.234 9.007 -9.257 391 HD3 LYS 59 2HD LYS 59 7.515 11.137 -9.323 392 HE3 LYS 59 2HE LYS 59 9.038 10.728 -11.726 393 HZ1 LYS 59 3HZ LYS 59 10.894 11.383 -10.282 394 HZ2 LYS 59 1HZ LYS 59 9.610 12.352 -10.023 395 HZ3 LYS 59 2HZ LYS 59 9.982 11.189 -8.941 396 H ASP 60 H ASP 60 11.081 7.570 -8.996 397 HA ASP 60 HA ASP 60 11.109 7.013 -11.829 398 HB3 ASP 60 2HB ASP 60 13.249 7.229 -9.687 399 H GLN 61 H GLN 61 11.814 4.931 -8.996 400 HA GLN 61 HA GLN 61 12.533 2.582 -10.613 401 HB3 GLN 61 2HB GLN 61 12.105 1.544 -8.214 402 HG3 GLN 61 2HG GLN 61 14.253 2.563 -7.290 403 HE21 GLN 61 2HE2 GLN 61 14.456 0.200 -7.392 404 HE22 GLN 61 1HE2 GLN 61 15.207 -0.525 -8.802 405 H ALA 62 H ALA 62 9.554 3.891 -9.080 406 HA ALA 62 HA ALA 62 7.851 1.703 -9.620 407 HB1 ALA 62 3HB ALA 62 6.073 3.215 -9.256 408 HB2 ALA 62 1HB ALA 62 7.405 3.906 -8.295 409 HB3 ALA 62 2HB ALA 62 6.987 4.603 -9.878 410 H ASP 63 H ASP 63 8.912 4.362 -11.738 411 HA ASP 63 HA ASP 63 7.329 3.857 -14.013 412 HB3 ASP 63 2HB ASP 63 10.176 4.782 -14.305 413 H ARG 64 H ARG 64 10.166 2.152 -12.886 414 HA ARG 64 HA ARG 64 10.210 0.310 -15.258 415 HB3 ARG 64 2HB ARG 64 12.266 -0.600 -13.975 416 HG3 ARG 64 2HG ARG 64 13.787 1.196 -14.585 417 HD3 ARG 64 2HD ARG 64 11.848 1.271 -16.865 418 HE ARG 64 HE ARG 64 14.744 0.896 -16.504 419 HH11 ARG 64 1HH2 ARG 64 12.169 0.625 -18.871 420 HH12 ARG 64 2HH2 ARG 64 13.290 0.578 -20.206 421 HH21 ARG 64 1HH1 ARG 64 16.103 0.806 -18.245 422 HH22 ARG 64 2HH1 ARG 64 15.454 0.675 -19.853 423 H CYS 65 H CYS 65 8.939 0.490 -12.120 424 HA CYS 65 HA CYS 65 7.853 -0.925 -10.776 425 HB3 CYS 65 2HB CYS 65 7.565 -2.580 -13.266 426 H THR 66 H THR 66 10.273 -0.956 -10.180 427 HA THR 66 HA THR 66 11.224 -3.761 -9.874 428 HB THR 66 HB THR 66 13.531 -2.700 -9.788 429 HG1 THR 66 1HG THR 66 13.639 -0.683 -10.873 430 HG21 THR 66 3HG2 THR 66 13.731 -2.573 -12.231 431 HG22 THR 66 1HG2 THR 66 12.668 -3.915 -11.796 432 HG23 THR 66 2HG2 THR 66 11.969 -2.406 -12.392 433 H ILE 67 H ILE 67 11.612 -4.519 -7.988 434 HA ILE 67 HA ILE 67 11.278 -2.846 -5.532 435 HB ILE 67 HB ILE 67 10.654 -5.768 -5.487 436 HG13 ILE 67 2HG1 ILE 67 8.376 -5.629 -6.236 437 HG21 ILE 67 1HG2 ILE 67 10.435 -4.297 -3.481 438 HG22 ILE 67 2HG2 ILE 67 9.036 -3.550 -4.296 439 HG23 ILE 67 3HG2 ILE 67 9.006 -5.250 -3.894 440 HD11 ILE 67 3HD1 ILE 67 7.875 -3.632 -7.826 441 HD12 ILE 67 1HD1 ILE 67 7.556 -3.465 -6.083 442 HD13 ILE 67 2HD1 ILE 67 9.000 -2.726 -6.803 443 H LYS 68 H LYS 68 12.484 -3.819 -3.610 444 HA LYS 68 HA LYS 68 14.988 -5.262 -4.426 445 HB3 LYS 68 2HB LYS 68 15.542 -3.691 -2.110 446 HG3 LYS 68 2HG LYS 68 16.875 -2.277 -3.675 447 HD3 LYS 68 2HD LYS 68 17.214 -5.252 -4.256 448 HE3 LYS 68 2HE LYS 68 19.397 -3.186 -3.917 449 HZ1 LYS 68 3HZ LYS 68 20.567 -4.709 -5.367 450 HZ2 LYS 68 1HZ LYS 68 19.961 -5.575 -4.125 451 HZ3 LYS 68 2HZ LYS 68 19.245 -5.633 -5.600 452 H LYS 69 H LYS 69 14.958 -7.234 -3.672 453 HA LYS 69 HA LYS 69 13.576 -8.340 -1.478 454 HB3 LYS 69 2HB LYS 69 14.524 -9.842 -3.065 455 HG3 LYS 69 2HG LYS 69 17.166 -8.476 -2.463 456 HD3 LYS 69 2HD LYS 69 17.831 -10.417 -4.251 457 HE3 LYS 69 2HE LYS 69 18.111 -11.046 -1.301 458 HZ1 LYS 69 3HZ LYS 69 20.396 -11.453 -2.046 459 HZ2 LYS 69 1HZ LYS 69 19.376 -12.336 -2.970 460 HZ3 LYS 69 2HZ LYS 69 20.047 -10.965 -3.561 461 H GLU 70 H GLU 70 16.469 -6.394 -1.329 462 HA GLU 70 HA GLU 70 17.290 -7.097 1.345 463 HB3 GLU 70 2HB GLU 70 18.419 -4.887 1.315 464 HG3 GLU 70 2HG GLU 70 18.959 -6.058 -1.408 465 H ASN 71 H ASN 71 14.511 -5.480 0.267 466 HA ASN 71 HA ASN 71 13.858 -4.491 3.010 467 HB3 ASN 71 2HB ASN 71 12.293 -2.984 1.483 468 HD21 ASN 71 2HD2 ASN 71 15.853 -2.642 1.191 469 HD22 ASN 71 1HD2 ASN 71 15.920 -1.287 2.308 470 H THR 72 H THR 72 11.369 -4.211 3.087 471 HA THR 72 HA THR 72 10.121 -6.756 2.166 472 HB THR 72 HB THR 72 9.224 -7.161 4.332 473 HG1 THR 72 1HG THR 72 9.701 -5.863 6.078 474 HG21 THR 72 3HG2 THR 72 11.196 -7.685 5.607 475 HG22 THR 72 1HG2 THR 72 11.600 -7.915 3.891 476 HG23 THR 72 2HG2 THR 72 12.162 -6.462 4.753 477 HA PRO 73 HA PRO 73 6.823 -3.982 1.087 478 HB3 PRO 73 2HB PRO 73 5.986 -5.488 -0.392 479 HG3 PRO 73 2HG PRO 73 6.431 -7.735 -0.125 480 HD3 PRO 73 2HD PRO 73 8.509 -7.173 0.635 481 H LEU 74 H LEU 74 5.648 -2.679 2.344 482 HA LEU 74 HA LEU 74 5.153 -3.152 5.139 483 HB3 LEU 74 2HB LEU 74 5.424 -0.902 4.334 484 HG LEU 74 HG LEU 74 3.520 -1.637 2.249 485 HD11 LEU 74 1HD1 LEU 74 1.774 -0.728 3.677 486 HD12 LEU 74 2HD1 LEU 74 2.689 0.788 3.860 487 HD13 LEU 74 3HD1 LEU 74 2.064 0.303 2.265 488 HD21 LEU 74 3HD2 LEU 74 4.297 0.371 1.216 489 HD22 LEU 74 1HD2 LEU 74 4.940 0.999 2.750 490 HD23 LEU 74 2HD2 LEU 74 5.684 -0.420 1.981 491 H LEU 75 H LEU 75 3.307 -3.892 2.280 492 HA LEU 75 HA LEU 75 1.016 -4.795 3.963 493 HB3 LEU 75 2HB LEU 75 0.850 -4.303 1.002 494 HG LEU 75 HG LEU 75 -1.355 -3.402 1.458 495 HD11 LEU 75 1HD1 LEU 75 -1.129 -5.764 0.833 496 HD12 LEU 75 2HD1 LEU 75 -1.026 -6.208 2.555 497 HD13 LEU 75 3HD1 LEU 75 -2.498 -5.468 1.919 498 HD21 LEU 75 3HD2 LEU 75 -2.482 -3.780 3.576 499 HD22 LEU 75 1HD2 LEU 75 -1.016 -4.403 4.321 500 HD23 LEU 75 2HD2 LEU 75 -1.090 -2.698 3.807 501 H ASN 76 H ASN 76 0.939 -6.877 4.223 502 HA ASN 76 HA ASN 76 2.248 -8.791 2.339 503 HB3 ASN 76 2HB ASN 76 1.977 -10.157 4.671 504 HD21 ASN 76 2HD2 ASN 76 4.058 -7.215 4.574 505 HD22 ASN 76 1HD2 ASN 76 5.511 -8.149 4.350 506 H CYS 77 H CYS 77 -0.013 -8.263 1.193 507 HA CYS 77 HA CYS 77 -2.350 -9.690 2.198 508 HB3 CYS 77 2HB CYS 77 -2.828 -9.263 -0.489 509 H ALA 78 H ALA 78 -0.150 -11.376 2.256 510 HA ALA 78 HA ALA 78 -0.808 -13.659 0.487 511 HB1 ALA 78 3HB ALA 78 1.519 -13.908 -0.183 512 HB2 ALA 78 1HB ALA 78 1.042 -12.241 -0.581 513 HB3 ALA 78 2HB ALA 78 2.028 -12.552 0.848 514 H LYS 79 H LYS 79 -1.454 -15.025 2.036 515 HA LYS 79 HA LYS 79 0.465 -16.354 3.668 516 HB3 LYS 79 2HB LYS 79 -1.321 -15.771 5.759 517 HG3 LYS 79 2HG LYS 79 1.490 -15.170 5.104 518 HD3 LYS 79 2HD LYS 79 0.220 -13.461 7.256 519 HE3 LYS 79 2HE LYS 79 2.694 -14.294 7.242 520 HZ1 LYS 79 3HZ LYS 79 4.142 -12.886 5.959 521 HZ2 LYS 79 1HZ LYS 79 3.078 -13.537 4.892 522 HZ3 LYS 79 2HZ LYS 79 2.911 -11.991 5.378 523 HA PRO 80 HA PRO 80 -2.606 -19.517 3.178 524 HB3 PRO 80 2HB PRO 80 -0.940 -20.993 3.736 525 HG3 PRO 80 2HG PRO 80 0.624 -20.538 5.409 526 HD3 PRO 80 2HD PRO 80 0.742 -18.446 4.435 527 H ASP 81 H ASP 81 -2.319 -19.014 6.722 528 HA ASP 81 HA ASP 81 -5.269 -18.712 6.940 529 HB3 ASP 81 2HB ASP 81 -4.961 -20.904 7.562 530 H GLN 82 H GLN 82 -3.610 -16.608 6.655 531 HA GLN 82 HA GLN 82 -4.140 -15.117 9.165 532 HB3 GLN 82 2HB GLN 82 -1.759 -14.103 7.850 533 HG3 GLN 82 2HG GLN 82 -2.177 -15.327 10.598 534 HE21 GLN 82 2HE2 GLN 82 0.019 -16.225 10.714 535 HE22 GLN 82 1HE2 GLN 82 1.407 -15.146 10.703 536 H ASP 83 H ASP 83 -5.483 -13.500 8.715 537 HA ASP 83 HA ASP 83 -5.673 -12.196 6.078 538 HB3 ASP 83 2HB ASP 83 -7.689 -12.390 7.388 539 H ILE 84 H ILE 84 -5.026 -10.036 5.682 540 HA ILE 84 HA ILE 84 -3.059 -8.901 7.612 541 HB ILE 84 HB ILE 84 -2.397 -9.655 5.084 542 HG13 ILE 84 2HG1 ILE 84 -1.300 -7.339 6.735 543 HG21 ILE 84 1HG2 ILE 84 -3.927 -7.960 4.030 544 HG22 ILE 84 2HG2 ILE 84 -2.948 -6.672 4.770 545 HG23 ILE 84 3HG2 ILE 84 -2.231 -7.786 3.601 546 HD11 ILE 84 3HD1 ILE 84 0.530 -8.959 7.196 547 HD12 ILE 84 1HD1 ILE 84 -1.015 -9.573 7.811 548 HD13 ILE 84 2HD1 ILE 84 -0.346 -10.213 6.295 549 H LYS 85 H LYS 85 -3.359 -6.912 8.303 550 HA LYS 85 HA LYS 85 -5.221 -5.099 6.983 551 HB3 LYS 85 2HB LYS 85 -6.792 -6.322 8.332 552 HG3 LYS 85 2HG LYS 85 -4.734 -6.335 10.431 553 HD3 LYS 85 2HD LYS 85 -6.372 -6.238 12.291 554 HE3 LYS 85 2HE LYS 85 -4.874 -4.202 11.334 555 HZ1 LYS 85 3HZ LYS 85 -6.285 -2.222 11.465 556 HZ2 LYS 85 1HZ LYS 85 -6.776 -3.128 10.191 557 HZ3 LYS 85 2HZ LYS 85 -7.640 -3.117 11.580 558 H PHE 86 H PHE 86 -4.855 -3.049 7.325 559 HA PHE 86 HA PHE 86 -2.871 -2.118 9.334 560 HB3 PHE 86 2HB PHE 86 -2.179 -0.792 6.965 561 HD1 PHE 86 1HD PHE 86 -1.005 -4.302 7.408 562 HD2 PHE 86 2HD PHE 86 -0.381 -0.170 8.429 563 HE1 PHE 86 1HE PHE 86 1.228 -4.864 8.348 564 HE2 PHE 86 2HE PHE 86 1.855 -0.720 9.351 565 HZ PHE 86 HZ PHE 86 2.653 -3.079 9.331 566 H THR 87 H THR 87 -3.689 -0.413 10.319 567 HA THR 87 HA THR 87 -5.648 1.352 8.901 568 HB THR 87 HB THR 87 -6.843 0.158 10.564 569 HG1 THR 87 1HG THR 87 -7.825 1.887 10.741 570 HG21 THR 87 3HG2 THR 87 -6.504 0.222 12.937 571 HG22 THR 87 1HG2 THR 87 -5.019 -0.384 12.195 572 HG23 THR 87 2HG2 THR 87 -5.093 1.281 12.796 573 H ILE 88 H ILE 88 -4.719 3.116 8.328 574 HA ILE 88 HA ILE 88 -2.732 4.409 10.154 575 HB ILE 88 HB ILE 88 -2.767 4.217 7.149 576 HG13 ILE 88 2HG1 ILE 88 -0.603 4.284 9.315 577 HG21 ILE 88 1HG2 ILE 88 -2.899 6.657 7.459 578 HG22 ILE 88 2HG2 ILE 88 -1.624 6.594 8.701 579 HG23 ILE 88 3HG2 ILE 88 -1.265 6.208 7.008 580 HD11 ILE 88 3HD1 ILE 88 0.037 2.067 8.470 581 HD12 ILE 88 1HD1 ILE 88 -1.617 2.009 9.087 582 HD13 ILE 88 2HD1 ILE 88 -1.326 2.079 7.328 583 H LYS 89 H LYS 89 -3.383 6.063 11.076 584 HA LYS 89 HA LYS 89 -5.617 7.716 9.990 585 HB3 LYS 89 2HB LYS 89 -6.093 6.649 12.178 586 HG3 LYS 89 2HG LYS 89 -4.153 8.603 13.429 587 HD3 LYS 89 2HD LYS 89 -6.037 7.514 14.755 588 HE3 LYS 89 2HE LYS 89 -4.361 5.052 15.035 589 HZ1 LYS 89 3HZ LYS 89 -6.553 4.036 15.158 590 HZ2 LYS 89 1HZ LYS 89 -6.530 5.336 16.147 591 HZ3 LYS 89 2HZ LYS 89 -7.294 5.415 14.701 592 H PHE 90 H PHE 90 -5.420 10.007 10.433 593 HA PHE 90 HA PHE 90 -3.405 11.384 9.349 594 HB3 PHE 90 2HB PHE 90 -5.523 12.378 10.083 595 HD1 PHE 90 1HD PHE 90 -6.813 10.865 11.668 596 HD2 PHE 90 2HD PHE 90 -3.777 13.599 13.057 597 HE1 PHE 90 1HE PHE 90 -7.500 10.439 14.011 598 HE2 PHE 90 2HE PHE 90 -4.530 13.235 15.394 599 HZ PHE 90 HZ PHE 90 -6.363 11.633 15.880 600 H GLN 91 H GLN 91 -3.326 10.326 12.751 601 HA GLN 91 HA GLN 91 -1.206 11.604 13.871 602 HB3 GLN 91 2HB GLN 91 -1.820 8.634 13.998 603 HG3 GLN 91 2HG GLN 91 0.318 10.056 15.252 604 HE21 GLN 91 2HE2 GLN 91 -0.026 11.585 16.901 605 HE22 GLN 91 1HE2 GLN 91 -0.934 11.216 18.359 606 H GLU 92 H GLU 92 0.643 12.201 12.981 607 HA GLU 92 HA GLU 92 2.217 10.483 11.212 608 HB3 GLU 92 2HB GLU 92 2.658 13.262 12.390 609 HG3 GLU 92 2HG GLU 92 4.347 11.570 10.556 610 H PHE 93 H PHE 93 3.204 12.175 14.236 611 HA PHE 93 HA PHE 93 5.176 10.150 14.900 612 HB3 PHE 93 2HB PHE 93 4.063 12.579 16.317 613 HD1 PHE 93 2HD PHE 93 7.308 10.725 16.699 614 HD2 PHE 93 1HD PHE 93 3.647 12.005 18.580 615 HE1 PHE 93 2HE PHE 93 8.178 9.980 18.903 616 HE2 PHE 93 1HE PHE 93 4.522 11.271 20.784 617 HZ PHE 93 HZ PHE 93 6.789 10.257 20.949 618 H SER 94 H SER 94 4.936 8.301 15.954 619 HA SER 94 HA SER 94 2.560 7.865 17.713 620 HB3 SER 94 2HB SER 94 2.574 5.497 17.015 621 HG SER 94 HG SER 94 1.685 5.925 14.931 622 HA PRO 95 HA PRO 95 5.942 6.876 20.528 623 HB3 PRO 95 2HB PRO 95 4.727 7.941 22.154 624 HG3 PRO 95 2HG PRO 95 2.375 7.873 22.202 625 HD3 PRO 95 2HD PRO 95 2.661 8.431 19.947 626 H ASN 96 H ASN 96 3.500 4.648 19.448 627 HA ASN 96 HA ASN 96 4.308 2.272 20.813 628 HB3 ASN 96 2HB ASN 96 3.170 1.863 18.110 629 HD21 ASN 96 2HD2 ASN 96 0.627 2.283 20.237 630 HD22 ASN 96 1HD2 ASN 96 0.596 0.656 20.899 631 H LEU 97 H LEU 97 5.075 3.368 17.488 632 HA LEU 97 HA LEU 97 7.750 2.255 17.521 633 HB3 LEU 97 2HB LEU 97 6.262 1.149 15.198 634 HG LEU 97 HG LEU 97 8.617 0.492 16.634 635 HD11 LEU 97 1HD1 LEU 97 7.205 -0.752 18.261 636 HD12 LEU 97 2HD1 LEU 97 6.546 -1.726 16.929 637 HD13 LEU 97 3HD1 LEU 97 8.275 -1.825 17.341 638 HD21 LEU 97 3HD2 LEU 97 8.833 -1.341 15.022 639 HD22 LEU 97 1HD2 LEU 97 7.129 -1.144 14.546 640 HD23 LEU 97 2HD2 LEU 97 8.308 0.155 14.236 641 H TRP 98 H TRP 98 8.935 2.772 15.538 642 HA TRP 98 HA TRP 98 8.033 5.258 14.353 643 HB3 TRP 98 2HB TRP 98 10.475 4.444 15.085 644 HD1 TRP 98 HD TRP 98 10.244 1.872 13.270 645 HE1 TRP 98 1HE TRP 98 11.791 1.447 11.268 646 HE3 TRP 98 3HE TRP 98 11.956 6.645 12.547 647 HZ2 TRP 98 2HZ TRP 98 13.513 2.996 9.532 648 HZ3 TRP 98 3HZ TRP 98 13.561 7.142 10.717 649 HH2 TRP 98 HH TRP 98 14.339 5.332 9.200 650 H GLY 99 H GLY 99 7.046 2.256 13.532 651 HA2 GLY 99 2HA GLY 99 7.400 2.125 10.668 652 H LEU 100 H LEU 100 4.868 3.567 12.735 653 HA LEU 100 HA LEU 100 3.280 4.530 10.434 654 HB3 LEU 100 2HB LEU 100 1.763 5.367 12.168 655 HG LEU 100 HG LEU 100 2.709 2.539 12.835 656 HD11 LEU 100 1HD1 LEU 100 1.516 3.541 14.740 657 HD12 LEU 100 2HD1 LEU 100 0.173 4.001 13.668 658 HD13 LEU 100 3HD1 LEU 100 0.540 2.288 13.966 659 HD21 LEU 100 3HD2 LEU 100 0.793 1.782 11.553 660 HD22 LEU 100 1HD2 LEU 100 0.270 3.451 11.255 661 HD23 LEU 100 2HD2 LEU 100 1.766 2.832 10.515 662 H GLU 101 H GLU 101 5.854 5.688 12.430 663 HA GLU 101 HA GLU 101 5.565 8.526 12.301 664 HB3 GLU 101 2HB GLU 101 8.268 8.169 12.102 665 HG3 GLU 101 2HG GLU 101 8.051 7.707 14.733 666 H PHE 102 H PHE 102 6.129 10.020 10.925 667 HA PHE 102 HA PHE 102 7.117 9.383 8.207 668 HB3 PHE 102 2HB PHE 102 5.117 11.314 7.822 669 HD1 PHE 102 2HD PHE 102 6.448 10.148 5.795 670 HD2 PHE 102 1HD PHE 102 3.133 8.453 7.982 671 HE1 PHE 102 2HE PHE 102 5.868 8.758 3.848 672 HE2 PHE 102 1HE PHE 102 2.545 7.069 6.002 673 HZ PHE 102 HZ PHE 102 3.901 7.225 3.936 674 H GLN 103 H GLN 103 7.812 11.360 7.088 675 HA GLN 103 HA GLN 103 8.607 13.586 8.930 676 HB3 GLN 103 2HB GLN 103 10.626 13.858 7.648 677 HG3 GLN 103 2HG GLN 103 10.294 11.814 9.468 678 HE21 GLN 103 2HE2 GLN 103 10.824 9.554 9.702 679 HE22 GLN 103 1HE2 GLN 103 11.297 8.575 8.322 680 H LYS 104 H LYS 104 7.988 15.517 8.336 681 HA LYS 104 HA LYS 104 6.552 16.207 5.919 682 HB3 LYS 104 2HB LYS 104 6.192 17.482 7.968 683 HG3 LYS 104 2HG LYS 104 9.181 18.015 7.843 684 HD3 LYS 104 2HD LYS 104 7.039 19.661 9.250 685 HE3 LYS 104 2HE LYS 104 9.235 19.110 10.534 686 HZ1 LYS 104 3HZ LYS 104 10.972 20.746 10.045 687 HZ2 LYS 104 1HZ LYS 104 10.829 19.715 8.798 688 HZ3 LYS 104 2HZ LYS 104 10.210 21.240 8.695 689 H ASN 105 H ASN 105 7.332 18.056 4.577 690 HA ASN 105 HA ASN 105 8.436 18.624 2.737 691 HB3 ASN 105 2HB ASN 105 9.648 20.041 4.296 692 HD21 ASN 105 2HD2 ASN 105 10.304 19.498 6.363 693 HD22 ASN 105 1HD2 ASN 105 11.798 18.602 6.695 694 H LYS 106 H LYS 106 8.045 15.841 2.997 695 HA LYS 106 HA LYS 106 10.201 14.699 1.278 696 HB3 LYS 106 2HB LYS 106 9.258 12.726 3.227 697 HG3 LYS 106 2HG LYS 106 11.769 12.903 3.900 698 HD3 LYS 106 2HD LYS 106 10.543 11.822 1.449 699 HE3 LYS 106 2HE LYS 106 12.629 13.186 0.624 700 HZ1 LYS 106 3HZ LYS 106 14.613 11.796 0.680 701 HZ2 LYS 106 1HZ LYS 106 14.222 12.194 2.216 702 HZ3 LYS 106 2HZ LYS 106 13.898 10.695 1.643 703 H ASP 107 H ASP 107 9.479 13.636 -0.384 704 HA ASP 107 HA ASP 107 6.569 13.178 -0.720 705 HB3 ASP 107 2HB ASP 107 6.902 13.199 -2.947 706 H TYR 108 H TYR 108 5.660 11.197 -0.430 707 HA TYR 108 HA TYR 108 7.478 8.843 -0.161 708 HB3 TYR 108 2HB TYR 108 4.588 8.731 0.538 709 HD1 TYR 108 2HD TYR 108 8.038 8.190 1.957 710 HD2 TYR 108 1HD TYR 108 4.084 6.588 1.305 711 HE1 TYR 108 2HE TYR 108 8.621 6.203 3.330 712 HE2 TYR 108 1HE TYR 108 4.664 4.630 2.752 713 HH TYR 108 HH TYR 108 7.804 4.291 4.353 714 H TYR 109 H TYR 109 7.257 7.114 -1.365 715 HA TYR 109 HA TYR 109 5.198 6.952 -3.480 716 HB3 TYR 109 2HB TYR 109 7.000 6.399 -5.106 717 HD1 TYR 109 2HD TYR 109 5.091 8.429 -5.315 718 HD2 TYR 109 1HD TYR 109 9.261 8.845 -4.268 719 HE1 TYR 109 2HE TYR 109 5.109 10.723 -6.281 720 HE2 TYR 109 1HE TYR 109 9.276 11.129 -5.261 721 HH TYR 109 HH TYR 109 6.380 12.578 -6.779 722 H ILE 110 H ILE 110 4.581 4.913 -3.886 723 HA ILE 110 HA ILE 110 5.942 2.569 -2.705 724 HB ILE 110 HB ILE 110 3.017 3.180 -2.260 725 HG13 ILE 110 2HG1 ILE 110 4.138 4.795 -0.842 726 HG21 ILE 110 1HG2 ILE 110 3.660 0.775 -2.278 727 HG22 ILE 110 2HG2 ILE 110 4.653 1.092 -0.839 728 HG23 ILE 110 3HG2 ILE 110 2.898 1.335 -0.810 729 HD11 ILE 110 3HD1 ILE 110 3.146 4.374 1.188 730 HD12 ILE 110 1HD1 ILE 110 2.250 3.179 0.264 731 HD13 ILE 110 2HD1 ILE 110 3.661 2.675 1.202 732 H ILE 111 H ILE 111 5.362 0.624 -3.823 733 HA ILE 111 HA ILE 111 3.490 0.855 -6.112 734 HB ILE 111 HB ILE 111 4.949 0.543 -7.772 735 HG13 ILE 111 2HG1 ILE 111 5.877 -1.634 -7.068 736 HG21 ILE 111 1HG2 ILE 111 5.674 2.662 -6.740 737 HG22 ILE 111 2HG2 ILE 111 6.876 1.781 -5.762 738 HG23 ILE 111 3HG2 ILE 111 7.026 1.848 -7.505 739 HD11 ILE 111 3HD1 ILE 111 7.714 -1.572 -8.491 740 HD12 ILE 111 1HD1 ILE 111 6.837 -0.131 -8.979 741 HD13 ILE 111 2HD1 ILE 111 8.250 -0.002 -7.932 742 H SER 112 H SER 112 3.004 -1.258 -7.134 743 HA SER 112 HA SER 112 3.516 -3.621 -5.376 744 HB3 SER 112 2HB SER 112 0.804 -2.966 -6.527 745 HG SER 112 HG SER 112 0.227 -4.496 -4.877 746 H THR 113 H THR 113 3.702 -5.484 -6.332 747 HA THR 113 HA THR 113 3.573 -5.658 -9.304 748 HB THR 113 HB THR 113 5.180 -7.535 -9.088 749 HG1 THR 113 1HG THR 113 6.301 -7.773 -7.188 750 HG21 THR 113 3HG2 THR 113 7.147 -6.102 -8.672 751 HG22 THR 113 1HG2 THR 113 5.927 -5.224 -9.608 752 HG23 THR 113 2HG2 THR 113 6.095 -4.907 -7.871 753 H SER 114 H SER 114 1.154 -5.922 -8.822 754 HA SER 114 HA SER 114 0.157 -8.375 -7.818 755 HB3 SER 114 2HB SER 114 -1.391 -7.472 -10.120 756 HG SER 114 HG SER 114 -2.887 -7.095 -8.418 757 H ASN 115 H ASN 115 1.899 -7.829 -10.743 758 HA ASN 115 HA ASN 115 1.308 -10.373 -12.053 759 HB3 ASN 115 2HB ASN 115 3.782 -9.245 -12.993 760 HD21 ASN 115 2HD2 ASN 115 2.708 -11.147 -14.253 761 HD22 ASN 115 1HD2 ASN 115 1.692 -10.634 -15.594 762 H GLY 116 H GLY 116 2.970 -9.695 -9.266 763 HA2 GLY 116 2HA GLY 116 5.153 -11.616 -9.322 764 H SER 117 H SER 117 2.767 -12.778 -10.343 765 HA SER 117 HA SER 117 1.388 -14.620 -8.617 766 HB3 SER 117 2HB SER 117 0.738 -15.650 -10.673 767 HG SER 117 HG SER 117 0.439 -13.864 -12.161 768 H LEU 118 H LEU 118 1.845 -17.034 -8.714 769 HA LEU 118 HA LEU 118 4.322 -17.730 -7.671 770 HB3 LEU 118 2HB LEU 118 3.641 -20.112 -8.339 771 HG LEU 118 HG LEU 118 1.651 -20.331 -6.979 772 HD11 LEU 118 1HD1 LEU 118 3.762 -20.353 -5.851 773 HD12 LEU 118 2HD1 LEU 118 3.820 -18.592 -5.762 774 HD13 LEU 118 3HD1 LEU 118 2.592 -19.496 -4.841 775 HD21 LEU 118 3HD2 LEU 118 0.553 -18.528 -5.857 776 HD22 LEU 118 1HD2 LEU 118 1.642 -17.322 -6.566 777 HD23 LEU 118 2HD2 LEU 118 0.494 -18.219 -7.594 778 H GLU 119 H GLU 119 3.545 -17.566 -11.066 779 HA GLU 119 HA GLU 119 5.676 -18.957 -12.307 780 HB3 GLU 119 2HB GLU 119 5.236 -17.424 -14.199 781 HG3 GLU 119 2HG GLU 119 2.662 -18.234 -12.779 782 H GLY 120 H GLY 120 5.676 -15.854 -10.699 783 HA2 GLY 120 2HA GLY 120 8.571 -15.455 -10.912 784 H LEU 121 H LEU 121 6.914 -15.837 -8.657 785 HA LEU 121 HA LEU 121 6.028 -13.401 -7.485 786 HB3 LEU 121 2HB LEU 121 5.720 -16.040 -6.947 787 HG LEU 121 HG LEU 121 7.995 -15.890 -5.524 788 HD11 LEU 121 1HD1 LEU 121 7.324 -13.940 -4.138 789 HD12 LEU 121 2HD1 LEU 121 5.856 -14.810 -3.626 790 HD13 LEU 121 3HD1 LEU 121 7.465 -15.376 -3.141 791 HD21 LEU 121 3HD2 LEU 121 7.146 -17.593 -4.020 792 HD22 LEU 121 1HD2 LEU 121 5.480 -17.159 -4.422 793 HD23 LEU 121 2HD2 LEU 121 6.537 -17.869 -5.658 794 H ASP 122 H ASP 122 9.123 -14.991 -7.436 795 HA ASP 122 HA ASP 122 10.518 -13.058 -5.738 796 HB3 ASP 122 2HB ASP 122 11.547 -15.290 -7.538 797 H ASN 123 H ASN 123 9.418 -12.991 -8.947 798 HA ASN 123 HA ASN 123 11.670 -11.488 -10.065 799 HB3 ASN 123 2HB ASN 123 8.952 -11.830 -11.366 800 HD21 ASN 123 2HD2 ASN 123 9.197 -11.968 -13.770 801 HD22 ASN 123 1HD2 ASN 123 10.542 -11.093 -14.487 802 H GLN 124 H GLN 124 11.616 -10.029 -8.324 803 HA GLN 124 HA GLN 124 9.673 -7.977 -7.853 804 HB3 GLN 124 2HB GLN 124 11.806 -6.922 -6.792 805 HG3 GLN 124 2HG GLN 124 10.375 -9.369 -6.032 806 HE21 GLN 124 2HE2 GLN 124 10.926 -10.661 -4.070 807 HE22 GLN 124 1HE2 GLN 124 12.600 -11.176 -3.932 808 H GLU 125 H GLU 125 10.177 -8.261 -10.762 809 HA GLU 125 HA GLU 125 10.858 -5.495 -11.498 810 HB3 GLU 125 2HB GLU 125 12.504 -6.128 -13.161 811 HG3 GLU 125 2HG GLU 125 13.395 -7.558 -10.627 812 H GLY 126 H GLY 126 9.662 -4.858 -13.303 813 HA2 GLY 126 2HA GLY 126 8.346 -4.984 -15.204 814 H GLY 127 H GLY 127 6.678 -4.780 -13.381 815 HA2 GLY 127 2HA GLY 127 4.645 -6.980 -13.505 816 H VAL 128 H VAL 128 2.663 -5.665 -11.976 817 HA VAL 128 HA VAL 128 1.447 -4.233 -14.128 818 HB VAL 128 HB VAL 128 -0.523 -4.228 -13.033 819 HG11 VAL 128 1HG1 VAL 128 0.415 -6.548 -13.152 820 HG12 VAL 128 2HG1 VAL 128 0.808 -6.375 -11.417 821 HG13 VAL 128 3HG1 VAL 128 -0.881 -6.313 -11.970 822 HG21 VAL 128 3HG2 VAL 128 -0.900 -4.271 -10.596 823 HG22 VAL 128 1HG2 VAL 128 0.851 -4.080 -10.337 824 HG23 VAL 128 2HG2 VAL 128 -0.100 -2.822 -11.164 825 H CYS 129 H CYS 129 2.990 -2.993 -11.150 826 HA CYS 129 HA CYS 129 2.449 -0.294 -11.496 827 HB3 CYS 129 2HB CYS 129 3.462 -0.765 -9.536 828 H GLN 130 H GLN 130 4.264 -2.148 -13.746 829 HA GLN 130 HA GLN 130 5.976 -0.054 -14.769 830 HB3 GLN 130 2HB GLN 130 4.994 -2.495 -16.269 831 HG3 GLN 130 2HG GLN 130 7.824 -1.392 -16.079 832 HE21 GLN 130 2HE2 GLN 130 9.041 -1.938 -18.186 833 HE22 GLN 130 1HE2 GLN 130 8.637 -3.474 -18.946 834 H THR 131 H THR 131 2.746 -1.276 -15.597 835 HA THR 131 HA THR 131 2.354 0.835 -17.693 836 HB THR 131 HB THR 131 2.019 -2.165 -18.094 837 HG1 THR 131 1HG THR 131 3.610 -1.806 -19.705 838 HG21 THR 131 3HG2 THR 131 1.501 -1.554 -20.473 839 HG22 THR 131 1HG2 THR 131 0.259 -1.055 -19.328 840 HG23 THR 131 2HG2 THR 131 1.394 0.154 -19.972 841 H ARG 132 H ARG 132 0.710 -1.833 -15.870 842 HA ARG 132 HA ARG 132 -1.994 -0.891 -16.215 843 HB3 ARG 132 2HB ARG 132 -0.696 -2.247 -13.852 844 HG3 ARG 132 2HG ARG 132 -2.953 -1.624 -13.261 845 HD3 ARG 132 2HD ARG 132 -3.612 -3.304 -15.708 846 HE ARG 132 HE ARG 132 -5.011 -3.414 -13.237 847 HH11 ARG 132 1HH2 ARG 132 -5.756 -3.048 -16.632 848 HH12 ARG 132 2HH2 ARG 132 -7.289 -3.864 -16.483 849 HH21 ARG 132 1HH1 ARG 132 -6.950 -4.469 -13.102 850 HH22 ARG 132 2HH1 ARG 132 -7.949 -4.647 -14.515 851 H ALA 133 H ALA 133 0.645 0.042 -14.124 852 HA ALA 133 HA ALA 133 1.153 1.874 -12.927 853 HB1 ALA 133 3HB ALA 133 -0.062 3.975 -13.142 854 HB2 ALA 133 1HB ALA 133 0.083 3.217 -14.740 855 HB3 ALA 133 2HB ALA 133 -1.450 3.137 -13.847 856 H MET 134 H MET 134 1.225 0.884 -11.040 857 HA MET 134 HA MET 134 -1.053 1.152 -9.149 858 HB3 MET 134 2HB MET 134 0.551 -1.411 -9.490 859 HG3 MET 134 2HG MET 134 -1.719 -0.499 -7.703 860 HE1 MET 134 3HE MET 134 -3.693 -3.411 -6.650 861 HE2 MET 134 1HE MET 134 -2.671 -2.227 -5.798 862 HE3 MET 134 2HE MET 134 -3.679 -1.713 -7.172 863 H LYS 135 H LYS 135 0.158 2.990 -8.683 864 HA LYS 135 HA LYS 135 2.112 2.469 -6.551 865 HB3 LYS 135 2HB LYS 135 3.497 2.894 -8.464 866 HG3 LYS 135 2HG LYS 135 2.531 5.738 -8.820 867 HD3 LYS 135 2HD LYS 135 2.848 4.516 -11.319 868 HE3 LYS 135 2HE LYS 135 5.006 6.019 -9.782 869 HZ1 LYS 135 3HZ LYS 135 5.613 6.722 -12.046 870 HZ2 LYS 135 1HZ LYS 135 5.727 5.094 -11.942 871 HZ3 LYS 135 2HZ LYS 135 4.455 5.781 -12.701 872 H ILE 136 H ILE 136 2.377 4.213 -5.087 873 HA ILE 136 HA ILE 136 -0.035 5.933 -4.940 874 HB ILE 136 HB ILE 136 -0.565 5.435 -2.839 875 HG13 ILE 136 2HG1 ILE 136 2.345 5.286 -2.253 876 HG21 ILE 136 1HG2 ILE 136 -0.561 3.258 -4.064 877 HG22 ILE 136 2HG2 ILE 136 1.014 2.888 -3.355 878 HG23 ILE 136 3HG2 ILE 136 -0.393 3.090 -2.313 879 HD11 ILE 136 3HD1 ILE 136 1.931 6.545 -0.345 880 HD12 ILE 136 1HD1 ILE 136 0.942 7.282 -1.615 881 HD13 ILE 136 2HD1 ILE 136 0.188 6.258 -0.368 882 H LEU 137 H LEU 137 0.134 7.954 -4.066 883 HA LEU 137 HA LEU 137 2.880 9.055 -3.692 884 HB3 LEU 137 2HB LEU 137 0.956 9.616 -5.831 885 HG LEU 137 HG LEU 137 0.506 11.697 -4.491 886 HD11 LEU 137 1HD1 LEU 137 2.770 12.036 -3.473 887 HD12 LEU 137 2HD1 LEU 137 3.432 12.323 -5.093 888 HD13 LEU 137 3HD1 LEU 137 2.217 13.428 -4.409 889 HD21 LEU 137 3HD2 LEU 137 0.853 13.162 -6.429 890 HD22 LEU 137 1HD2 LEU 137 2.029 12.014 -7.105 891 HD23 LEU 137 2HD2 LEU 137 0.321 11.562 -6.959 892 H MET 138 H MET 138 3.066 9.939 -1.827 893 HA MET 138 HA MET 138 0.778 11.360 -0.540 894 HB3 MET 138 2HB MET 138 2.787 9.664 0.991 895 HG3 MET 138 2HG MET 138 0.347 11.264 1.760 896 HE1 MET 138 3HE MET 138 -0.602 10.016 5.213 897 HE2 MET 138 1HE MET 138 0.298 11.473 4.734 898 HE3 MET 138 2HE MET 138 -1.083 10.917 3.762 899 H LYS 139 H LYS 139 1.322 13.385 -0.813 900 HA LYS 139 HA LYS 139 4.118 14.355 -0.483 901 HB3 LYS 139 2HB LYS 139 1.788 16.202 -0.989 902 HG3 LYS 139 2HG LYS 139 4.536 15.837 -2.274 903 HD3 LYS 139 2HD LYS 139 2.294 17.850 -2.621 904 HE3 LYS 139 2HE LYS 139 5.269 18.312 -3.094 905 HZ1 LYS 139 3HZ LYS 139 4.479 20.502 -3.846 906 HZ2 LYS 139 1HZ LYS 139 3.939 19.327 -4.844 907 HZ3 LYS 139 2HZ LYS 139 2.924 20.016 -3.760 908 H VAL 140 H VAL 140 4.733 15.531 1.374 909 HA VAL 140 HA VAL 140 2.708 16.562 3.254 910 HB VAL 140 HB VAL 140 3.965 15.535 5.205 911 HG11 VAL 140 1HG1 VAL 140 1.668 14.841 4.487 912 HG12 VAL 140 2HG1 VAL 140 2.414 13.505 3.573 913 HG13 VAL 140 3HG1 VAL 140 2.609 13.596 5.337 914 HG21 VAL 140 3HG2 VAL 140 4.992 13.333 4.923 915 HG22 VAL 140 1HG2 VAL 140 4.832 13.436 3.164 916 HG23 VAL 140 2HG2 VAL 140 5.911 14.544 4.030 917 H GLY 141 H GLY 141 3.360 18.580 3.741 918 HA2 GLY 141 2HA GLY 141 5.876 19.539 4.524 919 H GLN 142 H GLN 142 4.155 20.770 5.576 920 HA GLN 142 HA GLN 142 3.177 23.176 4.076 921 HB3 GLN 142 2HB GLN 142 1.791 23.129 6.470 922 HG3 GLN 142 2HG GLN 142 0.112 21.627 4.891 923 HE21 GLN 142 2HE2 GLN 142 0.790 24.631 3.181 924 HE22 GLN 142 1HE2 GLN 142 -0.399 25.573 4.071 Start of MODEL 3 1 H1 SER 1 H SER 1 -8.576 21.819 12.420 2 HA SER 1 HA SER 1 -7.259 19.323 12.816 3 HB3 SER 1 2HB SER 1 -8.686 18.293 14.552 4 HG SER 1 HG SER 1 -7.508 19.274 16.242 5 H LYS 2 H LYS 2 -7.995 18.473 10.921 6 HA LYS 2 HA LYS 2 -10.853 18.713 10.155 7 HB3 LYS 2 2HB LYS 2 -8.906 17.022 8.599 8 HG3 LYS 2 2HG LYS 2 -11.470 18.069 8.118 9 HD3 LYS 2 2HD LYS 2 -9.556 19.567 6.305 10 HE3 LYS 2 2HE LYS 2 -12.473 20.141 6.970 11 HZ1 LYS 2 3HZ LYS 2 -12.419 21.175 4.802 12 HZ2 LYS 2 1HZ LYS 2 -11.167 21.783 5.652 13 HZ3 LYS 2 2HZ LYS 2 -10.906 20.657 4.494 14 H SER 3 H SER 3 -11.766 16.542 9.242 15 HA SER 3 HA SER 3 -10.861 14.017 10.304 16 HB3 SER 3 2HB SER 3 -13.458 15.178 11.387 17 HG SER 3 HG SER 3 -13.627 13.112 12.379 18 H ILE 4 H ILE 4 -11.074 12.888 8.494 19 HA ILE 4 HA ILE 4 -13.510 13.187 6.777 20 HB ILE 4 HB ILE 4 -11.799 12.249 4.960 21 HG13 ILE 4 2HG1 ILE 4 -9.685 13.103 4.881 22 HG21 ILE 4 1HG2 ILE 4 -13.347 14.041 4.632 23 HG22 ILE 4 2HG2 ILE 4 -12.352 15.154 5.593 24 HG23 ILE 4 3HG2 ILE 4 -11.760 14.532 4.031 25 HD11 ILE 4 3HD1 ILE 4 -8.599 14.618 6.466 26 HD12 ILE 4 1HD1 ILE 4 -9.904 15.429 5.594 27 HD13 ILE 4 2HD1 ILE 4 -10.139 14.923 7.283 28 H VAL 5 H VAL 5 -10.836 10.873 7.425 29 HA VAL 5 HA VAL 5 -10.772 8.669 7.803 30 HB VAL 5 HB VAL 5 -13.606 8.991 8.849 31 HG11 VAL 5 1HG1 VAL 5 -13.188 6.628 8.439 32 HG12 VAL 5 2HG1 VAL 5 -11.589 6.724 9.188 33 HG13 VAL 5 3HG1 VAL 5 -13.055 6.932 10.168 34 HG21 VAL 5 3HG2 VAL 5 -12.449 9.063 11.056 35 HG22 VAL 5 1HG2 VAL 5 -10.884 9.074 10.215 36 HG23 VAL 5 2HG2 VAL 5 -12.009 10.429 10.037 37 H LEU 6 H LEU 6 -10.425 7.504 6.109 38 HA LEU 6 HA LEU 6 -12.661 6.599 4.345 39 HB3 LEU 6 2HB LEU 6 -10.481 6.824 2.632 40 HG LEU 6 HG LEU 6 -12.849 8.621 3.280 41 HD11 LEU 6 1HD1 LEU 6 -11.093 10.179 2.630 42 HD12 LEU 6 2HD1 LEU 6 -10.733 9.200 1.183 43 HD13 LEU 6 3HD1 LEU 6 -12.300 10.031 1.346 44 HD21 LEU 6 3HD2 LEU 6 -13.498 7.959 0.985 45 HD22 LEU 6 1HD2 LEU 6 -11.964 7.090 0.786 46 HD23 LEU 6 2HD2 LEU 6 -13.167 6.517 1.960 47 H GLU 7 H GLU 7 -11.942 4.698 2.991 48 HA GLU 7 HA GLU 7 -10.137 2.851 4.500 49 HB3 GLU 7 2HB GLU 7 -11.764 1.073 4.244 50 HG3 GLU 7 2HG GLU 7 -11.695 2.818 6.328 51 HA PRO 8 HA PRO 8 -9.203 2.856 0.023 52 HB3 PRO 8 2HB PRO 8 -7.148 3.757 0.315 53 HG3 PRO 8 2HG PRO 8 -6.031 3.627 2.388 54 HD3 PRO 8 2HD PRO 8 -8.226 4.313 3.002 55 H ILE 9 H ILE 9 -8.354 0.277 2.407 56 HA ILE 9 HA ILE 9 -9.089 -1.775 0.354 57 HB ILE 9 HB ILE 9 -7.086 -2.668 2.300 58 HG13 ILE 9 2HG1 ILE 9 -5.124 -1.728 1.537 59 HG21 ILE 9 1HG2 ILE 9 -7.890 -4.045 0.521 60 HG22 ILE 9 2HG2 ILE 9 -7.295 -2.896 -0.695 61 HG23 ILE 9 3HG2 ILE 9 -6.149 -3.758 0.356 62 HD11 ILE 9 3HD1 ILE 9 -5.006 0.156 -0.076 63 HD12 ILE 9 1HD1 ILE 9 -5.254 -1.446 -0.787 64 HD13 ILE 9 2HD1 ILE 9 -6.625 -0.331 -0.632 65 H TYR 10 H TYR 10 -10.973 -2.471 1.041 66 HA TYR 10 HA TYR 10 -11.389 -3.045 3.938 67 HB3 TYR 10 2HB TYR 10 -13.469 -1.614 2.255 68 HD1 TYR 10 2HD TYR 10 -11.940 -1.167 5.639 69 HD2 TYR 10 1HD TYR 10 -15.421 -2.461 3.441 70 HE1 TYR 10 2HE TYR 10 -13.239 -1.250 7.761 71 HE2 TYR 10 1HE TYR 10 -16.721 -2.557 5.570 72 HH TYR 10 HH TYR 10 -15.302 -1.712 8.741 73 H TRP 11 H TRP 11 -10.748 -5.115 2.954 74 HA TRP 11 HA TRP 11 -11.170 -7.271 2.538 75 HB3 TRP 11 2HB TRP 11 -13.305 -8.276 2.635 76 HD1 TRP 11 HD TRP 11 -14.588 -5.107 4.220 77 HE1 TRP 11 1HE TRP 11 -14.422 -5.205 6.772 78 HE3 TRP 11 3HE TRP 11 -11.903 -9.425 4.645 79 HZ2 TRP 11 2HZ TRP 11 -13.237 -6.985 8.782 80 HZ3 TRP 11 3HZ TRP 11 -11.263 -10.313 6.876 81 HH2 TRP 11 HH TRP 11 -11.921 -9.103 8.941 82 H ASN 12 H ASN 12 -13.196 -5.231 0.483 83 HA ASN 12 HA ASN 12 -12.748 -6.651 -2.044 84 HB3 ASN 12 2HB ASN 12 -13.508 -4.013 -2.619 85 HD21 ASN 12 2HD2 ASN 12 -16.102 -5.711 -1.028 86 HD22 ASN 12 1HD2 ASN 12 -16.700 -6.473 -2.495 87 H SER 13 H SER 13 -11.126 -6.394 -3.452 88 HA SER 13 HA SER 13 -8.793 -4.777 -2.908 89 HB3 SER 13 2HB SER 13 -8.137 -5.458 -5.224 90 HG SER 13 HG SER 13 -8.001 -7.652 -4.615 91 H SER 14 H SER 14 -11.690 -4.255 -4.900 92 HA SER 14 HA SER 14 -10.856 -1.986 -6.399 93 HB3 SER 14 2HB SER 14 -13.377 -1.335 -6.128 94 HG SER 14 HG SER 14 -13.789 -2.744 -7.802 95 H ASN 15 H ASN 15 -10.322 -0.038 -5.869 96 HA ASN 15 HA ASN 15 -10.580 0.891 -3.050 97 HB3 ASN 15 2HB ASN 15 -8.572 1.944 -5.061 98 HD21 ASN 15 2HD2 ASN 15 -6.741 0.475 -2.976 99 HD22 ASN 15 1HD2 ASN 15 -6.693 1.666 -1.687 100 H SER 16 H SER 16 -10.508 3.464 -2.910 101 HA SER 16 HA SER 16 -12.899 4.469 -4.193 102 HB3 SER 16 2HB SER 16 -12.191 5.217 -1.981 103 HG SER 16 HG SER 16 -10.436 6.771 -1.929 104 H LYS 17 H LYS 17 -9.448 5.162 -4.702 105 HA LYS 17 HA LYS 17 -9.829 6.775 -7.121 106 HB3 LYS 17 2HB LYS 17 -7.251 6.377 -7.244 107 HG3 LYS 17 2HG LYS 17 -7.153 7.496 -4.698 108 HD3 LYS 17 2HD LYS 17 -7.350 8.573 -7.468 109 HE3 LYS 17 2HE LYS 17 -7.457 10.923 -6.586 110 HZ1 LYS 17 3HZ LYS 17 -9.862 10.976 -6.560 111 HZ2 LYS 17 1HZ LYS 17 -9.390 9.903 -7.689 112 HZ3 LYS 17 2HZ LYS 17 -9.980 9.382 -6.254 113 H PHE 18 H PHE 18 -9.315 3.362 -6.542 114 HA PHE 18 HA PHE 18 -8.917 1.575 -7.932 115 HB3 PHE 18 2HB PHE 18 -11.257 3.002 -9.217 116 HD1 PHE 18 2HD PHE 18 -9.956 -0.575 -8.856 117 HD2 PHE 18 1HD PHE 18 -11.762 2.425 -11.394 118 HE1 PHE 18 2HE PHE 18 -10.063 -2.208 -10.729 119 HE2 PHE 18 1HE PHE 18 -11.860 0.790 -13.257 120 HZ PHE 18 HZ PHE 18 -11.035 -1.539 -12.925 121 H LEU 19 H LEU 19 -6.770 2.882 -8.329 122 HA LEU 19 HA LEU 19 -5.164 3.699 -9.758 123 HB3 LEU 19 2HB LEU 19 -4.580 1.448 -9.595 124 HG LEU 19 HG LEU 19 -6.886 0.901 -11.438 125 HD11 LEU 19 1HD1 LEU 19 -5.034 0.349 -12.896 126 HD12 LEU 19 2HD1 LEU 19 -4.237 -0.579 -11.602 127 HD13 LEU 19 3HD1 LEU 19 -5.779 -1.135 -12.306 128 HD21 LEU 19 3HD2 LEU 19 -6.909 -1.217 -10.174 129 HD22 LEU 19 1HD2 LEU 19 -5.367 -0.801 -9.398 130 HD23 LEU 19 2HD2 LEU 19 -6.827 0.134 -9.036 131 HA PRO 20 HA PRO 20 -7.984 5.469 -12.928 132 HB3 PRO 20 2HB PRO 20 -8.697 7.094 -11.460 133 HG3 PRO 20 2HG PRO 20 -7.355 7.881 -9.730 134 HD3 PRO 20 2HD PRO 20 -6.989 5.607 -9.380 135 H GLY 21 H GLY 21 -4.640 5.596 -12.460 136 HA2 GLY 21 2HA GLY 21 -3.796 5.418 -15.040 137 H GLN 22 H GLN 22 -3.028 6.731 -11.863 138 HA GLN 22 HA GLN 22 -0.264 5.576 -12.044 139 HB3 GLN 22 2HB GLN 22 0.230 7.241 -10.153 140 HG3 GLN 22 2HG GLN 22 -0.322 8.449 -12.893 141 HE21 GLN 22 2HE2 GLN 22 0.949 10.406 -13.300 142 HE22 GLN 22 1HE2 GLN 22 1.829 11.174 -11.982 143 H GLY 23 H GLY 23 -3.203 5.585 -10.019 144 HA2 GLY 23 2HA GLY 23 -3.263 3.206 -9.064 145 H LEU 24 H LEU 24 -1.914 5.105 -6.424 146 HA LEU 24 HA LEU 24 -4.583 6.189 -5.721 147 HB3 LEU 24 2HB LEU 24 -3.090 5.230 -3.336 148 HG LEU 24 HG LEU 24 -5.671 6.000 -3.899 149 HD11 LEU 24 1HD1 LEU 24 -5.923 3.918 -5.316 150 HD12 LEU 24 2HD1 LEU 24 -5.681 2.965 -3.854 151 HD13 LEU 24 3HD1 LEU 24 -7.089 4.060 -3.984 152 HD21 LEU 24 3HD2 LEU 24 -6.396 4.969 -1.812 153 HD22 LEU 24 1HD2 LEU 24 -4.888 4.015 -1.747 154 HD23 LEU 24 2HD2 LEU 24 -4.844 5.793 -1.649 155 H VAL 25 H VAL 25 -4.538 8.224 -4.859 156 HA VAL 25 HA VAL 25 -1.848 9.468 -4.324 157 HB VAL 25 HB VAL 25 -4.492 10.660 -5.234 158 HG11 VAL 25 1HG1 VAL 25 -3.606 12.213 -3.576 159 HG12 VAL 25 2HG1 VAL 25 -1.970 12.082 -4.262 160 HG13 VAL 25 3HG1 VAL 25 -3.279 12.861 -5.180 161 HG21 VAL 25 3HG2 VAL 25 -3.065 11.448 -7.119 162 HG22 VAL 25 1HG2 VAL 25 -1.656 10.649 -6.385 163 HG23 VAL 25 2HG2 VAL 25 -3.018 9.683 -6.988 164 H LEU 26 H LEU 26 -1.391 10.102 -2.397 165 HA LEU 26 HA LEU 26 -3.494 10.101 -0.280 166 HB3 LEU 26 2HB LEU 26 -1.124 9.835 1.094 167 HG LEU 26 HG LEU 26 -1.607 7.549 1.494 168 HD11 LEU 26 1HD1 LEU 26 -3.058 9.374 2.488 169 HD12 LEU 26 2HD1 LEU 26 -4.308 8.925 1.295 170 HD13 LEU 26 3HD1 LEU 26 -3.719 7.746 2.465 171 HD21 LEU 26 3HD2 LEU 26 -3.382 6.299 0.404 172 HD22 LEU 26 1HD2 LEU 26 -3.664 7.626 -0.731 173 HD23 LEU 26 2HD2 LEU 26 -2.127 6.746 -0.767 174 H TYR 27 H TYR 27 -3.445 11.589 1.282 175 HA TYR 27 HA TYR 27 -2.063 14.148 0.666 176 HB3 TYR 27 2HB TYR 27 -4.203 14.629 0.100 177 HD1 TYR 27 2HD TYR 27 -5.409 12.664 -0.650 178 HD2 TYR 27 1HD TYR 27 -5.460 13.864 3.494 179 HE1 TYR 27 2HE TYR 27 -7.351 11.162 -0.245 180 HE2 TYR 27 1HE TYR 27 -7.425 12.387 3.892 181 HH TYR 27 HH TYR 27 -8.840 10.359 1.314 182 HA PRO 28 HA PRO 28 -0.587 13.385 4.919 183 HB3 PRO 28 2HB PRO 28 1.532 13.753 4.081 184 HG3 PRO 28 2HG PRO 28 1.935 15.352 2.368 185 HD3 PRO 28 2HD PRO 28 0.226 14.023 1.425 186 H GLN 29 H GLN 29 -2.832 14.086 5.413 187 HA GLN 29 HA GLN 29 -2.895 16.722 6.836 188 HB3 GLN 29 2HB GLN 29 -5.488 16.401 6.391 189 HG3 GLN 29 2HG GLN 29 -3.664 17.448 4.182 190 HE21 GLN 29 2HE2 GLN 29 -5.193 20.084 4.751 191 HE22 GLN 29 1HE2 GLN 29 -6.736 19.820 3.952 192 H ILE 30 H ILE 30 -3.014 16.531 8.856 193 HA ILE 30 HA ILE 30 -3.613 14.127 10.337 194 HB ILE 30 HB ILE 30 -3.298 17.024 11.197 195 HG13 ILE 30 2HG1 ILE 30 -1.050 16.375 11.927 196 HG21 ILE 30 1HG2 ILE 30 -4.532 15.823 12.929 197 HG22 ILE 30 2HG2 ILE 30 -3.379 14.480 12.862 198 HG23 ILE 30 3HG2 ILE 30 -2.869 16.064 13.465 199 HD11 ILE 30 3HD1 ILE 30 0.074 14.365 11.140 200 HD12 ILE 30 1HD1 ILE 30 -1.257 13.891 12.200 201 HD13 ILE 30 2HD1 ILE 30 -1.411 13.747 10.430 202 H GLY 31 H GLY 31 -5.394 13.447 11.266 203 HA2 GLY 31 2HA GLY 31 -7.632 13.780 12.148 204 H ASP 32 H ASP 32 -6.536 13.083 8.887 205 HA ASP 32 HA ASP 32 -8.794 11.402 8.127 206 HB3 ASP 32 2HB ASP 32 -5.954 11.452 7.025 207 H LYS 33 H LYS 33 -8.547 9.094 7.768 208 HA LYS 33 HA LYS 33 -6.536 7.601 9.274 209 HB3 LYS 33 2HB LYS 33 -8.135 6.134 10.398 210 HG3 LYS 33 2HG LYS 33 -8.901 8.954 11.230 211 HD3 LYS 33 2HD LYS 33 -8.165 6.946 13.262 212 HE3 LYS 33 2HE LYS 33 -10.806 8.389 12.752 213 HZ1 LYS 33 3HZ LYS 33 -10.967 8.202 15.167 214 HZ2 LYS 33 1HZ LYS 33 -10.752 6.707 14.544 215 HZ3 LYS 33 2HZ LYS 33 -9.511 7.470 15.268 216 H LEU 34 H LEU 34 -6.410 5.466 8.521 217 HA LEU 34 HA LEU 34 -8.053 4.714 6.165 218 HB3 LEU 34 2HB LEU 34 -6.186 4.262 4.769 219 HG LEU 34 HG LEU 34 -6.990 6.850 5.260 220 HD11 LEU 34 1HD1 LEU 34 -5.141 7.265 6.891 221 HD12 LEU 34 2HD1 LEU 34 -3.966 6.697 5.683 222 HD13 LEU 34 3HD1 LEU 34 -4.883 8.196 5.407 223 HD21 LEU 34 3HD2 LEU 34 -5.759 7.477 3.308 224 HD22 LEU 34 1HD2 LEU 34 -4.779 5.984 3.420 225 HD23 LEU 34 2HD2 LEU 34 -6.524 5.912 3.097 226 H ASP 35 H ASP 35 -8.532 2.672 6.190 227 HA ASP 35 HA ASP 35 -7.000 0.715 7.856 228 HB3 ASP 35 2HB ASP 35 -9.092 -0.625 7.687 229 H ILE 36 H ILE 36 -6.012 -0.896 6.859 230 HA ILE 36 HA ILE 36 -6.735 -1.655 4.090 231 HB ILE 36 HB ILE 36 -4.650 -0.830 3.715 232 HG13 ILE 36 2HG1 ILE 36 -4.994 -3.413 3.196 233 HG21 ILE 36 1HG2 ILE 36 -3.880 -0.303 5.979 234 HG22 ILE 36 2HG2 ILE 36 -3.585 -2.031 6.278 235 HG23 ILE 36 3HG2 ILE 36 -2.626 -1.145 5.080 236 HD11 ILE 36 3HD1 ILE 36 -2.221 -3.426 2.962 237 HD12 ILE 36 1HD1 ILE 36 -3.372 -2.973 1.700 238 HD13 ILE 36 2HD1 ILE 36 -2.651 -1.714 2.737 239 H ILE 37 H ILE 37 -7.893 -3.352 4.225 240 HA ILE 37 HA ILE 37 -7.073 -5.679 5.904 241 HB ILE 37 HB ILE 37 -9.816 -4.458 5.390 242 HG13 ILE 37 2HG1 ILE 37 -8.319 -3.780 7.430 243 HG21 ILE 37 1HG2 ILE 37 -10.145 -6.825 4.995 244 HG22 ILE 37 2HG2 ILE 37 -9.111 -7.263 6.379 245 HG23 ILE 37 3HG2 ILE 37 -10.687 -6.513 6.631 246 HD11 ILE 37 3HD1 ILE 37 -10.152 -3.748 9.016 247 HD12 ILE 37 1HD1 ILE 37 -10.721 -3.261 7.409 248 HD13 ILE 37 2HD1 ILE 37 -11.093 -4.880 8.040 249 H CYS 38 H CYS 38 -6.792 -7.468 4.782 250 HA CYS 38 HA CYS 38 -8.167 -7.905 2.180 251 HB3 CYS 38 2HB CYS 38 -5.236 -8.310 2.773 252 HA PRO 39 HA PRO 39 -8.959 -11.815 4.450 253 HB3 PRO 39 2HB PRO 39 -11.129 -11.522 3.660 254 HG3 PRO 39 2HG PRO 39 -11.590 -10.690 1.517 255 HD3 PRO 39 2HD PRO 39 -10.158 -9.035 2.262 256 H LYS 40 H LYS 40 -9.073 -14.235 3.417 257 HA LYS 40 HA LYS 40 -6.638 -14.691 1.759 258 HB3 LYS 40 2HB LYS 40 -6.052 -14.778 4.158 259 HG3 LYS 40 2HG LYS 40 -6.555 -17.020 5.290 260 HD3 LYS 40 2HD LYS 40 -8.054 -14.544 5.501 261 HE3 LYS 40 2HE LYS 40 -9.505 -17.158 6.104 262 HZ1 LYS 40 3HZ LYS 40 -11.178 -15.684 7.098 263 HZ2 LYS 40 1HZ LYS 40 -9.774 -15.585 7.917 264 HZ3 LYS 40 2HZ LYS 40 -10.219 -14.380 6.907 265 H VAL 41 H VAL 41 -6.413 -16.802 0.950 266 HA VAL 41 HA VAL 41 -8.937 -18.260 0.289 267 HB VAL 41 HB VAL 41 -6.972 -17.041 -1.710 268 HG11 VAL 41 1HG1 VAL 41 -7.682 -19.280 -2.489 269 HG12 VAL 41 2HG1 VAL 41 -9.373 -18.856 -2.160 270 HG13 VAL 41 3HG1 VAL 41 -8.463 -18.028 -3.439 271 HG21 VAL 41 3HG2 VAL 41 -9.008 -15.884 -2.569 272 HG22 VAL 41 1HG2 VAL 41 -9.958 -16.564 -1.231 273 HG23 VAL 41 2HG2 VAL 41 -8.650 -15.406 -0.915 274 H ASP 42 H ASP 42 -8.641 -20.249 0.761 275 HA ASP 42 HA ASP 42 -6.912 -21.932 -0.654 276 HB3 ASP 42 2HB ASP 42 -6.089 -22.818 1.935 277 H SER 43 H SER 43 -8.348 -21.966 2.652 278 HA SER 43 HA SER 43 -9.706 -24.525 2.202 279 HB3 SER 43 2HB SER 43 -10.684 -24.031 4.481 280 HG SER 43 HG SER 43 -8.696 -24.441 5.470 281 H LYS 44 H LYS 44 -10.663 -21.115 2.218 282 HA LYS 44 HA LYS 44 -13.550 -21.669 2.007 283 HB3 LYS 44 2HB LYS 44 -13.733 -19.204 1.661 284 HG3 LYS 44 2HG LYS 44 -12.735 -18.397 3.766 285 HD3 LYS 44 2HD LYS 44 -14.707 -20.455 3.630 286 HE3 LYS 44 2HE LYS 44 -12.599 -20.869 5.789 287 HZ1 LYS 44 3HZ LYS 44 -14.273 -22.182 6.955 288 HZ2 LYS 44 1HZ LYS 44 -14.739 -20.626 6.889 289 HZ3 LYS 44 2HZ LYS 44 -15.441 -21.729 5.911 290 H THR 45 H THR 45 -11.066 -20.448 -0.209 291 HA THR 45 HA THR 45 -11.125 -20.016 -2.460 292 HB THR 45 HB THR 45 -11.490 -22.298 -3.752 293 HG1 THR 45 1HG THR 45 -10.693 -23.854 -1.986 294 HG21 THR 45 3HG2 THR 45 -9.199 -22.891 -3.111 295 HG22 THR 45 1HG2 THR 45 -9.424 -21.188 -3.504 296 HG23 THR 45 2HG2 THR 45 -9.257 -21.676 -1.810 297 H VAL 46 H VAL 46 -13.470 -19.083 -1.444 298 HA VAL 46 HA VAL 46 -15.667 -19.775 -3.248 299 HB VAL 46 HB VAL 46 -15.456 -18.813 -0.622 300 HG11 VAL 46 1HG1 VAL 46 -15.351 -16.455 -1.365 301 HG12 VAL 46 2HG1 VAL 46 -16.899 -16.669 -2.224 302 HG13 VAL 46 3HG1 VAL 46 -16.821 -16.824 -0.461 303 HG21 VAL 46 3HG2 VAL 46 -17.889 -19.044 -0.612 304 HG22 VAL 46 1HG2 VAL 46 -17.907 -19.059 -2.390 305 HG23 VAL 46 2HG2 VAL 46 -17.110 -20.366 -1.486 306 H GLY 47 H GLY 47 -13.350 -17.140 -2.967 307 HA2 GLY 47 2HA GLY 47 -14.493 -15.749 -5.363 308 H GLN 48 H GLN 48 -11.922 -17.886 -4.543 309 HA GLN 48 HA GLN 48 -9.836 -18.363 -5.408 310 HB3 GLN 48 2HB GLN 48 -10.195 -18.757 -8.019 311 HG3 GLN 48 2HG GLN 48 -11.840 -20.688 -7.340 312 HE21 GLN 48 2HE2 GLN 48 -10.408 -22.141 -8.328 313 HE22 GLN 48 1HE2 GLN 48 -8.765 -22.406 -7.756 314 H TYR 49 H TYR 49 -8.995 -16.365 -4.651 315 HA TYR 49 HA TYR 49 -8.134 -14.462 -6.774 316 HB3 TYR 49 2HB TYR 49 -8.135 -13.609 -3.919 317 HD1 TYR 49 1HD TYR 49 -10.198 -12.942 -7.010 318 HD2 TYR 49 2HD TYR 49 -7.221 -11.463 -4.255 319 HE1 TYR 49 1HE TYR 49 -10.253 -10.716 -8.139 320 HE2 TYR 49 2HE TYR 49 -7.237 -9.272 -5.407 321 HH TYR 49 HH TYR 49 -8.191 -7.984 -7.128 322 H GLU 50 H GLU 50 -6.140 -13.243 -6.225 323 HA GLU 50 HA GLU 50 -3.988 -15.041 -5.168 324 HB3 GLU 50 2HB GLU 50 -2.619 -13.137 -6.545 325 HG3 GLU 50 2HG GLU 50 -2.748 -15.783 -6.810 326 H TYR 51 H TYR 51 -2.109 -13.863 -4.392 327 HA TYR 51 HA TYR 51 -2.756 -11.917 -2.246 328 HB3 TYR 51 2HB TYR 51 -1.579 -13.926 -1.553 329 HD1 TYR 51 1HD TYR 51 -1.256 -15.693 -3.218 330 HD2 TYR 51 2HD TYR 51 1.418 -12.309 -2.990 331 HE1 TYR 51 1HE TYR 51 0.306 -16.813 -4.801 332 HE2 TYR 51 2HE TYR 51 2.972 -13.429 -4.582 333 HH TYR 51 HH TYR 51 3.214 -15.190 -6.028 334 H TYR 52 H TYR 52 -1.106 -10.197 -1.918 335 HA TYR 52 HA TYR 52 0.231 -9.122 -4.329 336 HB3 TYR 52 2HB TYR 52 -0.838 -6.869 -3.884 337 HD1 TYR 52 2HD TYR 52 -0.852 -8.800 -6.188 338 HD2 TYR 52 1HD TYR 52 -4.046 -7.281 -3.706 339 HE1 TYR 52 2HE TYR 52 -2.473 -9.237 -8.004 340 HE2 TYR 52 1HE TYR 52 -5.640 -7.597 -5.591 341 HH TYR 52 HH TYR 52 -4.634 -9.007 -8.730 342 H LYS 53 H LYS 53 1.630 -7.406 -3.886 343 HA LYS 53 HA LYS 53 2.474 -6.989 -1.088 344 HB3 LYS 53 2HB LYS 53 3.958 -8.611 -1.483 345 HG3 LYS 53 2HG LYS 53 4.223 -7.726 -4.380 346 HD3 LYS 53 2HD LYS 53 6.056 -9.297 -2.546 347 HE3 LYS 53 2HE LYS 53 5.992 -9.784 -5.545 348 HZ1 LYS 53 3HZ LYS 53 7.415 -11.595 -4.898 349 HZ2 LYS 53 1HZ LYS 53 8.032 -10.261 -4.192 350 HZ3 LYS 53 2HZ LYS 53 7.182 -11.333 -3.296 351 H VAL 54 H VAL 54 1.968 -5.107 -0.790 352 HA VAL 54 HA VAL 54 2.766 -2.766 -2.474 353 HB VAL 54 HB VAL 54 0.979 -3.290 -0.107 354 HG11 VAL 54 1HG1 VAL 54 2.183 -1.697 1.085 355 HG12 VAL 54 2HG1 VAL 54 2.470 -0.716 -0.346 356 HG13 VAL 54 3HG1 VAL 54 0.843 -0.798 0.358 357 HG21 VAL 54 3HG2 VAL 54 -0.489 -1.809 -1.368 358 HG22 VAL 54 1HG2 VAL 54 0.863 -1.306 -2.409 359 HG23 VAL 54 2HG2 VAL 54 0.250 -2.964 -2.487 360 H TYR 55 H TYR 55 4.773 -1.897 -2.244 361 HA TYR 55 HA TYR 55 5.999 -1.739 0.439 362 HB3 TYR 55 2HB TYR 55 7.286 -3.087 -1.946 363 HD1 TYR 55 2HD TYR 55 8.127 -2.371 1.705 364 HD2 TYR 55 1HD TYR 55 9.446 -2.502 -2.391 365 HE1 TYR 55 2HE TYR 55 10.368 -1.481 2.380 366 HE2 TYR 55 1HE TYR 55 11.696 -1.696 -1.701 367 HH TYR 55 HH TYR 55 12.475 -0.863 1.685 368 H MET 56 H MET 56 7.686 -0.177 0.612 369 HA MET 56 HA MET 56 7.005 2.241 -0.859 370 HB3 MET 56 2HB MET 56 8.456 3.371 0.758 371 HG3 MET 56 2HG MET 56 6.703 1.280 2.113 372 HE1 MET 56 3HE MET 56 8.524 2.043 5.356 373 HE2 MET 56 1HE MET 56 7.504 0.878 4.490 374 HE3 MET 56 2HE MET 56 9.040 1.416 3.776 375 H VAL 57 H VAL 57 7.964 2.727 -2.748 376 HA VAL 57 HA VAL 57 10.878 2.426 -3.156 377 HB VAL 57 HB VAL 57 9.077 1.388 -5.344 378 HG11 VAL 57 1HG1 VAL 57 11.558 1.833 -5.725 379 HG12 VAL 57 2HG1 VAL 57 11.920 0.692 -4.422 380 HG13 VAL 57 3HG1 VAL 57 11.157 0.123 -5.920 381 HG21 VAL 57 3HG2 VAL 57 9.431 -0.907 -4.747 382 HG22 VAL 57 1HG2 VAL 57 10.219 -0.414 -3.219 383 HG23 VAL 57 2HG2 VAL 57 8.491 -0.101 -3.508 384 H ASP 58 H ASP 58 11.668 3.836 -4.725 385 HA ASP 58 HA ASP 58 10.381 6.294 -5.107 386 HB3 ASP 58 2HB ASP 58 12.266 6.896 -6.432 387 H LYS 59 H LYS 59 9.474 7.369 -7.033 388 HA LYS 59 HA LYS 59 7.995 5.725 -8.864 389 HB3 LYS 59 2HB LYS 59 8.652 8.563 -9.617 390 HG3 LYS 59 2HG LYS 59 6.072 6.973 -9.192 391 HD3 LYS 59 2HD LYS 59 6.026 9.566 -8.951 392 HE3 LYS 59 2HE LYS 59 5.831 9.410 -11.977 393 HZ1 LYS 59 3HZ LYS 59 6.121 11.779 -11.789 394 HZ2 LYS 59 1HZ LYS 59 4.949 11.372 -10.730 395 HZ3 LYS 59 2HZ LYS 59 6.457 11.709 -10.199 396 H ASP 60 H ASP 60 11.242 6.945 -9.060 397 HA ASP 60 HA ASP 60 11.906 6.427 -11.794 398 HB3 ASP 60 2HB ASP 60 13.482 6.263 -9.196 399 H GLN 61 H GLN 61 11.298 4.111 -9.122 400 HA GLN 61 HA GLN 61 12.551 1.870 -10.393 401 HB3 GLN 61 2HB GLN 61 11.586 2.282 -7.965 402 HG3 GLN 61 2HG GLN 61 9.084 2.030 -8.831 403 HE21 GLN 61 2HE2 GLN 61 9.674 -1.038 -7.215 404 HE22 GLN 61 1HE2 GLN 61 9.089 -2.018 -8.557 405 H ALA 62 H ALA 62 9.320 3.321 -10.698 406 HA ALA 62 HA ALA 62 8.065 1.188 -12.082 407 HB1 ALA 62 3HB ALA 62 6.245 2.748 -12.442 408 HB2 ALA 62 1HB ALA 62 6.883 3.005 -10.813 409 HB3 ALA 62 2HB ALA 62 7.288 4.139 -12.116 410 H ASP 63 H ASP 63 10.187 3.639 -13.193 411 HA ASP 63 HA ASP 63 9.763 3.763 -16.002 412 HB3 ASP 63 2HB ASP 63 12.500 3.790 -14.718 413 H ARG 64 H ARG 64 11.339 1.342 -13.959 414 HA ARG 64 HA ARG 64 11.766 -0.554 -16.263 415 HB3 ARG 64 2HB ARG 64 13.456 -1.598 -14.704 416 HG3 ARG 64 2HG ARG 64 15.225 0.038 -14.759 417 HD3 ARG 64 2HD ARG 64 13.555 0.408 -17.266 418 HE ARG 64 HE ARG 64 16.296 0.911 -16.691 419 HH11 ARG 64 1HH2 ARG 64 14.413 -0.705 -19.169 420 HH12 ARG 64 2HH2 ARG 64 15.668 -0.530 -20.365 421 HH21 ARG 64 1HH1 ARG 64 17.865 1.082 -18.290 422 HH22 ARG 64 2HH1 ARG 64 17.544 0.450 -19.878 423 H CYS 65 H CYS 65 10.007 -0.018 -13.436 424 HA CYS 65 HA CYS 65 8.535 -1.084 -12.259 425 HB3 CYS 65 2HB CYS 65 8.214 -3.402 -14.104 426 H THR 66 H THR 66 11.074 -1.372 -11.402 427 HA THR 66 HA THR 66 11.527 -4.195 -10.514 428 HB THR 66 HB THR 66 13.941 -3.639 -10.511 429 HG1 THR 66 1HG THR 66 14.686 -1.854 -11.373 430 HG21 THR 66 3HG2 THR 66 14.276 -3.715 -12.926 431 HG22 THR 66 1HG2 THR 66 12.867 -4.709 -12.529 432 HG23 THR 66 2HG2 THR 66 12.637 -3.106 -13.214 433 H ILE 67 H ILE 67 10.918 -4.474 -8.516 434 HA ILE 67 HA ILE 67 10.915 -2.445 -6.450 435 HB ILE 67 HB ILE 67 10.870 -5.426 -6.057 436 HG13 ILE 67 2HG1 ILE 67 8.502 -5.540 -6.283 437 HG21 ILE 67 1HG2 ILE 67 11.059 -4.248 -3.990 438 HG22 ILE 67 2HG2 ILE 67 9.786 -3.114 -4.449 439 HG23 ILE 67 3HG2 ILE 67 9.378 -4.800 -4.124 440 HD11 ILE 67 3HD1 ILE 67 7.493 -3.268 -7.439 441 HD12 ILE 67 1HD1 ILE 67 7.264 -3.771 -5.742 442 HD13 ILE 67 2HD1 ILE 67 8.510 -2.589 -6.167 443 H LYS 68 H LYS 68 12.388 -2.170 -4.738 444 HA LYS 68 HA LYS 68 15.204 -2.933 -4.992 445 HB3 LYS 68 2HB LYS 68 14.853 -2.119 -2.388 446 HG3 LYS 68 2HG LYS 68 14.968 0.273 -3.215 447 HD3 LYS 68 2HD LYS 68 17.067 -1.373 -4.672 448 HE3 LYS 68 2HE LYS 68 18.100 0.437 -2.707 449 HZ1 LYS 68 3HZ LYS 68 18.878 1.672 -4.633 450 HZ2 LYS 68 1HZ LYS 68 19.097 0.082 -4.894 451 HZ3 LYS 68 2HZ LYS 68 17.873 0.875 -5.638 452 H LYS 69 H LYS 69 16.047 -4.862 -4.438 453 HA LYS 69 HA LYS 69 14.711 -6.957 -3.025 454 HB3 LYS 69 2HB LYS 69 16.583 -7.471 -4.484 455 HG3 LYS 69 2HG LYS 69 18.142 -5.652 -2.640 456 HD3 LYS 69 2HD LYS 69 19.227 -8.212 -3.876 457 HE3 LYS 69 2HE LYS 69 20.634 -5.675 -2.933 458 HZ1 LYS 69 3HZ LYS 69 22.669 -7.008 -3.271 459 HZ2 LYS 69 1HZ LYS 69 21.794 -7.574 -2.019 460 HZ3 LYS 69 2HZ LYS 69 21.787 -8.368 -3.447 461 H GLU 70 H GLU 70 16.159 -4.154 -1.698 462 HA GLU 70 HA GLU 70 16.460 -5.144 1.039 463 HB3 GLU 70 2HB GLU 70 16.774 -2.810 1.615 464 HG3 GLU 70 2HG GLU 70 18.303 -3.131 -0.987 465 H ASN 71 H ASN 71 13.721 -4.873 -0.775 466 HA ASN 71 HA ASN 71 11.771 -4.023 1.086 467 HB3 ASN 71 2HB ASN 71 11.297 -4.487 -1.249 468 HD21 ASN 71 2HD2 ASN 71 10.413 -6.067 -2.830 469 HD22 ASN 71 1HD2 ASN 71 11.321 -7.563 -2.990 470 H THR 72 H THR 72 10.330 -5.242 2.243 471 HA THR 72 HA THR 72 10.556 -7.745 3.418 472 HB THR 72 HB THR 72 12.399 -5.787 4.659 473 HG1 THR 72 1HG THR 72 13.449 -7.567 5.204 474 HG21 THR 72 3HG2 THR 72 12.212 -6.669 6.964 475 HG22 THR 72 1HG2 THR 72 10.812 -5.701 6.535 476 HG23 THR 72 2HG2 THR 72 10.690 -7.477 6.543 477 HA PRO 73 HA PRO 73 7.352 -5.213 5.854 478 HB3 PRO 73 2HB PRO 73 8.378 -3.348 6.752 479 HG3 PRO 73 2HG PRO 73 9.784 -1.957 5.498 480 HD3 PRO 73 2HD PRO 73 10.794 -3.973 4.936 481 H LEU 74 H LEU 74 6.992 -6.446 3.570 482 HA LEU 74 HA LEU 74 5.463 -5.025 1.579 483 HB3 LEU 74 2HB LEU 74 6.730 -7.347 1.519 484 HG LEU 74 HG LEU 74 4.966 -8.536 3.034 485 HD11 LEU 74 1HD1 LEU 74 2.822 -8.044 2.355 486 HD12 LEU 74 2HD1 LEU 74 3.322 -7.652 0.701 487 HD13 LEU 74 3HD1 LEU 74 3.096 -9.332 1.166 488 HD21 LEU 74 3HD2 LEU 74 4.991 -10.530 1.588 489 HD22 LEU 74 1HD2 LEU 74 5.437 -9.526 0.203 490 HD23 LEU 74 2HD2 LEU 74 6.562 -9.730 1.554 491 H LEU 75 H LEU 75 3.289 -4.750 1.429 492 HA LEU 75 HA LEU 75 1.460 -5.771 3.534 493 HB3 LEU 75 2HB LEU 75 0.817 -3.059 2.527 494 HG LEU 75 HG LEU 75 1.521 -3.578 5.418 495 HD11 LEU 75 1HD1 LEU 75 0.861 -1.381 4.649 496 HD12 LEU 75 2HD1 LEU 75 -0.669 -2.018 4.002 497 HD13 LEU 75 3HD1 LEU 75 -0.365 -2.036 5.761 498 HD21 LEU 75 3HD2 LEU 75 -0.844 -4.288 5.921 499 HD22 LEU 75 1HD2 LEU 75 -1.058 -4.703 4.221 500 HD23 LEU 75 2HD2 LEU 75 0.153 -5.534 5.208 501 H ASN 76 H ASN 76 -0.813 -4.384 2.305 502 HA ASN 76 HA ASN 76 -2.455 -4.715 0.787 503 HB3 ASN 76 2HB ASN 76 -0.740 -6.266 -1.137 504 HD21 ASN 76 2HD2 ASN 76 -1.154 -4.280 -3.178 505 HD22 ASN 76 1HD2 ASN 76 -2.859 -4.304 -3.582 506 H CYS 77 H CYS 77 -0.499 -7.771 0.535 507 HA CYS 77 HA CYS 77 -2.221 -9.210 2.347 508 HB3 CYS 77 2HB CYS 77 -2.638 -10.355 -0.384 509 H ALA 78 H ALA 78 0.075 -9.621 3.134 510 HA ALA 78 HA ALA 78 1.993 -11.099 1.582 511 HB1 ALA 78 3HB ALA 78 3.130 -11.423 3.699 512 HB2 ALA 78 1HB ALA 78 2.434 -9.790 3.738 513 HB3 ALA 78 2HB ALA 78 1.628 -11.122 4.609 514 H LYS 79 H LYS 79 2.725 -13.202 2.002 515 HA LYS 79 HA LYS 79 2.627 -15.451 1.881 516 HB3 LYS 79 2HB LYS 79 0.746 -16.482 3.540 517 HG3 LYS 79 2HG LYS 79 2.510 -15.170 5.371 518 HD3 LYS 79 2HD LYS 79 3.860 -17.518 4.696 519 HE3 LYS 79 2HE LYS 79 1.757 -18.332 6.438 520 HZ1 LYS 79 3HZ LYS 79 3.478 -18.038 8.130 521 HZ2 LYS 79 1HZ LYS 79 4.132 -18.712 6.799 522 HZ3 LYS 79 2HZ LYS 79 4.391 -17.132 7.125 523 HA PRO 80 HA PRO 80 -0.404 -16.708 -1.103 524 HB3 PRO 80 2HB PRO 80 0.897 -18.509 -1.625 525 HG3 PRO 80 2HG PRO 80 2.090 -19.689 -0.012 526 HD3 PRO 80 2HD PRO 80 2.660 -17.575 0.799 527 H ASP 81 H ASP 81 -0.891 -17.619 2.235 528 HA ASP 81 HA ASP 81 -3.815 -17.241 2.059 529 HB3 ASP 81 2HB ASP 81 -2.493 -19.840 2.942 530 H GLN 82 H GLN 82 -3.273 -15.305 3.286 531 HA GLN 82 HA GLN 82 -3.578 -15.867 6.118 532 HB3 GLN 82 2HB GLN 82 -1.440 -13.822 5.709 533 HG3 GLN 82 2HG GLN 82 -1.570 -16.327 7.447 534 HE21 GLN 82 2HE2 GLN 82 -0.282 -16.019 9.556 535 HE22 GLN 82 1HE2 GLN 82 1.199 -15.078 9.423 536 H ASP 83 H ASP 83 -4.809 -14.293 7.113 537 HA ASP 83 HA ASP 83 -5.826 -12.052 5.520 538 HB3 ASP 83 2HB ASP 83 -7.267 -13.217 7.178 539 H ILE 84 H ILE 84 -5.276 -9.914 5.774 540 HA ILE 84 HA ILE 84 -3.291 -9.204 7.843 541 HB ILE 84 HB ILE 84 -2.341 -9.477 5.325 542 HG13 ILE 84 2HG1 ILE 84 -1.517 -7.381 7.374 543 HG21 ILE 84 1HG2 ILE 84 -3.835 -7.739 4.348 544 HG22 ILE 84 2HG2 ILE 84 -3.065 -6.513 5.375 545 HG23 ILE 84 3HG2 ILE 84 -2.120 -7.379 4.157 546 HD11 ILE 84 3HD1 ILE 84 0.338 -8.972 7.808 547 HD12 ILE 84 1HD1 ILE 84 -1.215 -9.736 8.159 548 HD13 ILE 84 2HD1 ILE 84 -0.356 -10.121 6.652 549 H LYS 85 H LYS 85 -3.671 -7.381 8.863 550 HA LYS 85 HA LYS 85 -5.678 -5.445 7.914 551 HB3 LYS 85 2HB LYS 85 -7.000 -7.078 9.105 552 HG3 LYS 85 2HG LYS 85 -5.518 -6.359 11.667 553 HD3 LYS 85 2HD LYS 85 -7.632 -8.443 10.972 554 HE3 LYS 85 2HE LYS 85 -5.835 -9.074 12.691 555 HZ1 LYS 85 3HZ LYS 85 -6.226 -8.190 14.901 556 HZ2 LYS 85 1HZ LYS 85 -5.851 -6.935 13.932 557 HZ3 LYS 85 2HZ LYS 85 -7.402 -7.192 14.385 558 H PHE 86 H PHE 86 -5.021 -3.490 8.248 559 HA PHE 86 HA PHE 86 -3.305 -2.768 10.545 560 HB3 PHE 86 2HB PHE 86 -2.378 -1.445 8.100 561 HD1 PHE 86 1HD PHE 86 -1.403 -0.300 10.173 562 HD2 PHE 86 2HD PHE 86 -0.433 -4.330 8.944 563 HE1 PHE 86 1HE PHE 86 0.674 -0.231 11.542 564 HE2 PHE 86 2HE PHE 86 1.642 -4.246 10.312 565 HZ PHE 86 HZ PHE 86 2.173 -2.209 11.650 566 H THR 87 H THR 87 -3.893 -0.822 11.351 567 HA THR 87 HA THR 87 -5.623 0.992 9.728 568 HB THR 87 HB THR 87 -7.117 -0.074 11.199 569 HG1 THR 87 1HG THR 87 -8.018 1.700 11.868 570 HG21 THR 87 3HG2 THR 87 -7.021 -0.027 13.643 571 HG22 THR 87 1HG2 THR 87 -5.706 -0.954 12.938 572 HG23 THR 87 2HG2 THR 87 -5.386 0.657 13.606 573 H ILE 88 H ILE 88 -4.961 2.940 9.567 574 HA ILE 88 HA ILE 88 -2.806 3.972 11.369 575 HB ILE 88 HB ILE 88 -3.237 4.216 8.390 576 HG13 ILE 88 2HG1 ILE 88 -1.619 2.617 9.398 577 HG21 ILE 88 1HG2 ILE 88 -3.300 6.577 9.074 578 HG22 ILE 88 2HG2 ILE 88 -1.831 6.359 10.056 579 HG23 ILE 88 3HG2 ILE 88 -1.789 6.221 8.287 580 HD11 ILE 88 3HD1 ILE 88 0.432 3.181 8.283 581 HD12 ILE 88 1HD1 ILE 88 -0.899 3.717 7.235 582 HD13 ILE 88 2HD1 ILE 88 0.017 4.891 8.215 583 H LYS 89 H LYS 89 -3.204 5.573 12.527 584 HA LYS 89 HA LYS 89 -5.574 7.331 12.125 585 HB3 LYS 89 2HB LYS 89 -4.232 6.429 14.716 586 HG3 LYS 89 2HG LYS 89 -6.659 8.233 14.325 587 HD3 LYS 89 2HD LYS 89 -5.163 7.595 16.903 588 HE3 LYS 89 2HE LYS 89 -8.054 8.468 16.497 589 HZ1 LYS 89 3HZ LYS 89 -7.856 9.217 18.728 590 HZ2 LYS 89 1HZ LYS 89 -7.217 7.710 18.761 591 HZ3 LYS 89 2HZ LYS 89 -6.258 9.049 18.775 592 H PHE 90 H PHE 90 -4.732 9.068 11.068 593 HA PHE 90 HA PHE 90 -2.147 10.300 11.785 594 HB3 PHE 90 2HB PHE 90 -2.970 12.145 10.314 595 HD1 PHE 90 1HD PHE 90 -0.713 11.660 9.638 596 HD2 PHE 90 2HD PHE 90 -4.054 9.243 8.340 597 HE1 PHE 90 1HE PHE 90 0.626 10.823 7.725 598 HE2 PHE 90 2HE PHE 90 -2.658 8.377 6.458 599 HZ PHE 90 HZ PHE 90 -0.327 9.140 6.170 600 H GLN 91 H GLN 91 -2.656 10.384 14.110 601 HA GLN 91 HA GLN 91 -4.500 12.604 14.895 602 HB3 GLN 91 2HB GLN 91 -3.094 10.435 16.490 603 HG3 GLN 91 2HG GLN 91 -4.855 12.729 17.489 604 HE21 GLN 91 2HE2 GLN 91 -2.621 10.404 19.162 605 HE22 GLN 91 1HE2 GLN 91 -3.879 9.823 20.240 606 H GLU 92 H GLU 92 -1.083 11.645 15.586 607 HA GLU 92 HA GLU 92 0.143 14.123 15.046 608 HB3 GLU 92 2HB GLU 92 0.565 14.356 17.823 609 HG3 GLU 92 2HG GLU 92 -1.484 16.177 17.361 610 H PHE 93 H PHE 93 0.335 11.817 17.771 611 HA PHE 93 HA PHE 93 3.051 10.889 16.941 612 HB3 PHE 93 2HB PHE 93 3.262 10.711 19.595 613 HD1 PHE 93 2HD PHE 93 2.833 14.180 18.200 614 HD2 PHE 93 1HD PHE 93 5.568 11.005 19.252 615 HE1 PHE 93 2HE PHE 93 4.758 15.702 17.814 616 HE2 PHE 93 1HE PHE 93 7.485 12.532 18.866 617 HZ PHE 93 HZ PHE 93 7.090 14.880 18.129 618 H SER 94 H SER 94 3.557 8.781 17.578 619 HA SER 94 HA SER 94 1.195 7.033 18.131 620 HB3 SER 94 2HB SER 94 1.996 5.507 16.442 621 HG SER 94 HG SER 94 1.724 7.031 14.624 622 HA PRO 95 HA PRO 95 3.957 5.420 21.207 623 HB3 PRO 95 2HB PRO 95 2.069 4.895 22.389 624 HG3 PRO 95 2HG PRO 95 0.118 4.064 21.336 625 HD3 PRO 95 2HD PRO 95 0.548 5.952 20.014 626 H ASN 96 H ASN 96 3.138 3.532 18.392 627 HA ASN 96 HA ASN 96 5.524 1.739 18.680 628 HB3 ASN 96 2HB ASN 96 4.265 0.801 16.486 629 HD21 ASN 96 2HD2 ASN 96 1.894 0.189 18.879 630 HD22 ASN 96 1HD2 ASN 96 2.691 -1.227 19.548 631 H LEU 97 H LEU 97 7.278 2.573 17.832 632 HA LEU 97 HA LEU 97 7.235 4.517 15.655 633 HB3 LEU 97 2HB LEU 97 9.873 3.478 16.571 634 HG LEU 97 HG LEU 97 10.383 5.804 16.907 635 HD11 LEU 97 1HD1 LEU 97 10.380 5.130 14.533 636 HD12 LEU 97 2HD1 LEU 97 8.708 5.708 14.361 637 HD13 LEU 97 3HD1 LEU 97 10.008 6.845 14.754 638 HD21 LEU 97 3HD2 LEU 97 8.789 7.626 16.757 639 HD22 LEU 97 1HD2 LEU 97 7.451 6.512 16.447 640 HD23 LEU 97 2HD2 LEU 97 8.285 6.486 18.011 641 H TRP 98 H TRP 98 6.157 1.997 14.978 642 HA TRP 98 HA TRP 98 8.046 0.519 13.312 643 HB3 TRP 98 2HB TRP 98 5.113 0.085 12.973 644 HD1 TRP 98 HD TRP 98 8.021 -1.716 14.761 645 HE1 TRP 98 1HE TRP 98 8.312 -4.078 13.799 646 HE3 TRP 98 3HE TRP 98 4.439 -1.528 11.115 647 HZ2 TRP 98 2HZ TRP 98 7.076 -5.714 11.725 648 HZ3 TRP 98 3HZ TRP 98 3.992 -3.502 9.673 649 HH2 TRP 98 HH TRP 98 5.291 -5.596 9.979 650 H GLY 99 H GLY 99 6.349 3.370 12.846 651 HA2 GLY 99 2HA GLY 99 6.954 4.541 10.692 652 H LEU 100 H LEU 100 4.570 4.259 12.756 653 HA LEU 100 HA LEU 100 2.177 4.889 11.196 654 HB3 LEU 100 2HB LEU 100 1.213 5.280 13.462 655 HG LEU 100 HG LEU 100 2.805 2.672 13.476 656 HD11 LEU 100 1HD1 LEU 100 1.764 3.312 15.626 657 HD12 LEU 100 2HD1 LEU 100 0.208 3.568 14.807 658 HD13 LEU 100 3HD1 LEU 100 0.907 1.939 14.907 659 HD21 LEU 100 3HD2 LEU 100 0.673 1.712 12.547 660 HD22 LEU 100 1HD2 LEU 100 0.082 3.358 12.286 661 HD23 LEU 100 2HD2 LEU 100 1.510 2.764 11.399 662 H GLU 101 H GLU 101 4.567 6.840 13.010 663 HA GLU 101 HA GLU 101 3.139 9.374 12.577 664 HB3 GLU 101 2HB GLU 101 5.399 10.365 13.118 665 HG3 GLU 101 2HG GLU 101 4.316 8.443 15.205 666 H PHE 102 H PHE 102 3.603 10.930 11.078 667 HA PHE 102 HA PHE 102 5.052 10.075 8.616 668 HB3 PHE 102 2HB PHE 102 2.518 10.866 8.742 669 HD1 PHE 102 1HD PHE 102 2.687 12.912 10.631 670 HD2 PHE 102 2HD PHE 102 3.560 13.265 6.409 671 HE1 PHE 102 1HE PHE 102 2.286 15.361 10.741 672 HE2 PHE 102 2HE PHE 102 3.136 15.705 6.534 673 HZ PHE 102 HZ PHE 102 2.447 16.752 8.683 674 H GLN 103 H GLN 103 6.112 11.949 7.436 675 HA GLN 103 HA GLN 103 7.536 13.867 9.239 676 HB3 GLN 103 2HB GLN 103 9.599 13.366 7.871 677 HG3 GLN 103 2HG GLN 103 8.394 11.098 9.516 678 HE21 GLN 103 2HE2 GLN 103 9.813 9.364 10.219 679 HE22 GLN 103 1HE2 GLN 103 11.299 9.064 9.329 680 H LYS 104 H LYS 104 7.649 15.869 8.449 681 HA LYS 104 HA LYS 104 6.365 16.525 5.864 682 HB3 LYS 104 2HB LYS 104 6.483 18.814 6.553 683 HG3 LYS 104 2HG LYS 104 5.885 17.387 9.154 684 HD3 LYS 104 2HD LYS 104 4.259 19.514 7.724 685 HE3 LYS 104 2HE LYS 104 4.290 18.218 10.360 686 HZ1 LYS 104 3HZ LYS 104 3.843 20.246 11.602 687 HZ2 LYS 104 1HZ LYS 104 5.355 20.314 10.999 688 HZ3 LYS 104 2HZ LYS 104 4.161 21.187 10.306 689 H ASN 105 H ASN 105 7.365 18.185 4.528 690 HA ASN 105 HA ASN 105 8.788 18.593 2.864 691 HB3 ASN 105 2HB ASN 105 11.154 18.492 4.741 692 HD21 ASN 105 2HD2 ASN 105 11.942 18.413 2.279 693 HD22 ASN 105 1HD2 ASN 105 12.184 20.017 1.568 694 H LYS 106 H LYS 106 8.119 15.842 3.341 695 HA LYS 106 HA LYS 106 10.339 14.395 2.003 696 HB3 LYS 106 2HB LYS 106 9.112 12.582 3.856 697 HG3 LYS 106 2HG LYS 106 11.845 13.754 4.365 698 HD3 LYS 106 2HD LYS 106 10.518 11.039 4.444 699 HE3 LYS 106 2HE LYS 106 13.506 11.019 4.426 700 HZ1 LYS 106 3HZ LYS 106 13.031 8.924 3.265 701 HZ2 LYS 106 1HZ LYS 106 12.141 8.983 4.634 702 HZ3 LYS 106 2HZ LYS 106 11.440 9.266 3.182 703 H ASP 107 H ASP 107 9.603 13.738 0.206 704 HA ASP 107 HA ASP 107 6.863 12.935 -0.391 705 HB3 ASP 107 2HB ASP 107 8.219 13.798 -2.179 706 H TYR 108 H TYR 108 6.119 10.880 -0.688 707 HA TYR 108 HA TYR 108 7.779 8.530 0.034 708 HB3 TYR 108 2HB TYR 108 5.524 7.555 0.941 709 HD1 TYR 108 1HD TYR 108 6.761 10.648 2.679 710 HD2 TYR 108 2HD TYR 108 6.633 6.332 2.556 711 HE1 TYR 108 1HE TYR 108 7.858 10.546 4.914 712 HE2 TYR 108 2HE TYR 108 7.713 6.232 4.788 713 HH TYR 108 HH TYR 108 8.615 7.449 6.536 714 H TYR 109 H TYR 109 7.417 6.821 -1.226 715 HA TYR 109 HA TYR 109 5.263 6.833 -3.258 716 HB3 TYR 109 2HB TYR 109 6.908 6.083 -4.964 717 HD1 TYR 109 2HD TYR 109 5.350 8.047 -5.611 718 HD2 TYR 109 1HD TYR 109 9.235 8.543 -3.802 719 HE1 TYR 109 2HE TYR 109 5.470 10.368 -6.510 720 HE2 TYR 109 1HE TYR 109 9.366 10.849 -4.731 721 HH TYR 109 HH TYR 109 6.729 12.340 -6.623 722 H ILE 110 H ILE 110 4.602 4.781 -3.833 723 HA ILE 110 HA ILE 110 5.841 2.387 -2.588 724 HB ILE 110 HB ILE 110 2.924 3.190 -2.359 725 HG13 ILE 110 2HG1 ILE 110 4.101 4.523 -0.734 726 HG21 ILE 110 1HG2 ILE 110 3.141 0.726 -2.504 727 HG22 ILE 110 2HG2 ILE 110 4.120 0.785 -1.006 728 HG23 ILE 110 3HG2 ILE 110 2.422 1.343 -1.042 729 HD11 ILE 110 3HD1 ILE 110 3.520 3.834 1.472 730 HD12 ILE 110 1HD1 ILE 110 2.159 3.332 0.440 731 HD13 ILE 110 2HD1 ILE 110 3.366 2.138 0.990 732 H ILE 111 H ILE 111 5.196 0.435 -3.729 733 HA ILE 111 HA ILE 111 3.424 0.717 -6.057 734 HB ILE 111 HB ILE 111 5.689 1.610 -6.733 735 HG13 ILE 111 2HG1 ILE 111 4.054 0.722 -8.375 736 HG21 ILE 111 1HG2 ILE 111 6.924 -0.167 -5.311 737 HG22 ILE 111 2HG2 ILE 111 6.563 -1.283 -6.630 738 HG23 ILE 111 3HG2 ILE 111 7.570 0.148 -6.910 739 HD11 ILE 111 3HD1 ILE 111 5.515 1.094 -10.078 740 HD12 ILE 111 1HD1 ILE 111 6.632 1.501 -8.786 741 HD13 ILE 111 2HD1 ILE 111 6.644 -0.139 -9.481 742 H SER 112 H SER 112 3.113 -1.397 -7.149 743 HA SER 112 HA SER 112 3.726 -3.790 -5.474 744 HB3 SER 112 2HB SER 112 1.465 -4.524 -5.499 745 HG SER 112 HG SER 112 0.238 -2.563 -4.850 746 H THR 113 H THR 113 3.505 -5.775 -6.534 747 HA THR 113 HA THR 113 3.631 -5.774 -9.510 748 HB THR 113 HB THR 113 5.359 -7.531 -9.332 749 HG1 THR 113 1HG THR 113 6.458 -7.768 -7.416 750 HG21 THR 113 3HG2 THR 113 7.185 -6.036 -8.912 751 HG22 THR 113 1HG2 THR 113 5.878 -5.023 -9.555 752 HG23 THR 113 2HG2 THR 113 6.194 -5.035 -7.826 753 H SER 114 H SER 114 1.220 -6.163 -9.146 754 HA SER 114 HA SER 114 0.248 -8.627 -8.263 755 HB3 SER 114 2HB SER 114 -1.647 -8.215 -9.725 756 HG SER 114 HG SER 114 -2.060 -6.100 -9.062 757 H ASN 115 H ASN 115 2.227 -8.106 -11.050 758 HA ASN 115 HA ASN 115 1.729 -10.640 -12.403 759 HB3 ASN 115 2HB ASN 115 4.266 -9.705 -13.198 760 HD21 ASN 115 2HD2 ASN 115 3.362 -7.509 -15.014 761 HD22 ASN 115 1HD2 ASN 115 2.306 -8.326 -16.151 762 H GLY 116 H GLY 116 3.153 -9.962 -9.485 763 HA2 GLY 116 2HA GLY 116 5.172 -12.031 -9.251 764 H SER 117 H SER 117 2.735 -13.012 -10.517 765 HA SER 117 HA SER 117 1.140 -14.779 -8.878 766 HB3 SER 117 2HB SER 117 0.554 -15.774 -10.977 767 HG SER 117 HG SER 117 0.356 -13.948 -12.426 768 H LEU 118 H LEU 118 1.505 -17.235 -8.997 769 HA LEU 118 HA LEU 118 3.943 -18.048 -7.909 770 HB3 LEU 118 2HB LEU 118 3.168 -20.383 -8.602 771 HG LEU 118 HG LEU 118 1.216 -20.575 -7.250 772 HD11 LEU 118 1HD1 LEU 118 3.380 -20.367 -6.096 773 HD12 LEU 118 2HD1 LEU 118 3.133 -18.612 -5.935 774 HD13 LEU 118 3HD1 LEU 118 2.041 -19.742 -5.119 775 HD21 LEU 118 3HD2 LEU 118 0.018 -18.765 -6.222 776 HD22 LEU 118 1HD2 LEU 118 1.090 -17.561 -6.942 777 HD23 LEU 118 2HD2 LEU 118 -0.003 -18.515 -7.973 778 H GLU 119 H GLU 119 3.242 -17.759 -11.318 779 HA GLU 119 HA GLU 119 5.341 -19.227 -12.552 780 HB3 GLU 119 2HB GLU 119 5.067 -17.561 -14.395 781 HG3 GLU 119 2HG GLU 119 2.644 -17.742 -14.828 782 H GLY 120 H GLY 120 5.464 -16.184 -10.806 783 HA2 GLY 120 2HA GLY 120 8.368 -15.920 -10.941 784 H LEU 121 H LEU 121 6.633 -16.126 -8.740 785 HA LEU 121 HA LEU 121 5.854 -13.597 -7.728 786 HB3 LEU 121 2HB LEU 121 5.397 -16.196 -7.043 787 HG LEU 121 HG LEU 121 7.532 -15.944 -5.376 788 HD11 LEU 121 1HD1 LEU 121 6.565 -13.813 -4.352 789 HD12 LEU 121 2HD1 LEU 121 5.198 -14.774 -3.780 790 HD13 LEU 121 3HD1 LEU 121 6.839 -15.112 -3.189 791 HD21 LEU 121 3HD2 LEU 121 6.385 -17.479 -3.834 792 HD22 LEU 121 1HD2 LEU 121 4.821 -17.064 -4.568 793 HD23 LEU 121 2HD2 LEU 121 6.061 -17.904 -5.520 794 H ASP 122 H ASP 122 8.881 -15.289 -7.493 795 HA ASP 122 HA ASP 122 10.272 -13.359 -5.783 796 HB3 ASP 122 2HB ASP 122 12.245 -14.696 -6.391 797 H ASN 123 H ASN 123 9.208 -13.284 -9.044 798 HA ASN 123 HA ASN 123 11.456 -11.720 -10.078 799 HB3 ASN 123 2HB ASN 123 8.836 -12.201 -11.531 800 HD21 ASN 123 2HD2 ASN 123 9.776 -13.177 -13.837 801 HD22 ASN 123 1HD2 ASN 123 10.985 -12.099 -14.523 802 H GLN 124 H GLN 124 11.263 -10.155 -8.406 803 HA GLN 124 HA GLN 124 9.069 -8.342 -8.146 804 HB3 GLN 124 2HB GLN 124 10.949 -9.002 -6.522 805 HG3 GLN 124 2HG GLN 124 12.407 -6.549 -7.523 806 HE21 GLN 124 2HE2 GLN 124 14.548 -9.045 -7.371 807 HE22 GLN 124 1HE2 GLN 124 14.963 -8.962 -5.667 808 H GLU 125 H GLU 125 9.999 -8.656 -10.972 809 HA GLU 125 HA GLU 125 10.784 -5.908 -11.780 810 HB3 GLU 125 2HB GLU 125 12.467 -6.807 -13.300 811 HG3 GLU 125 2HG GLU 125 13.003 -8.066 -10.580 812 H GLY 126 H GLY 126 9.994 -5.308 -13.827 813 HA2 GLY 126 2HA GLY 126 8.488 -5.287 -15.574 814 H GLY 127 H GLY 127 7.555 -5.323 -12.795 815 HA2 GLY 127 2HA GLY 127 5.200 -6.847 -12.320 816 H VAL 128 H VAL 128 3.027 -5.601 -11.933 817 HA VAL 128 HA VAL 128 1.990 -4.893 -14.557 818 HB VAL 128 HB VAL 128 -0.136 -4.568 -13.583 819 HG11 VAL 128 1HG1 VAL 128 0.661 -6.835 -14.068 820 HG12 VAL 128 2HG1 VAL 128 1.100 -6.997 -12.354 821 HG13 VAL 128 3HG1 VAL 128 -0.602 -6.780 -12.838 822 HG21 VAL 128 3HG2 VAL 128 -0.599 -4.820 -11.153 823 HG22 VAL 128 1HG2 VAL 128 1.146 -4.933 -10.842 824 HG23 VAL 128 2HG2 VAL 128 0.438 -3.430 -11.442 825 H CYS 129 H CYS 129 3.499 -2.929 -12.165 826 HA CYS 129 HA CYS 129 2.153 -0.527 -12.508 827 HB3 CYS 129 2HB CYS 129 4.133 -1.137 -10.966 828 H GLN 130 H GLN 130 4.076 -2.168 -14.829 829 HA GLN 130 HA GLN 130 4.756 -0.150 -16.671 830 HB3 GLN 130 2HB GLN 130 4.065 -3.032 -17.385 831 HG3 GLN 130 2HG GLN 130 5.953 -0.908 -18.385 832 HE21 GLN 130 2HE2 GLN 130 8.107 -1.192 -17.674 833 HE22 GLN 130 1HE2 GLN 130 8.940 -2.738 -17.796 834 H THR 131 H THR 131 1.638 -1.705 -16.115 835 HA THR 131 HA THR 131 0.371 -0.041 -18.250 836 HB THR 131 HB THR 131 0.009 -3.039 -17.966 837 HG1 THR 131 1HG THR 131 0.550 -2.914 -20.215 838 HG21 THR 131 3HG2 THR 131 -1.659 -2.814 -19.844 839 HG22 THR 131 1HG2 THR 131 -2.213 -2.190 -18.301 840 HG23 THR 131 2HG2 THR 131 -1.676 -1.057 -19.556 841 H ARG 132 H ARG 132 -0.473 -2.337 -15.536 842 HA ARG 132 HA ARG 132 -3.059 -1.137 -14.927 843 HB3 ARG 132 2HB ARG 132 -2.523 -2.074 -12.583 844 HG3 ARG 132 2HG ARG 132 -2.282 -4.548 -13.400 845 HD3 ARG 132 2HD ARG 132 -4.418 -3.119 -12.717 846 HE ARG 132 HE ARG 132 -4.753 -3.488 -15.608 847 HH11 ARG 132 1HH2 ARG 132 -6.549 -3.416 -12.585 848 HH12 ARG 132 2HH2 ARG 132 -8.056 -3.096 -13.395 849 HH21 ARG 132 1HH1 ARG 132 -6.738 -3.144 -16.556 850 HH22 ARG 132 2HH1 ARG 132 -8.156 -2.970 -15.565 851 H ALA 133 H ALA 133 0.268 -0.310 -14.106 852 HA ALA 133 HA ALA 133 1.196 1.355 -12.831 853 HB1 ALA 133 3HB ALA 133 0.279 3.597 -13.131 854 HB2 ALA 133 1HB ALA 133 0.388 2.703 -14.664 855 HB3 ALA 133 2HB ALA 133 -1.181 2.926 -13.863 856 H MET 134 H MET 134 0.738 -0.142 -11.032 857 HA MET 134 HA MET 134 -1.136 0.995 -9.016 858 HB3 MET 134 2HB MET 134 0.223 -1.725 -9.056 859 HG3 MET 134 2HG MET 134 -1.266 -0.183 -7.046 860 HE1 MET 134 3HE MET 134 -3.050 -4.395 -7.633 861 HE2 MET 134 1HE MET 134 -1.875 -3.667 -8.749 862 HE3 MET 134 2HE MET 134 -1.388 -4.087 -7.093 863 H LYS 135 H LYS 135 0.351 2.848 -8.850 864 HA LYS 135 HA LYS 135 2.198 2.275 -6.607 865 HB3 LYS 135 2HB LYS 135 3.705 2.830 -8.401 866 HG3 LYS 135 2HG LYS 135 3.766 5.345 -9.042 867 HD3 LYS 135 2HD LYS 135 1.916 3.630 -10.736 868 HE3 LYS 135 2HE LYS 135 4.159 5.606 -11.373 869 HZ1 LYS 135 3HZ LYS 135 3.229 5.601 -13.569 870 HZ2 LYS 135 1HZ LYS 135 3.483 4.040 -13.178 871 HZ3 LYS 135 2HZ LYS 135 1.968 4.664 -13.149 872 H ILE 136 H ILE 136 2.582 4.172 -5.235 873 HA ILE 136 HA ILE 136 0.251 5.966 -5.191 874 HB ILE 136 HB ILE 136 -0.280 5.833 -3.009 875 HG13 ILE 136 2HG1 ILE 136 2.599 5.319 -2.428 876 HG21 ILE 136 1HG2 ILE 136 -0.762 3.639 -3.982 877 HG22 ILE 136 2HG2 ILE 136 0.775 3.001 -3.370 878 HG23 ILE 136 3HG2 ILE 136 -0.473 3.551 -2.250 879 HD11 ILE 136 3HD1 ILE 136 2.183 6.678 -0.459 880 HD12 ILE 136 1HD1 ILE 136 1.662 7.536 -1.893 881 HD13 ILE 136 2HD1 ILE 136 0.462 6.787 -0.824 882 H LEU 137 H LEU 137 0.508 7.993 -4.460 883 HA LEU 137 HA LEU 137 3.293 9.068 -4.277 884 HB3 LEU 137 2HB LEU 137 1.134 9.614 -6.253 885 HG LEU 137 HG LEU 137 1.098 11.776 -4.993 886 HD11 LEU 137 1HD1 LEU 137 3.550 11.859 -4.307 887 HD12 LEU 137 2HD1 LEU 137 3.950 12.132 -6.011 888 HD13 LEU 137 3HD1 LEU 137 2.955 13.307 -5.127 889 HD21 LEU 137 3HD2 LEU 137 1.352 13.132 -7.000 890 HD22 LEU 137 1HD2 LEU 137 2.304 11.849 -7.774 891 HD23 LEU 137 2HD2 LEU 137 0.596 11.584 -7.395 892 H MET 138 H MET 138 3.580 10.119 -2.509 893 HA MET 138 HA MET 138 1.321 11.371 -1.005 894 HB3 MET 138 2HB MET 138 3.915 10.747 0.329 895 HG3 MET 138 2HG MET 138 1.000 10.315 1.009 896 HE1 MET 138 3HE MET 138 1.112 8.655 4.462 897 HE2 MET 138 1HE MET 138 1.000 10.400 4.127 898 HE3 MET 138 2HE MET 138 0.113 9.233 3.113 899 H LYS 139 H LYS 139 1.381 13.488 -0.881 900 HA LYS 139 HA LYS 139 3.359 15.122 -2.137 901 HB3 LYS 139 2HB LYS 139 1.515 16.153 0.041 902 HG3 LYS 139 2HG LYS 139 2.357 17.098 -2.738 903 HD3 LYS 139 2HD LYS 139 -0.087 17.490 -2.213 904 HE3 LYS 139 2HE LYS 139 0.948 19.675 -0.387 905 HZ1 LYS 139 3HZ LYS 139 -1.349 19.705 0.328 906 HZ2 LYS 139 1HZ LYS 139 -1.331 19.821 -1.298 907 HZ3 LYS 139 2HZ LYS 139 -1.737 18.410 -0.582 908 H VAL 140 H VAL 140 4.873 16.596 -1.165 909 HA VAL 140 HA VAL 140 6.605 15.540 0.783 910 HB VAL 140 HB VAL 140 7.639 17.802 0.862 911 HG11 VAL 140 1HG1 VAL 140 8.305 16.155 -0.807 912 HG12 VAL 140 2HG1 VAL 140 7.052 16.738 -1.927 913 HG13 VAL 140 3HG1 VAL 140 8.395 17.800 -1.451 914 HG21 VAL 140 3HG2 VAL 140 6.906 19.562 -0.652 915 HG22 VAL 140 1HG2 VAL 140 5.472 18.642 -1.125 916 HG23 VAL 140 2HG2 VAL 140 5.646 19.246 0.539 917 H GLY 141 H GLY 141 3.822 17.523 1.316 918 HA2 GLY 141 2HA GLY 141 3.024 17.012 3.813 919 H GLN 142 H GLN 142 4.423 20.171 2.962 920 HA GLN 142 HA GLN 142 3.537 22.301 2.975 921 HB3 GLN 142 2HB GLN 142 1.531 22.382 1.194 922 HG3 GLN 142 2HG GLN 142 4.368 21.526 0.470 923 HE21 GLN 142 2HE2 GLN 142 3.380 24.299 -1.171 924 HE22 GLN 142 1HE2 GLN 142 2.803 23.518 -2.638 Start of MODEL 4 1 H1 SER 1 H SER 1 -7.352 11.663 16.071 2 HA SER 1 HA SER 1 -9.163 13.757 16.702 3 HB3 SER 1 2HB SER 1 -7.273 15.223 15.014 4 HG SER 1 HG SER 1 -7.691 16.742 16.679 5 H LYS 2 H LYS 2 -10.590 12.640 15.443 6 HA LYS 2 HA LYS 2 -10.152 11.815 12.716 7 HB3 LYS 2 2HB LYS 2 -12.394 11.954 14.654 8 HG3 LYS 2 2HG LYS 2 -14.042 11.285 12.825 9 HD3 LYS 2 2HD LYS 2 -13.379 14.240 13.163 10 HE3 LYS 2 2HE LYS 2 -14.960 13.649 11.231 11 HZ1 LYS 2 3HZ LYS 2 -17.245 13.276 11.983 12 HZ2 LYS 2 1HZ LYS 2 -16.334 12.002 12.440 13 HZ3 LYS 2 2HZ LYS 2 -16.778 13.134 13.536 14 H SER 3 H SER 3 -10.820 12.750 10.800 15 HA SER 3 HA SER 3 -11.593 15.620 10.746 16 HB3 SER 3 2HB SER 3 -9.152 14.634 9.221 17 HG SER 3 HG SER 3 -8.793 16.918 9.091 18 H ILE 4 H ILE 4 -10.844 12.698 8.831 19 HA ILE 4 HA ILE 4 -13.246 13.217 7.167 20 HB ILE 4 HB ILE 4 -11.612 12.136 5.286 21 HG13 ILE 4 2HG1 ILE 4 -9.506 12.893 5.121 22 HG21 ILE 4 1HG2 ILE 4 -13.215 13.831 4.846 23 HG22 ILE 4 2HG2 ILE 4 -12.247 15.064 5.679 24 HG23 ILE 4 3HG2 ILE 4 -11.656 14.321 4.173 25 HD11 ILE 4 3HD1 ILE 4 -8.486 14.712 6.596 26 HD12 ILE 4 1HD1 ILE 4 -9.587 15.254 5.318 27 HD13 ILE 4 2HD1 ILE 4 -10.141 15.193 6.996 28 H VAL 5 H VAL 5 -10.731 10.811 8.022 29 HA VAL 5 HA VAL 5 -10.760 8.559 8.243 30 HB VAL 5 HB VAL 5 -13.618 9.141 9.057 31 HG11 VAL 5 1HG1 VAL 5 -13.820 6.854 8.507 32 HG12 VAL 5 2HG1 VAL 5 -12.169 6.479 9.015 33 HG13 VAL 5 3HG1 VAL 5 -13.430 6.846 10.221 34 HG21 VAL 5 3HG2 VAL 5 -12.714 8.789 11.297 35 HG22 VAL 5 1HG2 VAL 5 -11.123 8.392 10.628 36 HG23 VAL 5 2HG2 VAL 5 -11.773 10.038 10.473 37 H LEU 6 H LEU 6 -10.152 7.793 6.310 38 HA LEU 6 HA LEU 6 -12.311 6.801 4.505 39 HB3 LEU 6 2HB LEU 6 -10.317 7.037 2.746 40 HG LEU 6 HG LEU 6 -11.065 9.024 1.829 41 HD11 LEU 6 1HD1 LEU 6 -12.756 7.170 1.843 42 HD12 LEU 6 2HD1 LEU 6 -13.547 7.966 3.225 43 HD13 LEU 6 3HD1 LEU 6 -13.444 8.793 1.668 44 HD21 LEU 6 3HD2 LEU 6 -12.431 10.706 2.920 45 HD22 LEU 6 1HD2 LEU 6 -12.392 9.802 4.441 46 HD23 LEU 6 2HD2 LEU 6 -10.893 10.494 3.773 47 H GLU 7 H GLU 7 -11.696 5.052 3.145 48 HA GLU 7 HA GLU 7 -9.976 3.035 4.537 49 HB3 GLU 7 2HB GLU 7 -11.685 1.402 4.171 50 HG3 GLU 7 2HG GLU 7 -12.019 3.433 6.080 51 HA PRO 8 HA PRO 8 -8.883 3.315 0.069 52 HB3 PRO 8 2HB PRO 8 -6.820 4.221 0.434 53 HG3 PRO 8 2HG PRO 8 -5.756 3.996 2.502 54 HD3 PRO 8 2HD PRO 8 -7.951 4.647 3.104 55 H ILE 9 H ILE 9 -7.784 0.688 2.344 56 HA ILE 9 HA ILE 9 -8.703 -1.270 0.258 57 HB ILE 9 HB ILE 9 -6.621 -2.258 2.050 58 HG13 ILE 9 2HG1 ILE 9 -4.696 -1.328 1.099 59 HG21 ILE 9 1HG2 ILE 9 -7.491 -3.586 0.234 60 HG22 ILE 9 2HG2 ILE 9 -6.946 -2.376 -0.950 61 HG23 ILE 9 3HG2 ILE 9 -5.763 -3.277 0.019 62 HD11 ILE 9 3HD1 ILE 9 -4.645 0.704 -0.316 63 HD12 ILE 9 1HD1 ILE 9 -5.066 -0.795 -1.151 64 HD13 ILE 9 2HD1 ILE 9 -6.333 0.384 -0.760 65 H TYR 10 H TYR 10 -10.572 -2.030 0.982 66 HA TYR 10 HA TYR 10 -10.845 -2.766 3.877 67 HB3 TYR 10 2HB TYR 10 -12.971 -1.571 2.068 68 HD1 TYR 10 1HD TYR 10 -11.902 -1.335 5.667 69 HD2 TYR 10 2HD TYR 10 -15.072 -2.332 2.914 70 HE1 TYR 10 1HE TYR 10 -13.415 -1.836 7.588 71 HE2 TYR 10 2HE TYR 10 -16.589 -2.805 4.830 72 HH TYR 10 HH TYR 10 -16.807 -2.912 7.096 73 H TRP 11 H TRP 11 -9.896 -4.595 2.127 74 HA TRP 11 HA TRP 11 -10.146 -6.391 0.830 75 HB3 TRP 11 2HB TRP 11 -10.348 -7.244 3.138 76 HD1 TRP 11 HD TRP 11 -12.323 -5.928 4.648 77 HE1 TRP 11 1HE TRP 11 -14.662 -6.720 5.337 78 HE3 TRP 11 3HE TRP 11 -12.827 -9.852 1.399 79 HZ2 TRP 11 2HZ TRP 11 -16.545 -8.755 4.533 80 HZ3 TRP 11 3HZ TRP 11 -14.894 -11.233 1.403 81 HH2 TRP 11 HH TRP 11 -16.770 -10.670 2.938 82 H ASN 12 H ASN 12 -12.022 -4.229 0.056 83 HA ASN 12 HA ASN 12 -14.487 -5.562 -0.711 84 HB3 ASN 12 2HB ASN 12 -13.817 -2.642 -1.212 85 HD21 ASN 12 2HD2 ASN 12 -16.059 -4.334 1.001 86 HD22 ASN 12 1HD2 ASN 12 -17.520 -3.792 0.191 87 H SER 13 H SER 13 -12.279 -6.475 -2.166 88 HA SER 13 HA SER 13 -11.476 -7.037 -4.188 89 HB3 SER 13 2HB SER 13 -13.080 -5.917 -6.191 90 HG SER 13 HG SER 13 -13.904 -8.063 -6.234 91 H SER 14 H SER 14 -12.707 -3.709 -4.433 92 HA SER 14 HA SER 14 -10.039 -2.749 -5.374 93 HB3 SER 14 2HB SER 14 -11.178 -1.212 -6.918 94 HG SER 14 HG SER 14 -11.884 -2.748 -8.436 95 H ASN 15 H ASN 15 -10.268 -0.161 -5.364 96 HA ASN 15 HA ASN 15 -10.993 0.522 -2.536 97 HB3 ASN 15 2HB ASN 15 -9.119 1.994 -2.583 98 HD21 ASN 15 2HD2 ASN 15 -6.713 1.257 -4.116 99 HD22 ASN 15 1HD2 ASN 15 -6.292 -0.367 -3.600 100 H SER 16 H SER 16 -11.637 2.906 -2.176 101 HA SER 16 HA SER 16 -13.656 3.702 -4.063 102 HB3 SER 16 2HB SER 16 -13.684 4.273 -1.638 103 HG SER 16 HG SER 16 -12.502 6.327 -1.208 104 H LYS 17 H LYS 17 -10.377 4.836 -3.529 105 HA LYS 17 HA LYS 17 -10.338 6.759 -5.733 106 HB3 LYS 17 2HB LYS 17 -7.698 6.168 -4.785 107 HG3 LYS 17 2HG LYS 17 -8.196 8.285 -3.318 108 HD3 LYS 17 2HD LYS 17 -7.719 7.992 -6.212 109 HE3 LYS 17 2HE LYS 17 -8.009 10.825 -5.726 110 HZ1 LYS 17 3HZ LYS 17 -9.381 10.636 -7.743 111 HZ2 LYS 17 1HZ LYS 17 -8.007 9.773 -7.915 112 HZ3 LYS 17 2HZ LYS 17 -9.426 9.009 -7.612 113 H PHE 18 H PHE 18 -10.029 3.378 -5.773 114 HA PHE 18 HA PHE 18 -7.976 3.033 -7.767 115 HB3 PHE 18 2HB PHE 18 -10.332 1.276 -7.044 116 HD1 PHE 18 1HD PHE 18 -10.461 0.331 -9.396 117 HD2 PHE 18 2HD PHE 18 -6.891 0.115 -6.976 118 HE1 PHE 18 1HE PHE 18 -9.592 -1.493 -10.838 119 HE2 PHE 18 2HE PHE 18 -6.035 -1.725 -8.407 120 HZ PHE 18 HZ PHE 18 -7.382 -2.528 -10.339 121 H LEU 19 H LEU 19 -8.181 4.334 -9.499 122 HA LEU 19 HA LEU 19 -10.346 3.906 -11.430 123 HB3 LEU 19 2HB LEU 19 -10.378 6.734 -11.107 124 HG LEU 19 HG LEU 19 -12.360 4.562 -10.371 125 HD11 LEU 19 1HD1 LEU 19 -12.633 6.326 -8.712 126 HD12 LEU 19 2HD1 LEU 19 -12.655 7.568 -9.985 127 HD13 LEU 19 3HD1 LEU 19 -13.969 6.370 -9.869 128 HD21 LEU 19 3HD2 LEU 19 -13.645 5.589 -12.190 129 HD22 LEU 19 1HD2 LEU 19 -12.392 6.826 -12.416 130 HD23 LEU 19 2HD2 LEU 19 -12.039 5.120 -12.771 131 HA PRO 20 HA PRO 20 -6.996 6.481 -13.579 132 HB3 PRO 20 2HB PRO 20 -6.407 8.455 -12.547 133 HG3 PRO 20 2HG PRO 20 -6.590 8.659 -10.251 134 HD3 PRO 20 2HD PRO 20 -8.421 7.316 -10.158 135 H GLY 21 H GLY 21 -5.192 5.474 -14.523 136 HA2 GLY 21 2HA GLY 21 -4.342 2.937 -13.797 137 H GLN 22 H GLN 22 -2.749 6.019 -12.840 138 HA GLN 22 HA GLN 22 -0.588 5.144 -11.359 139 HB3 GLN 22 2HB GLN 22 -1.351 7.128 -9.785 140 HG3 GLN 22 2HG GLN 22 -0.946 8.205 -12.536 141 HE21 GLN 22 2HE2 GLN 22 1.201 9.548 -12.518 142 HE22 GLN 22 1HE2 GLN 22 1.584 10.328 -10.984 143 H GLY 23 H GLY 23 -3.871 4.426 -10.432 144 HA2 GLY 23 2HA GLY 23 -4.064 2.412 -9.238 145 H LEU 24 H LEU 24 -3.020 4.222 -6.455 146 HA LEU 24 HA LEU 24 -5.651 5.479 -6.015 147 HB3 LEU 24 2HB LEU 24 -4.475 3.320 -4.218 148 HG LEU 24 HG LEU 24 -6.133 5.635 -3.355 149 HD11 LEU 24 1HD1 LEU 24 -7.848 3.832 -3.603 150 HD12 LEU 24 2HD1 LEU 24 -6.906 2.839 -2.457 151 HD13 LEU 24 3HD1 LEU 24 -7.616 4.378 -1.940 152 HD21 LEU 24 3HD2 LEU 24 -5.273 5.117 -1.215 153 HD22 LEU 24 1HD2 LEU 24 -4.769 3.484 -1.700 154 HD23 LEU 24 2HD2 LEU 24 -3.935 4.892 -2.364 155 H VAL 25 H VAL 25 -5.461 7.448 -5.044 156 HA VAL 25 HA VAL 25 -2.710 8.317 -4.179 157 HB VAL 25 HB VAL 25 -4.942 9.932 -5.473 158 HG11 VAL 25 1HG1 VAL 25 -3.783 11.353 -3.858 159 HG12 VAL 25 2HG1 VAL 25 -2.201 10.835 -4.491 160 HG13 VAL 25 3HG1 VAL 25 -3.311 11.796 -5.495 161 HG21 VAL 25 3HG2 VAL 25 -3.327 10.253 -7.303 162 HG22 VAL 25 1HG2 VAL 25 -2.162 9.190 -6.484 163 HG23 VAL 25 2HG2 VAL 25 -3.700 8.540 -7.094 164 H LEU 26 H LEU 26 -2.475 9.227 -2.176 165 HA LEU 26 HA LEU 26 -4.935 9.338 -0.475 166 HB3 LEU 26 2HB LEU 26 -3.230 9.402 1.411 167 HG LEU 26 HG LEU 26 -2.808 7.121 1.617 168 HD11 LEU 26 1HD1 LEU 26 -5.240 7.761 1.679 169 HD12 LEU 26 2HD1 LEU 26 -5.377 7.259 -0.022 170 HD13 LEU 26 3HD1 LEU 26 -4.962 6.069 1.219 171 HD21 LEU 26 3HD2 LEU 26 -2.913 5.486 -0.133 172 HD22 LEU 26 1HD2 LEU 26 -3.380 6.722 -1.321 173 HD23 LEU 26 2HD2 LEU 26 -1.773 6.772 -0.605 174 H TYR 27 H TYR 27 -5.412 11.010 0.773 175 HA TYR 27 HA TYR 27 -4.711 13.629 -0.178 176 HB3 TYR 27 2HB TYR 27 -6.041 14.156 2.063 177 HD1 TYR 27 1HD TYR 27 -7.155 11.762 -0.682 178 HD2 TYR 27 2HD TYR 27 -7.536 15.664 1.146 179 HE1 TYR 27 1HE TYR 27 -8.795 12.422 -2.427 180 HE2 TYR 27 2HE TYR 27 -9.193 16.308 -0.594 181 HH TYR 27 HH TYR 27 -10.312 15.676 -2.474 182 HA PRO 28 HA PRO 28 -1.225 13.944 2.706 183 HB3 PRO 28 2HB PRO 28 -0.079 14.605 0.881 184 HG3 PRO 28 2HG PRO 28 -0.974 15.992 -0.811 185 HD3 PRO 28 2HD PRO 28 -2.574 14.334 -0.705 186 H GLN 29 H GLN 29 -3.356 14.280 4.057 187 HA GLN 29 HA GLN 29 -3.330 16.990 5.346 188 HB3 GLN 29 2HB GLN 29 -5.862 16.203 5.786 189 HG3 GLN 29 2HG GLN 29 -6.103 17.246 3.192 190 HE21 GLN 29 2HE2 GLN 29 -8.069 17.581 4.552 191 HE22 GLN 29 1HE2 GLN 29 -8.134 18.997 5.591 192 H ILE 30 H ILE 30 -2.453 16.845 7.240 193 HA ILE 30 HA ILE 30 -2.437 14.490 8.911 194 HB ILE 30 HB ILE 30 -1.765 17.386 9.480 195 HG13 ILE 30 2HG1 ILE 30 0.537 16.813 9.213 196 HG21 ILE 30 1HG2 ILE 30 -2.265 16.321 11.612 197 HG22 ILE 30 2HG2 ILE 30 -1.218 14.944 11.218 198 HG23 ILE 30 3HG2 ILE 30 -0.518 16.550 11.456 199 HD11 ILE 30 3HD1 ILE 30 1.327 14.616 8.355 200 HD12 ILE 30 1HD1 ILE 30 0.744 14.517 10.019 201 HD13 ILE 30 2HD1 ILE 30 -0.262 13.919 8.681 202 H GLY 31 H GLY 31 -4.057 13.700 9.938 203 HA2 GLY 31 2HA GLY 31 -5.780 14.128 11.729 204 H ASP 32 H ASP 32 -5.638 13.249 8.341 205 HA ASP 32 HA ASP 32 -8.074 11.623 8.523 206 HB3 ASP 32 2HB ASP 32 -7.360 12.654 6.411 207 H LYS 33 H LYS 33 -7.742 9.274 7.689 208 HA LYS 33 HA LYS 33 -5.426 7.862 8.624 209 HB3 LYS 33 2HB LYS 33 -6.503 7.795 10.790 210 HG3 LYS 33 2HG LYS 33 -9.040 7.171 9.262 211 HD3 LYS 33 2HD LYS 33 -9.562 7.044 12.038 212 HE3 LYS 33 2HE LYS 33 -10.801 5.877 10.226 213 HZ1 LYS 33 3HZ LYS 33 -9.983 3.706 9.485 214 HZ2 LYS 33 1HZ LYS 33 -8.877 4.820 9.109 215 HZ3 LYS 33 2HZ LYS 33 -8.637 3.844 10.400 216 H LEU 34 H LEU 34 -5.428 5.687 7.973 217 HA LEU 34 HA LEU 34 -7.390 4.903 5.899 218 HB3 LEU 34 2HB LEU 34 -6.063 5.617 4.274 219 HG LEU 34 HG LEU 34 -3.739 5.851 6.210 220 HD11 LEU 34 1HD1 LEU 34 -2.803 4.623 4.349 221 HD12 LEU 34 2HD1 LEU 34 -3.606 5.685 3.178 222 HD13 LEU 34 3HD1 LEU 34 -2.310 6.315 4.219 223 HD21 LEU 34 3HD2 LEU 34 -3.575 8.096 5.129 224 HD22 LEU 34 1HD2 LEU 34 -4.947 7.698 4.080 225 HD23 LEU 34 2HD2 LEU 34 -5.165 7.864 5.823 226 H ASP 35 H ASP 35 -8.004 2.972 6.280 227 HA ASP 35 HA ASP 35 -6.169 1.038 7.589 228 HB3 ASP 35 2HB ASP 35 -8.060 1.023 8.848 229 H ILE 36 H ILE 36 -5.614 -0.811 6.746 230 HA ILE 36 HA ILE 36 -6.252 -1.409 3.928 231 HB ILE 36 HB ILE 36 -4.164 -0.441 3.742 232 HG13 ILE 36 2HG1 ILE 36 -4.542 -2.804 2.728 233 HG21 ILE 36 1HG2 ILE 36 -3.382 -0.319 6.033 234 HG22 ILE 36 2HG2 ILE 36 -3.162 -2.084 6.081 235 HG23 ILE 36 3HG2 ILE 36 -2.140 -1.079 5.037 236 HD11 ILE 36 3HD1 ILE 36 -2.476 -2.843 1.637 237 HD12 ILE 36 1HD1 ILE 36 -2.686 -1.126 2.017 238 HD13 ILE 36 2HD1 ILE 36 -1.609 -2.110 3.003 239 H ILE 37 H ILE 37 -7.510 -3.046 4.049 240 HA ILE 37 HA ILE 37 -6.788 -5.407 5.692 241 HB ILE 37 HB ILE 37 -9.555 -4.397 4.984 242 HG13 ILE 37 2HG1 ILE 37 -7.868 -3.630 7.195 243 HG21 ILE 37 1HG2 ILE 37 -9.497 -6.866 5.082 244 HG22 ILE 37 2HG2 ILE 37 -8.764 -6.801 6.688 245 HG23 ILE 37 3HG2 ILE 37 -10.416 -6.196 6.423 246 HD11 ILE 37 3HD1 ILE 37 -9.841 -2.384 7.942 247 HD12 ILE 37 1HD1 ILE 37 -9.629 -2.217 6.185 248 HD13 ILE 37 2HD1 ILE 37 -10.872 -3.318 6.837 249 H CYS 38 H CYS 38 -6.746 -7.344 4.641 250 HA CYS 38 HA CYS 38 -7.859 -7.570 1.908 251 HB3 CYS 38 2HB CYS 38 -5.720 -8.906 1.357 252 HA PRO 39 HA PRO 39 -9.084 -11.482 3.621 253 HB3 PRO 39 2HB PRO 39 -10.784 -11.420 2.057 254 HG3 PRO 39 2HG PRO 39 -10.435 -10.523 -0.073 255 HD3 PRO 39 2HD PRO 39 -9.218 -8.825 0.871 256 H LYS 40 H LYS 40 -8.665 -13.888 3.326 257 HA LYS 40 HA LYS 40 -5.752 -14.308 2.824 258 HB3 LYS 40 2HB LYS 40 -7.834 -15.886 4.392 259 HG3 LYS 40 2HG LYS 40 -5.466 -16.763 5.322 260 HD3 LYS 40 2HD LYS 40 -7.156 -17.956 3.102 261 HE3 LYS 40 2HE LYS 40 -6.051 -20.122 3.625 262 HZ1 LYS 40 3HZ LYS 40 -4.137 -19.775 2.244 263 HZ2 LYS 40 1HZ LYS 40 -5.347 -18.850 1.632 264 HZ3 LYS 40 2HZ LYS 40 -4.125 -18.164 2.490 265 H VAL 41 H VAL 41 -8.837 -15.792 1.939 266 HA VAL 41 HA VAL 41 -9.539 -17.104 0.257 267 HB VAL 41 HB VAL 41 -7.032 -16.365 -1.302 268 HG11 VAL 41 1HG1 VAL 41 -8.316 -18.138 -2.354 269 HG12 VAL 41 2HG1 VAL 41 -9.829 -17.244 -2.084 270 HG13 VAL 41 3HG1 VAL 41 -8.615 -16.632 -3.228 271 HG21 VAL 41 3HG2 VAL 41 -8.472 -14.527 -2.256 272 HG22 VAL 41 1HG2 VAL 41 -9.653 -14.831 -0.958 273 HG23 VAL 41 2HG2 VAL 41 -8.015 -14.259 -0.580 274 H ASP 42 H ASP 42 -9.706 -19.212 0.473 275 HA ASP 42 HA ASP 42 -7.815 -21.059 -0.547 276 HB3 ASP 42 2HB ASP 42 -7.948 -22.118 2.121 277 H SER 43 H SER 43 -10.211 -21.072 2.138 278 HA SER 43 HA SER 43 -11.256 -23.662 1.352 279 HB3 SER 43 2HB SER 43 -12.692 -21.799 3.266 280 HG SER 43 HG SER 43 -12.747 -23.826 4.430 281 H LYS 44 H LYS 44 -12.502 -20.361 1.231 282 HA LYS 44 HA LYS 44 -14.957 -21.070 -0.260 283 HB3 LYS 44 2HB LYS 44 -15.512 -18.744 -0.016 284 HG3 LYS 44 2HG LYS 44 -15.301 -18.211 2.325 285 HD3 LYS 44 2HD LYS 44 -15.825 -20.278 3.541 286 HE3 LYS 44 2HE LYS 44 -17.239 -20.937 1.017 287 HZ1 LYS 44 3HZ LYS 44 -19.142 -20.368 2.426 288 HZ2 LYS 44 1HZ LYS 44 -18.144 -21.365 3.248 289 HZ3 LYS 44 2HZ LYS 44 -18.171 -19.766 3.588 290 H THR 45 H THR 45 -11.779 -19.925 -0.885 291 HA THR 45 HA THR 45 -10.535 -19.318 -2.619 292 HB THR 45 HB THR 45 -12.258 -20.511 -4.721 293 HG1 THR 45 1HG THR 45 -11.802 -22.579 -3.939 294 HG21 THR 45 3HG2 THR 45 -10.139 -21.644 -5.256 295 HG22 THR 45 1HG2 THR 45 -9.776 -19.925 -5.012 296 HG23 THR 45 2HG2 THR 45 -9.421 -21.091 -3.726 297 H VAL 46 H VAL 46 -13.688 -18.064 -2.704 298 HA VAL 46 HA VAL 46 -14.695 -16.322 -3.652 299 HB VAL 46 HB VAL 46 -13.706 -14.171 -3.365 300 HG11 VAL 46 1HG1 VAL 46 -14.485 -15.395 -1.374 301 HG12 VAL 46 2HG1 VAL 46 -12.843 -16.029 -1.110 302 HG13 VAL 46 3HG1 VAL 46 -13.160 -14.288 -1.004 303 HG21 VAL 46 3HG2 VAL 46 -11.410 -13.788 -2.657 304 HG22 VAL 46 1HG2 VAL 46 -11.039 -15.515 -2.784 305 HG23 VAL 46 2HG2 VAL 46 -11.388 -14.572 -4.236 306 H GLY 47 H GLY 47 -13.950 -18.021 -5.660 307 HA2 GLY 47 2HA GLY 47 -14.175 -18.004 -7.989 308 H GLN 48 H GLN 48 -11.542 -17.559 -6.229 309 HA GLN 48 HA GLN 48 -9.435 -18.139 -6.320 310 HB3 GLN 48 2HB GLN 48 -8.418 -19.310 -8.051 311 HG3 GLN 48 2HG GLN 48 -10.939 -20.166 -7.104 312 HE21 GLN 48 2HE2 GLN 48 -12.935 -20.589 -8.027 313 HE22 GLN 48 1HE2 GLN 48 -13.166 -20.914 -9.738 314 H TYR 49 H TYR 49 -8.276 -16.499 -5.769 315 HA TYR 49 HA TYR 49 -7.643 -14.323 -7.715 316 HB3 TYR 49 2HB TYR 49 -7.372 -13.546 -4.934 317 HD1 TYR 49 1HD TYR 49 -9.592 -13.366 -7.978 318 HD2 TYR 49 2HD TYR 49 -7.945 -11.257 -4.581 319 HE1 TYR 49 1HE TYR 49 -10.392 -11.216 -8.924 320 HE2 TYR 49 2HE TYR 49 -8.791 -9.107 -5.522 321 HH TYR 49 HH TYR 49 -9.793 -8.077 -7.295 322 H GLU 50 H GLU 50 -5.679 -13.029 -7.067 323 HA GLU 50 HA GLU 50 -3.428 -14.938 -6.607 324 HB3 GLU 50 2HB GLU 50 -2.420 -12.480 -7.577 325 HG3 GLU 50 2HG GLU 50 -1.758 -14.897 -8.119 326 H TYR 51 H TYR 51 -1.382 -13.623 -5.854 327 HA TYR 51 HA TYR 51 -2.084 -12.578 -3.156 328 HB3 TYR 51 2HB TYR 51 0.272 -13.270 -2.650 329 HD1 TYR 51 2HD TYR 51 -2.851 -14.558 -2.777 330 HD2 TYR 51 1HD TYR 51 1.215 -15.951 -3.278 331 HE1 TYR 51 2HE TYR 51 -3.579 -16.855 -2.255 332 HE2 TYR 51 1HE TYR 51 0.467 -18.269 -2.737 333 HH TYR 51 HH TYR 51 -2.970 -19.049 -2.067 334 H TYR 52 H TYR 52 -1.770 -10.518 -2.685 335 HA TYR 52 HA TYR 52 -0.147 -8.829 -4.554 336 HB3 TYR 52 2HB TYR 52 -1.690 -7.058 -4.108 337 HD1 TYR 52 1HD TYR 52 -1.716 -9.473 -6.099 338 HD2 TYR 52 2HD TYR 52 -4.704 -7.719 -3.525 339 HE1 TYR 52 1HE TYR 52 -3.503 -10.435 -7.518 340 HE2 TYR 52 2HE TYR 52 -6.490 -8.649 -4.986 341 HH TYR 52 HH TYR 52 -6.959 -9.949 -6.823 342 H LYS 53 H LYS 53 1.020 -7.003 -3.607 343 HA LYS 53 HA LYS 53 1.392 -7.008 -0.697 344 HB3 LYS 53 2HB LYS 53 2.878 -8.856 -1.487 345 HG3 LYS 53 2HG LYS 53 3.738 -7.019 -3.514 346 HD3 LYS 53 2HD LYS 53 5.366 -6.364 -1.520 347 HE3 LYS 53 2HE LYS 53 5.855 -8.830 -1.028 348 HZ1 LYS 53 3HZ LYS 53 7.504 -9.843 -2.519 349 HZ2 LYS 53 1HZ LYS 53 6.122 -9.561 -3.341 350 HZ3 LYS 53 2HZ LYS 53 7.393 -8.566 -3.558 351 H VAL 54 H VAL 54 2.187 -5.132 0.094 352 HA VAL 54 HA VAL 54 2.429 -2.873 -1.881 353 HB VAL 54 HB VAL 54 1.052 -3.134 0.765 354 HG11 VAL 54 1HG1 VAL 54 2.451 -1.312 1.371 355 HG12 VAL 54 2HG1 VAL 54 2.261 -0.536 -0.206 356 HG13 VAL 54 3HG1 VAL 54 0.892 -0.629 0.920 357 HG21 VAL 54 3HG2 VAL 54 -0.669 -1.816 -0.392 358 HG22 VAL 54 1HG2 VAL 54 0.383 -1.673 -1.816 359 HG23 VAL 54 2HG2 VAL 54 -0.238 -3.261 -1.318 360 H TYR 55 H TYR 55 4.451 -2.436 -2.175 361 HA TYR 55 HA TYR 55 6.257 -2.290 0.180 362 HB3 TYR 55 2HB TYR 55 6.709 -3.446 -2.564 363 HD1 TYR 55 1HD TYR 55 8.974 -3.492 0.409 364 HD2 TYR 55 2HD TYR 55 8.348 -1.947 -3.564 365 HE1 TYR 55 1HE TYR 55 11.300 -2.574 0.385 366 HE2 TYR 55 2HE TYR 55 10.686 -1.141 -3.603 367 HH TYR 55 HH TYR 55 12.562 -0.791 -2.461 368 H MET 56 H MET 56 7.827 -0.658 0.214 369 HA MET 56 HA MET 56 6.998 1.765 -1.228 370 HB3 MET 56 2HB MET 56 9.002 1.376 1.023 371 HG3 MET 56 2HG MET 56 7.506 3.901 0.247 372 HE1 MET 56 3HE MET 56 10.049 6.442 1.781 373 HE2 MET 56 1HE MET 56 10.243 5.673 0.190 374 HE3 MET 56 2HE MET 56 8.635 6.193 0.737 375 H VAL 57 H VAL 57 7.965 2.229 -3.124 376 HA VAL 57 HA VAL 57 10.870 1.612 -3.518 377 HB VAL 57 HB VAL 57 9.139 0.080 -4.675 378 HG11 VAL 57 1HG1 VAL 57 7.664 1.838 -5.569 379 HG12 VAL 57 2HG1 VAL 57 9.001 2.379 -6.611 380 HG13 VAL 57 3HG1 VAL 57 8.317 0.769 -6.829 381 HG21 VAL 57 3HG2 VAL 57 10.553 0.014 -6.765 382 HG22 VAL 57 1HG2 VAL 57 11.503 1.324 -6.039 383 HG23 VAL 57 2HG2 VAL 57 11.416 -0.210 -5.251 384 H ASP 58 H ASP 58 11.824 2.975 -5.391 385 HA ASP 58 HA ASP 58 11.244 5.811 -5.017 386 HB3 ASP 58 2HB ASP 58 13.032 6.161 -6.606 387 H LYS 59 H LYS 59 10.618 7.326 -6.733 388 HA LYS 59 HA LYS 59 8.337 6.635 -8.207 389 HB3 LYS 59 2HB LYS 59 9.080 8.929 -7.593 390 HG3 LYS 59 2HG LYS 59 10.795 8.827 -10.086 391 HD3 LYS 59 2HD LYS 59 10.044 11.069 -8.179 392 HE3 LYS 59 2HE LYS 59 12.337 10.668 -10.103 393 HZ1 LYS 59 3HZ LYS 59 12.554 13.097 -10.176 394 HZ2 LYS 59 1HZ LYS 59 11.194 12.620 -10.939 395 HZ3 LYS 59 2HZ LYS 59 11.103 13.288 -9.449 396 H ASP 60 H ASP 60 11.668 6.629 -9.390 397 HA ASP 60 HA ASP 60 11.079 6.032 -12.146 398 HB3 ASP 60 2HB ASP 60 13.502 5.785 -10.324 399 H GLN 61 H GLN 61 11.912 4.007 -9.343 400 HA GLN 61 HA GLN 61 11.852 1.486 -10.770 401 HB3 GLN 61 2HB GLN 61 11.944 0.551 -8.484 402 HG3 GLN 61 2HG GLN 61 13.969 2.729 -8.284 403 HE21 GLN 61 2HE2 GLN 61 15.607 0.340 -9.733 404 HE22 GLN 61 1HE2 GLN 61 15.856 -0.752 -8.381 405 H ALA 62 H ALA 62 9.429 3.334 -8.926 406 HA ALA 62 HA ALA 62 7.286 1.448 -9.124 407 HB1 ALA 62 3HB ALA 62 5.903 3.359 -8.543 408 HB2 ALA 62 1HB ALA 62 7.388 3.479 -7.621 409 HB3 ALA 62 2HB ALA 62 7.168 4.500 -9.040 410 H ASP 63 H ASP 63 8.929 3.192 -11.612 411 HA ASP 63 HA ASP 63 6.639 2.843 -13.489 412 HB3 ASP 63 2HB ASP 63 9.048 4.214 -14.482 413 H ARG 64 H ARG 64 9.986 1.857 -12.887 414 HA ARG 64 HA ARG 64 10.231 0.108 -15.212 415 HB3 ARG 64 2HB ARG 64 12.061 -0.935 -13.718 416 HG3 ARG 64 2HG ARG 64 12.277 2.068 -14.186 417 HD3 ARG 64 2HD ARG 64 14.220 -0.204 -13.737 418 HE ARG 64 HE ARG 64 15.321 2.097 -15.159 419 HH11 ARG 64 1HH2 ARG 64 14.092 -1.157 -15.620 420 HH12 ARG 64 2HH2 ARG 64 14.822 -1.317 -17.192 421 HH21 ARG 64 1HH1 ARG 64 16.218 1.835 -17.175 422 HH22 ARG 64 2HH1 ARG 64 16.003 0.342 -18.046 423 H CYS 65 H CYS 65 8.787 -0.278 -12.073 424 HA CYS 65 HA CYS 65 7.594 -1.909 -11.146 425 HB3 CYS 65 2HB CYS 65 6.434 -3.536 -12.396 426 H THR 66 H THR 66 9.671 -1.933 -10.071 427 HA THR 66 HA THR 66 10.744 -4.692 -9.880 428 HB THR 66 HB THR 66 13.045 -3.728 -9.660 429 HG1 THR 66 1HG THR 66 13.383 -1.660 -10.520 430 HG21 THR 66 3HG2 THR 66 13.489 -3.485 -12.041 431 HG22 THR 66 1HG2 THR 66 12.248 -4.732 -11.828 432 HG23 THR 66 2HG2 THR 66 11.789 -3.106 -12.372 433 H ILE 67 H ILE 67 11.181 -5.306 -7.824 434 HA ILE 67 HA ILE 67 10.679 -3.363 -5.598 435 HB ILE 67 HB ILE 67 10.185 -6.243 -5.260 436 HG13 ILE 67 2HG1 ILE 67 7.878 -6.320 -5.993 437 HG21 ILE 67 1HG2 ILE 67 9.982 -4.691 -3.371 438 HG22 ILE 67 2HG2 ILE 67 8.543 -4.028 -4.194 439 HG23 ILE 67 3HG2 ILE 67 8.547 -5.695 -3.654 440 HD11 ILE 67 3HD1 ILE 67 7.093 -4.469 -7.605 441 HD12 ILE 67 1HD1 ILE 67 6.947 -4.165 -5.869 442 HD13 ILE 67 2HD1 ILE 67 8.279 -3.432 -6.802 443 H LYS 68 H LYS 68 12.073 -3.681 -3.766 444 HA LYS 68 HA LYS 68 14.667 -4.940 -4.479 445 HB3 LYS 68 2HB LYS 68 15.473 -3.807 -2.472 446 HG3 LYS 68 2HG LYS 68 14.945 -1.416 -3.007 447 HD3 LYS 68 2HD LYS 68 15.692 -2.768 -5.602 448 HE3 LYS 68 2HE LYS 68 16.595 -0.402 -3.920 449 HZ1 LYS 68 3HZ LYS 68 18.421 -0.134 -5.476 450 HZ2 LYS 68 1HZ LYS 68 18.589 -1.545 -4.675 451 HZ3 LYS 68 2HZ LYS 68 18.071 -1.545 -6.227 452 H LYS 69 H LYS 69 15.393 -6.848 -3.673 453 HA LYS 69 HA LYS 69 13.783 -8.505 -1.945 454 HB3 LYS 69 2HB LYS 69 15.370 -9.318 -3.689 455 HG3 LYS 69 2HG LYS 69 17.336 -7.825 -2.227 456 HD3 LYS 69 2HD LYS 69 17.910 -10.814 -2.312 457 HE3 LYS 69 2HE LYS 69 19.631 -8.988 -0.737 458 HZ1 LYS 69 3HZ LYS 69 21.350 -10.222 -1.917 459 HZ2 LYS 69 1HZ LYS 69 20.238 -11.282 -1.361 460 HZ3 LYS 69 2HZ LYS 69 20.265 -10.874 -2.944 461 H GLU 70 H GLU 70 16.010 -6.028 -1.103 462 HA GLU 70 HA GLU 70 16.433 -6.861 1.647 463 HB3 GLU 70 2HB GLU 70 17.938 -5.354 0.471 464 HG3 GLU 70 2HG GLU 70 16.342 -2.908 0.915 465 H ASN 71 H ASN 71 13.570 -5.966 0.125 466 HA ASN 71 HA ASN 71 12.194 -4.586 2.194 467 HB3 ASN 71 2HB ASN 71 11.390 -4.905 -0.124 468 HD21 ASN 71 2HD2 ASN 71 9.634 -6.092 -1.355 469 HD22 ASN 71 1HD2 ASN 71 9.910 -7.831 -1.536 470 H THR 72 H THR 72 10.409 -5.550 3.423 471 HA THR 72 HA THR 72 9.909 -7.968 4.479 472 HB THR 72 HB THR 72 12.573 -7.177 5.498 473 HG1 THR 72 1HG THR 72 12.730 -9.345 5.402 474 HG21 THR 72 3HG2 THR 72 12.279 -8.347 7.651 475 HG22 THR 72 1HG2 THR 72 11.385 -6.830 7.630 476 HG23 THR 72 2HG2 THR 72 10.517 -8.373 7.400 477 HA PRO 73 HA PRO 73 8.611 -4.931 7.816 478 HB3 PRO 73 2HB PRO 73 10.390 -3.758 8.612 479 HG3 PRO 73 2HG PRO 73 12.062 -2.962 7.210 480 HD3 PRO 73 2HD PRO 73 11.957 -4.961 6.109 481 H LEU 74 H LEU 74 7.528 -5.247 5.269 482 HA LEU 74 HA LEU 74 5.760 -2.883 4.828 483 HB3 LEU 74 2HB LEU 74 5.980 -3.936 2.341 484 HG LEU 74 HG LEU 74 7.653 -2.441 1.639 485 HD11 LEU 74 1HD1 LEU 74 5.424 -1.478 2.205 486 HD12 LEU 74 2HD1 LEU 74 6.077 -0.997 3.782 487 HD13 LEU 74 3HD1 LEU 74 6.749 -0.314 2.295 488 HD21 LEU 74 3HD2 LEU 74 9.087 -1.129 2.957 489 HD22 LEU 74 1HD2 LEU 74 8.322 -1.665 4.458 490 HD23 LEU 74 2HD2 LEU 74 9.283 -2.808 3.483 491 H LEU 75 H LEU 75 3.973 -3.792 3.097 492 HA LEU 75 HA LEU 75 2.602 -5.857 4.734 493 HB3 LEU 75 2HB LEU 75 1.575 -3.677 2.894 494 HG LEU 75 HG LEU 75 0.148 -6.006 4.136 495 HD11 LEU 75 1HD1 LEU 75 -0.446 -4.514 5.845 496 HD12 LEU 75 2HD1 LEU 75 -0.790 -3.198 4.714 497 HD13 LEU 75 3HD1 LEU 75 -1.826 -4.643 4.757 498 HD21 LEU 75 3HD2 LEU 75 -1.590 -5.341 2.494 499 HD22 LEU 75 1HD2 LEU 75 -0.621 -3.930 2.058 500 HD23 LEU 75 2HD2 LEU 75 -0.007 -5.543 1.725 501 H ASN 76 H ASN 76 1.525 -7.563 3.951 502 HA ASN 76 HA ASN 76 1.879 -8.368 1.094 503 HB3 ASN 76 2HB ASN 76 2.237 -10.705 2.111 504 HD21 ASN 76 2HD2 ASN 76 4.616 -8.963 3.951 505 HD22 ASN 76 1HD2 ASN 76 5.861 -9.068 2.719 506 H CYS 77 H CYS 77 -0.199 -7.721 0.721 507 HA CYS 77 HA CYS 77 -2.626 -8.621 1.959 508 HB3 CYS 77 2HB CYS 77 -1.862 -7.390 -0.698 509 H ALA 78 H ALA 78 -1.482 -10.845 2.070 510 HA ALA 78 HA ALA 78 -2.975 -12.721 0.469 511 HB1 ALA 78 3HB ALA 78 -0.953 -13.899 -0.441 512 HB2 ALA 78 1HB ALA 78 -1.197 -12.286 -1.145 513 HB3 ALA 78 2HB ALA 78 0.061 -12.529 0.068 514 H LYS 79 H LYS 79 0.217 -12.892 2.045 515 HA LYS 79 HA LYS 79 1.155 -14.258 3.593 516 HB3 LYS 79 2HB LYS 79 -0.876 -14.547 5.574 517 HG3 LYS 79 2HG LYS 79 1.434 -13.903 6.123 518 HD3 LYS 79 2HD LYS 79 0.859 -11.142 4.991 519 HE3 LYS 79 2HE LYS 79 3.351 -10.894 5.386 520 HZ1 LYS 79 3HZ LYS 79 3.211 -10.621 7.785 521 HZ2 LYS 79 1HZ LYS 79 1.859 -10.028 7.100 522 HZ3 LYS 79 2HZ LYS 79 1.830 -11.476 7.870 523 HA PRO 80 HA PRO 80 0.275 -18.449 2.975 524 HB3 PRO 80 2HB PRO 80 2.087 -19.121 4.200 525 HG3 PRO 80 2HG PRO 80 2.748 -17.933 6.092 526 HD3 PRO 80 2HD PRO 80 2.200 -16.007 4.943 527 H ASP 81 H ASP 81 -0.962 -17.665 6.254 528 HA ASP 81 HA ASP 81 -3.686 -18.124 5.469 529 HB3 ASP 81 2HB ASP 81 -2.604 -20.019 7.592 530 H GLN 82 H GLN 82 -3.199 -15.823 6.071 531 HA GLN 82 HA GLN 82 -4.548 -15.425 8.592 532 HB3 GLN 82 2HB GLN 82 -2.440 -13.440 8.616 533 HG3 GLN 82 2HG GLN 82 -2.772 -15.739 10.571 534 HE21 GLN 82 2HE2 GLN 82 -2.362 -15.082 12.815 535 HE22 GLN 82 1HE2 GLN 82 -1.362 -13.670 13.139 536 H ASP 83 H ASP 83 -5.931 -13.794 8.468 537 HA ASP 83 HA ASP 83 -6.338 -12.033 6.231 538 HB3 ASP 83 2HB ASP 83 -7.167 -12.018 9.160 539 H ILE 84 H ILE 84 -5.425 -10.102 5.722 540 HA ILE 84 HA ILE 84 -3.457 -8.918 7.632 541 HB ILE 84 HB ILE 84 -3.364 -9.274 4.763 542 HG13 ILE 84 2HG1 ILE 84 -1.417 -7.948 6.708 543 HG21 ILE 84 1HG2 ILE 84 -4.294 -6.977 4.549 544 HG22 ILE 84 2HG2 ILE 84 -3.027 -6.374 5.635 545 HG23 ILE 84 3HG2 ILE 84 -2.607 -7.063 4.050 546 HD11 ILE 84 3HD1 ILE 84 -0.261 -10.130 6.686 547 HD12 ILE 84 1HD1 ILE 84 -1.845 -10.285 7.427 548 HD13 ILE 84 2HD1 ILE 84 -1.601 -10.844 5.757 549 H LYS 85 H LYS 85 -3.837 -7.211 8.669 550 HA LYS 85 HA LYS 85 -5.781 -5.168 7.833 551 HB3 LYS 85 2HB LYS 85 -5.969 -6.644 10.479 552 HG3 LYS 85 2HG LYS 85 -7.868 -4.421 9.652 553 HD3 LYS 85 2HD LYS 85 -7.349 -4.124 12.319 554 HE3 LYS 85 2HE LYS 85 -9.411 -6.000 11.092 555 HZ1 LYS 85 3HZ LYS 85 -10.616 -5.511 13.172 556 HZ2 LYS 85 1HZ LYS 85 -9.237 -6.323 13.487 557 HZ3 LYS 85 2HZ LYS 85 -9.325 -4.718 13.777 558 H PHE 86 H PHE 86 -4.703 -3.370 8.003 559 HA PHE 86 HA PHE 86 -3.095 -2.745 10.421 560 HB3 PHE 86 2HB PHE 86 -1.819 -1.502 8.189 561 HD1 PHE 86 1HD PHE 86 -1.165 -5.045 9.279 562 HD2 PHE 86 2HD PHE 86 -0.028 -0.910 9.594 563 HE1 PHE 86 1HE PHE 86 0.816 -5.691 10.632 564 HE2 PHE 86 2HE PHE 86 1.961 -1.546 10.940 565 HZ PHE 86 HZ PHE 86 2.375 -3.943 11.473 566 H THR 87 H THR 87 -3.452 -0.607 11.114 567 HA THR 87 HA THR 87 -4.922 1.215 9.272 568 HB THR 87 HB THR 87 -6.663 0.219 10.584 569 HG1 THR 87 1HG THR 87 -7.376 2.211 11.567 570 HG21 THR 87 3HG2 THR 87 -6.954 0.545 12.952 571 HG22 THR 87 1HG2 THR 87 -5.436 -0.331 12.710 572 HG23 THR 87 2HG2 THR 87 -5.414 1.410 13.088 573 H ILE 88 H ILE 88 -3.881 2.986 9.008 574 HA ILE 88 HA ILE 88 -2.042 3.970 11.164 575 HB ILE 88 HB ILE 88 -1.611 3.631 8.203 576 HG13 ILE 88 2HG1 ILE 88 0.131 3.471 10.714 577 HG21 ILE 88 1HG2 ILE 88 -1.427 6.063 8.356 578 HG22 ILE 88 2HG2 ILE 88 -0.357 5.923 9.779 579 HG23 ILE 88 3HG2 ILE 88 0.167 5.353 8.184 580 HD11 ILE 88 3HD1 ILE 88 0.591 1.192 9.978 581 HD12 ILE 88 1HD1 ILE 88 -1.140 1.388 10.265 582 HD13 ILE 88 2HD1 ILE 88 -0.513 1.378 8.597 583 H LYS 89 H LYS 89 -2.255 5.963 11.791 584 HA LYS 89 HA LYS 89 -4.267 7.733 10.470 585 HB3 LYS 89 2HB LYS 89 -4.965 6.880 12.693 586 HG3 LYS 89 2HG LYS 89 -2.690 8.579 13.808 587 HD3 LYS 89 2HD LYS 89 -3.337 6.951 15.825 588 HE3 LYS 89 2HE LYS 89 -4.672 9.553 15.055 589 HZ1 LYS 89 3HZ LYS 89 -5.461 9.550 17.410 590 HZ2 LYS 89 1HZ LYS 89 -6.237 8.429 16.500 591 HZ3 LYS 89 2HZ LYS 89 -5.069 7.977 17.549 592 H PHE 90 H PHE 90 -3.790 9.837 10.151 593 HA PHE 90 HA PHE 90 -0.895 10.510 10.083 594 HB3 PHE 90 2HB PHE 90 -1.949 12.484 8.770 595 HD1 PHE 90 2HD PHE 90 -1.821 8.756 8.233 596 HD2 PHE 90 1HD PHE 90 -1.555 12.703 6.495 597 HE1 PHE 90 2HE PHE 90 -0.881 7.787 6.165 598 HE2 PHE 90 1HE PHE 90 -0.603 11.723 4.426 599 HZ PHE 90 HZ PHE 90 -0.256 9.277 4.262 600 H GLN 91 H GLN 91 -0.887 10.673 12.459 601 HA GLN 91 HA GLN 91 -2.116 13.123 13.612 602 HB3 GLN 91 2HB GLN 91 -2.192 10.976 14.831 603 HG3 GLN 91 2HG GLN 91 0.742 11.330 15.514 604 HE21 GLN 91 2HE2 GLN 91 0.493 10.454 17.632 605 HE22 GLN 91 1HE2 GLN 91 -0.211 8.853 17.901 606 H GLU 92 H GLU 92 -0.630 14.500 15.039 607 HA GLU 92 HA GLU 92 1.660 15.434 13.449 608 HB3 GLU 92 2HB GLU 92 1.831 16.844 15.768 609 HG3 GLU 92 2HG GLU 92 -0.319 17.410 13.703 610 H PHE 93 H PHE 93 1.282 13.914 16.667 611 HA PHE 93 HA PHE 93 4.172 13.180 16.692 612 HB3 PHE 93 2HB PHE 93 3.539 13.774 19.348 613 HD1 PHE 93 2HD PHE 93 4.212 16.440 16.801 614 HD2 PHE 93 1HD PHE 93 5.872 13.786 19.772 615 HE1 PHE 93 2HE PHE 93 6.412 17.580 16.596 616 HE2 PHE 93 1HE PHE 93 8.065 14.936 19.574 617 HZ PHE 93 HZ PHE 93 8.337 16.834 17.988 618 H SER 94 H SER 94 4.666 11.347 17.925 619 HA SER 94 HA SER 94 2.325 9.556 18.368 620 HB3 SER 94 2HB SER 94 5.167 8.739 17.755 621 HG SER 94 HG SER 94 3.877 6.981 16.913 622 HA PRO 95 HA PRO 95 3.657 9.361 22.596 623 HB3 PRO 95 2HB PRO 95 1.536 8.756 23.186 624 HG3 PRO 95 2HG PRO 95 0.183 7.497 21.752 625 HD3 PRO 95 2HD PRO 95 1.009 8.893 20.105 626 H ASN 96 H ASN 96 3.874 6.411 20.574 627 HA ASN 96 HA ASN 96 6.626 6.055 21.391 628 HB3 ASN 96 2HB ASN 96 4.892 3.642 22.008 629 HD21 ASN 96 2HD2 ASN 96 5.904 2.270 23.645 630 HD22 ASN 96 1HD2 ASN 96 7.624 2.419 23.973 631 H LEU 97 H LEU 97 5.026 6.349 18.825 632 HA LEU 97 HA LEU 97 5.897 3.851 17.435 633 HB3 LEU 97 2HB LEU 97 3.663 5.260 16.151 634 HG LEU 97 HG LEU 97 2.497 3.244 16.100 635 HD11 LEU 97 1HD1 LEU 97 4.334 3.414 14.477 636 HD12 LEU 97 2HD1 LEU 97 5.431 2.583 15.617 637 HD13 LEU 97 3HD1 LEU 97 4.023 1.743 14.947 638 HD21 LEU 97 3HD2 LEU 97 3.194 1.211 17.239 639 HD22 LEU 97 1HD2 LEU 97 4.560 2.070 17.995 640 HD23 LEU 97 2HD2 LEU 97 2.885 2.515 18.394 641 H TRP 98 H TRP 98 7.727 4.391 16.439 642 HA TRP 98 HA TRP 98 8.281 6.900 15.147 643 HB3 TRP 98 2HB TRP 98 10.057 5.125 14.049 644 HD1 TRP 98 HD TRP 98 9.538 6.354 17.705 645 HE1 TRP 98 1HE TRP 98 11.572 7.767 18.381 646 HE3 TRP 98 3HE TRP 98 12.329 5.891 13.422 647 HZ2 TRP 98 2HZ TRP 98 14.070 8.602 17.227 648 HZ3 TRP 98 3HZ TRP 98 14.538 7.015 13.241 649 HH2 TRP 98 HH TRP 98 15.413 8.373 15.130 650 H GLY 99 H GLY 99 6.069 4.663 14.112 651 HA2 GLY 99 2HA GLY 99 6.472 5.244 11.198 652 H LEU 100 H LEU 100 4.124 5.727 13.846 653 HA LEU 100 HA LEU 100 2.035 6.831 12.095 654 HB3 LEU 100 2HB LEU 100 1.090 7.651 14.270 655 HG LEU 100 HG LEU 100 1.796 4.689 14.289 656 HD11 LEU 100 1HD1 LEU 100 1.102 5.586 16.523 657 HD12 LEU 100 2HD1 LEU 100 -0.411 6.148 15.790 658 HD13 LEU 100 3HD1 LEU 100 -0.045 4.418 15.846 659 HD21 LEU 100 3HD2 LEU 100 -0.618 4.504 13.480 660 HD22 LEU 100 1HD2 LEU 100 -0.551 6.260 13.180 661 HD23 LEU 100 2HD2 LEU 100 0.533 5.164 12.308 662 H GLU 101 H GLU 101 4.834 8.093 13.885 663 HA GLU 101 HA GLU 101 4.240 10.877 13.252 664 HB3 GLU 101 2HB GLU 101 7.012 10.700 13.469 665 HG3 GLU 101 2HG GLU 101 4.948 10.996 15.676 666 H PHE 102 H PHE 102 4.997 12.128 11.645 667 HA PHE 102 HA PHE 102 6.308 10.898 9.283 668 HB3 PHE 102 2HB PHE 102 4.358 12.565 8.230 669 HD1 PHE 102 2HD PHE 102 5.939 10.375 7.089 670 HD2 PHE 102 1HD PHE 102 1.986 10.287 8.833 671 HE1 PHE 102 2HE PHE 102 5.376 8.394 5.715 672 HE2 PHE 102 1HE PHE 102 1.433 8.304 7.448 673 HZ PHE 102 HZ PHE 102 3.125 7.351 5.892 674 H GLN 103 H GLN 103 7.279 12.422 7.865 675 HA GLN 103 HA GLN 103 8.049 14.983 9.217 676 HB3 GLN 103 2HB GLN 103 10.242 14.683 8.104 677 HG3 GLN 103 2HG GLN 103 11.153 12.843 9.441 678 HE21 GLN 103 2HE2 GLN 103 9.145 12.517 11.899 679 HE22 GLN 103 1HE2 GLN 103 9.366 14.048 12.726 680 H LYS 104 H LYS 104 8.250 16.831 7.963 681 HA LYS 104 HA LYS 104 6.673 16.886 5.519 682 HB3 LYS 104 2HB LYS 104 7.084 19.287 5.528 683 HG3 LYS 104 2HG LYS 104 5.532 18.025 7.326 684 HD3 LYS 104 2HD LYS 104 7.729 18.553 9.018 685 HE3 LYS 104 2HE LYS 104 6.479 20.150 10.643 686 HZ1 LYS 104 3HZ LYS 104 7.475 22.116 9.611 687 HZ2 LYS 104 1HZ LYS 104 8.518 20.866 9.587 688 HZ3 LYS 104 2HZ LYS 104 7.739 21.314 8.216 689 H ASN 105 H ASN 105 7.455 18.124 3.590 690 HA ASN 105 HA ASN 105 8.578 18.002 1.643 691 HB3 ASN 105 2HB ASN 105 11.087 18.214 3.343 692 HD21 ASN 105 2HD2 ASN 105 12.892 18.922 2.215 693 HD22 ASN 105 1HD2 ASN 105 12.882 19.238 0.483 694 H LYS 106 H LYS 106 7.771 15.518 2.621 695 HA LYS 106 HA LYS 106 9.817 13.699 1.418 696 HB3 LYS 106 2HB LYS 106 8.308 12.241 3.370 697 HG3 LYS 106 2HG LYS 106 10.476 12.248 4.675 698 HD3 LYS 106 2HD LYS 106 10.811 11.534 1.732 699 HE3 LYS 106 2HE LYS 106 11.965 9.686 3.648 700 HZ1 LYS 106 3HZ LYS 106 13.981 10.189 2.413 701 HZ2 LYS 106 1HZ LYS 106 12.748 10.031 1.356 702 HZ3 LYS 106 2HZ LYS 106 13.318 11.519 1.737 703 H ASP 107 H ASP 107 9.088 11.991 0.259 704 HA ASP 107 HA ASP 107 6.168 11.829 -0.376 705 HB3 ASP 107 2HB ASP 107 7.132 11.165 -2.730 706 H TYR 108 H TYR 108 5.358 9.854 -0.667 707 HA TYR 108 HA TYR 108 7.140 7.474 -0.334 708 HB3 TYR 108 2HB TYR 108 4.629 6.794 0.652 709 HD1 TYR 108 1HD TYR 108 7.392 8.889 2.175 710 HD2 TYR 108 2HD TYR 108 5.181 5.177 2.215 711 HE1 TYR 108 1HE TYR 108 8.753 8.092 4.109 712 HE2 TYR 108 2HE TYR 108 6.536 4.394 4.145 713 HH TYR 108 HH TYR 108 8.227 4.864 5.590 714 H TYR 109 H TYR 109 7.085 6.157 -1.926 715 HA TYR 109 HA TYR 109 4.784 6.052 -3.842 716 HB3 TYR 109 2HB TYR 109 6.939 4.947 -5.137 717 HD1 TYR 109 1HD TYR 109 5.258 5.582 -6.839 718 HD2 TYR 109 2HD TYR 109 7.670 8.478 -4.731 719 HE1 TYR 109 1HE TYR 109 4.829 7.258 -8.641 720 HE2 TYR 109 2HE TYR 109 7.216 10.153 -6.515 721 HH TYR 109 HH TYR 109 6.244 10.554 -8.535 722 H ILE 110 H ILE 110 3.788 4.194 -3.878 723 HA ILE 110 HA ILE 110 5.073 1.777 -2.686 724 HB ILE 110 HB ILE 110 2.278 2.730 -2.966 725 HG13 ILE 110 2HG1 ILE 110 3.761 1.568 -0.557 726 HG21 ILE 110 1HG2 ILE 110 1.957 0.468 -3.686 727 HG22 ILE 110 2HG2 ILE 110 2.969 -0.147 -2.342 728 HG23 ILE 110 3HG2 ILE 110 1.381 0.594 -2.037 729 HD11 ILE 110 3HD1 ILE 110 3.294 3.879 0.460 730 HD12 ILE 110 1HD1 ILE 110 4.629 3.770 -0.702 731 HD13 ILE 110 2HD1 ILE 110 3.066 4.461 -1.200 732 H ILE 111 H ILE 111 4.457 -0.314 -3.746 733 HA ILE 111 HA ILE 111 3.514 -0.280 -6.508 734 HB ILE 111 HB ILE 111 5.850 0.180 -6.889 735 HG13 ILE 111 2HG1 ILE 111 4.651 -1.457 -8.353 736 HG21 ILE 111 1HG2 ILE 111 6.835 -0.482 -4.784 737 HG22 ILE 111 2HG2 ILE 111 6.428 -2.179 -5.046 738 HG23 ILE 111 3HG2 ILE 111 7.656 -1.372 -6.046 739 HD11 ILE 111 3HD1 ILE 111 6.720 -2.473 -9.371 740 HD12 ILE 111 1HD1 ILE 111 6.652 -0.692 -9.283 741 HD13 ILE 111 2HD1 ILE 111 7.681 -1.610 -8.170 742 H SER 112 H SER 112 2.837 -2.377 -7.202 743 HA SER 112 HA SER 112 3.117 -4.685 -5.365 744 HB3 SER 112 2HB SER 112 0.453 -3.733 -6.459 745 HG SER 112 HG SER 112 -0.350 -5.396 -5.112 746 H THR 113 H THR 113 2.503 -6.744 -6.395 747 HA THR 113 HA THR 113 3.005 -6.709 -9.322 748 HB THR 113 HB THR 113 4.730 -8.384 -9.129 749 HG1 THR 113 1HG THR 113 5.414 -9.092 -7.158 750 HG21 THR 113 3HG2 THR 113 6.469 -7.007 -8.309 751 HG22 THR 113 1HG2 THR 113 5.222 -5.854 -8.801 752 HG23 THR 113 2HG2 THR 113 5.419 -6.246 -7.087 753 H SER 114 H SER 114 0.516 -7.133 -8.190 754 HA SER 114 HA SER 114 -0.550 -9.632 -8.016 755 HB3 SER 114 2HB SER 114 -1.560 -7.180 -9.490 756 HG SER 114 HG SER 114 -3.651 -8.218 -9.134 757 H ASN 115 H ASN 115 0.740 -8.390 -11.088 758 HA ASN 115 HA ASN 115 -0.624 -10.276 -12.749 759 HB3 ASN 115 2HB ASN 115 2.056 -9.230 -13.637 760 HD21 ASN 115 2HD2 ASN 115 2.070 -9.074 -15.913 761 HD22 ASN 115 1HD2 ASN 115 0.620 -9.287 -16.884 762 H GLY 116 H GLY 116 2.104 -10.710 -10.666 763 HA2 GLY 116 2HA GLY 116 3.761 -12.295 -10.479 764 H SER 117 H SER 117 4.388 -11.171 -12.766 765 HA SER 117 HA SER 117 4.417 -12.546 -15.211 766 HB3 SER 117 2HB SER 117 6.626 -10.876 -13.930 767 HG SER 117 HG SER 117 7.172 -10.467 -16.137 768 H LEU 118 H LEU 118 6.103 -13.851 -16.271 769 HA LEU 118 HA LEU 118 6.775 -16.152 -14.795 770 HB3 LEU 118 2HB LEU 118 8.341 -15.311 -17.249 771 HG LEU 118 HG LEU 118 8.043 -17.524 -18.081 772 HD11 LEU 118 1HD1 LEU 118 9.873 -17.249 -16.381 773 HD12 LEU 118 2HD1 LEU 118 8.779 -17.978 -15.179 774 HD13 LEU 118 3HD1 LEU 118 9.286 -18.905 -16.592 775 HD21 LEU 118 3HD2 LEU 118 6.844 -19.306 -16.813 776 HD22 LEU 118 1HD2 LEU 118 6.255 -18.072 -15.685 777 HD23 LEU 118 2HD2 LEU 118 5.788 -18.012 -17.390 778 H GLU 119 H GLU 119 8.809 -13.307 -15.496 779 HA GLU 119 HA GLU 119 11.212 -14.258 -14.182 780 HB3 GLU 119 2HB GLU 119 11.795 -11.794 -14.221 781 HG3 GLU 119 2HG GLU 119 11.058 -11.709 -16.905 782 H GLY 120 H GLY 120 8.292 -12.732 -12.991 783 HA2 GLY 120 2HA GLY 120 9.387 -12.456 -10.218 784 H LEU 121 H LEU 121 8.267 -14.895 -11.305 785 HA LEU 121 HA LEU 121 5.523 -15.248 -10.835 786 HB3 LEU 121 2HB LEU 121 7.076 -17.695 -10.336 787 HG LEU 121 HG LEU 121 5.499 -16.707 -12.758 788 HD11 LEU 121 1HD1 LEU 121 7.248 -18.270 -13.450 789 HD12 LEU 121 2HD1 LEU 121 6.744 -19.439 -12.216 790 HD13 LEU 121 3HD1 LEU 121 5.657 -19.036 -13.564 791 HD21 LEU 121 3HD2 LEU 121 3.846 -18.389 -12.060 792 HD22 LEU 121 1HD2 LEU 121 4.846 -18.833 -10.660 793 HD23 LEU 121 2HD2 LEU 121 4.107 -17.220 -10.760 794 H ASP 122 H ASP 122 8.215 -15.529 -8.686 795 HA ASP 122 HA ASP 122 6.430 -15.548 -6.298 796 HB3 ASP 122 2HB ASP 122 9.030 -17.121 -6.572 797 H ASN 123 H ASN 123 9.605 -14.800 -7.749 798 HA ASN 123 HA ASN 123 10.704 -13.177 -5.744 799 HB3 ASN 123 2HB ASN 123 11.947 -12.058 -7.597 800 HD21 ASN 123 2HD2 ASN 123 13.290 -13.319 -9.405 801 HD22 ASN 123 1HD2 ASN 123 13.953 -14.831 -8.797 802 H GLN 124 H GLN 124 10.902 -10.967 -5.519 803 HA GLN 124 HA GLN 124 8.476 -9.412 -6.026 804 HB3 GLN 124 2HB GLN 124 9.468 -9.511 -3.829 805 HG3 GLN 124 2HG GLN 124 11.466 -7.771 -3.519 806 HE21 GLN 124 2HE2 GLN 124 13.296 -10.203 -5.010 807 HE22 GLN 124 1HE2 GLN 124 13.322 -11.309 -3.646 808 H GLU 125 H GLU 125 8.965 -9.676 -8.462 809 HA GLU 125 HA GLU 125 10.290 -7.179 -9.425 810 HB3 GLU 125 2HB GLU 125 11.373 -8.480 -11.275 811 HG3 GLU 125 2HG GLU 125 12.333 -8.758 -8.448 812 H GLY 126 H GLY 126 9.672 -6.626 -11.664 813 HA2 GLY 126 2HA GLY 126 8.126 -6.318 -13.334 814 H GLY 127 H GLY 127 5.387 -7.513 -13.200 815 HA2 GLY 127 2HA GLY 127 3.650 -7.573 -11.421 816 H VAL 128 H VAL 128 1.609 -6.205 -11.314 817 HA VAL 128 HA VAL 128 0.693 -5.528 -13.982 818 HB VAL 128 HB VAL 128 -1.250 -4.509 -12.747 819 HG11 VAL 128 1HG1 VAL 128 -1.308 -6.779 -13.722 820 HG12 VAL 128 2HG1 VAL 128 -0.986 -7.389 -12.080 821 HG13 VAL 128 3HG1 VAL 128 -2.433 -6.455 -12.396 822 HG21 VAL 128 3HG2 VAL 128 -1.623 -4.981 -10.431 823 HG22 VAL 128 1HG2 VAL 128 -0.080 -5.862 -10.313 824 HG23 VAL 128 2HG2 VAL 128 -0.079 -4.124 -10.606 825 H CYS 129 H CYS 129 2.380 -3.718 -11.559 826 HA CYS 129 HA CYS 129 1.977 -1.088 -12.134 827 HB3 CYS 129 2HB CYS 129 4.343 -2.747 -11.451 828 H GLN 130 H GLN 130 3.416 -3.430 -14.405 829 HA GLN 130 HA GLN 130 4.607 -1.694 -16.240 830 HB3 GLN 130 2HB GLN 130 3.612 -3.654 -17.878 831 HG3 GLN 130 2HG GLN 130 5.867 -4.308 -15.959 832 HE21 GLN 130 2HE2 GLN 130 7.216 -4.074 -18.885 833 HE22 GLN 130 1HE2 GLN 130 6.842 -5.657 -19.555 834 H THR 131 H THR 131 1.159 -2.371 -15.930 835 HA THR 131 HA THR 131 0.562 -0.299 -18.018 836 HB THR 131 HB THR 131 -0.669 -3.080 -17.974 837 HG1 THR 131 1HG THR 131 0.318 -3.232 -19.996 838 HG21 THR 131 3HG2 THR 131 -1.787 -2.340 -20.083 839 HG22 THR 131 1HG2 THR 131 -2.348 -1.407 -18.694 840 HG23 THR 131 2HG2 THR 131 -1.168 -0.694 -19.815 841 H ARG 132 H ARG 132 -0.896 -2.478 -15.518 842 HA ARG 132 HA ARG 132 -3.205 -0.756 -15.044 843 HB3 ARG 132 2HB ARG 132 -3.422 -1.986 -12.903 844 HG3 ARG 132 2HG ARG 132 -3.299 -4.404 -13.596 845 HD3 ARG 132 2HD ARG 132 -5.322 -2.895 -13.761 846 HE ARG 132 HE ARG 132 -4.322 -2.551 -16.490 847 HH11 ARG 132 1HH2 ARG 132 -7.253 -2.660 -14.590 848 HH12 ARG 132 2HH2 ARG 132 -8.206 -1.876 -15.820 849 HH21 ARG 132 1HH1 ARG 132 -5.595 -1.562 -18.045 850 HH22 ARG 132 2HH1 ARG 132 -7.277 -1.276 -17.729 851 H ALA 133 H ALA 133 0.114 -0.503 -14.168 852 HA ALA 133 HA ALA 133 1.302 0.690 -12.634 853 HB1 ALA 133 3HB ALA 133 0.699 3.105 -12.565 854 HB2 ALA 133 1HB ALA 133 0.921 2.368 -14.163 855 HB3 ALA 133 2HB ALA 133 -0.704 2.690 -13.578 856 H MET 134 H MET 134 -0.032 -1.145 -11.219 857 HA MET 134 HA MET 134 -1.514 -0.076 -9.007 858 HB3 MET 134 2HB MET 134 0.060 -2.663 -8.978 859 HG3 MET 134 2HG MET 134 -2.468 -1.660 -7.618 860 HE1 MET 134 3HE MET 134 -4.208 -4.653 -6.270 861 HE2 MET 134 1HE MET 134 -3.410 -3.252 -5.515 862 HE3 MET 134 2HE MET 134 -4.353 -3.047 -7.010 863 H LYS 135 H LYS 135 -0.353 1.700 -8.457 864 HA LYS 135 HA LYS 135 1.609 1.291 -6.286 865 HB3 LYS 135 2HB LYS 135 3.038 1.900 -8.028 866 HG3 LYS 135 2HG LYS 135 2.069 4.601 -8.698 867 HD3 LYS 135 2HD LYS 135 2.675 2.462 -10.738 868 HE3 LYS 135 2HE LYS 135 3.982 5.187 -10.400 869 HZ1 LYS 135 3HZ LYS 135 4.503 4.926 -12.713 870 HZ2 LYS 135 1HZ LYS 135 4.859 3.497 -12.015 871 HZ3 LYS 135 2HZ LYS 135 3.494 3.661 -12.897 872 H ILE 136 H ILE 136 1.755 3.416 -5.010 873 HA ILE 136 HA ILE 136 -0.654 5.028 -5.170 874 HB ILE 136 HB ILE 136 -1.297 5.014 -2.874 875 HG13 ILE 136 2HG1 ILE 136 1.065 4.245 -2.018 876 HG21 ILE 136 1HG2 ILE 136 -2.320 3.326 -4.385 877 HG22 ILE 136 2HG2 ILE 136 -1.182 2.108 -3.796 878 HG23 ILE 136 3HG2 ILE 136 -2.358 2.834 -2.680 879 HD11 ILE 136 3HD1 ILE 136 0.102 3.492 0.131 880 HD12 ILE 136 1HD1 ILE 136 -0.480 5.045 -0.462 881 HD13 ILE 136 2HD1 ILE 136 -1.515 3.598 -0.593 882 H LEU 137 H LEU 137 -0.528 7.032 -4.046 883 HA LEU 137 HA LEU 137 2.273 7.862 -3.447 884 HB3 LEU 137 2HB LEU 137 1.177 10.164 -4.430 885 HG LEU 137 HG LEU 137 2.608 7.973 -5.990 886 HD11 LEU 137 1HD1 LEU 137 1.313 9.520 -7.487 887 HD12 LEU 137 2HD1 LEU 137 2.257 10.879 -6.841 888 HD13 LEU 137 3HD1 LEU 137 3.061 9.561 -7.724 889 HD21 LEU 137 3HD2 LEU 137 4.484 9.690 -5.766 890 HD22 LEU 137 1HD2 LEU 137 3.508 10.525 -4.573 891 HD23 LEU 137 2HD2 LEU 137 4.047 8.855 -4.290 892 H MET 138 H MET 138 2.626 8.829 -1.707 893 HA MET 138 HA MET 138 0.436 10.032 -0.054 894 HB3 MET 138 2HB MET 138 1.554 9.023 1.921 895 HG3 MET 138 2HG MET 138 0.771 7.003 -0.215 896 HE1 MET 138 3HE MET 138 0.386 5.940 4.237 897 HE2 MET 138 1HE MET 138 1.155 7.490 3.833 898 HE3 MET 138 2HE MET 138 -0.517 7.169 3.325 899 H LYS 139 H LYS 139 0.984 12.095 -0.618 900 HA LYS 139 HA LYS 139 3.695 13.162 -0.277 901 HB3 LYS 139 2HB LYS 139 1.967 15.311 0.013 902 HG3 LYS 139 2HG LYS 139 2.928 14.125 -2.606 903 HD3 LYS 139 2HD LYS 139 1.689 16.744 -1.809 904 HE3 LYS 139 2HE LYS 139 4.058 16.514 -3.716 905 HZ1 LYS 139 3HZ LYS 139 3.691 18.924 -3.933 906 HZ2 LYS 139 1HZ LYS 139 2.398 18.104 -4.496 907 HZ3 LYS 139 2HZ LYS 139 2.330 18.840 -3.036 908 H VAL 140 H VAL 140 4.572 14.123 1.463 909 HA VAL 140 HA VAL 140 2.991 14.334 3.982 910 HB VAL 140 HB VAL 140 5.773 13.122 3.926 911 HG11 VAL 140 1HG1 VAL 140 4.827 14.220 6.036 912 HG12 VAL 140 2HG1 VAL 140 3.565 12.974 6.025 913 HG13 VAL 140 3HG1 VAL 140 5.283 12.524 6.169 914 HG21 VAL 140 3HG2 VAL 140 4.728 10.928 4.395 915 HG22 VAL 140 1HG2 VAL 140 3.125 11.603 4.039 916 HG23 VAL 140 2HG2 VAL 140 4.368 11.486 2.769 917 H GLY 141 H GLY 141 2.916 16.494 4.052 918 HA2 GLY 141 2HA GLY 141 4.792 18.068 5.203 919 H GLN 142 H GLN 142 3.370 18.816 2.019 920 HA GLN 142 HA GLN 142 1.529 20.835 3.256 921 HB3 GLN 142 2HB GLN 142 1.633 21.742 0.793 922 HG3 GLN 142 2HG GLN 142 4.239 22.466 1.964 923 HE21 GLN 142 2HE2 GLN 142 1.445 24.331 2.901 924 HE22 GLN 142 1HE2 GLN 142 1.510 25.486 1.575 Start of MODEL 5 1 H1 SER 1 H SER 1 -13.061 18.581 10.160 2 HA SER 1 HA SER 1 -12.804 18.927 12.973 3 HB3 SER 1 2HB SER 1 -14.101 16.937 13.781 4 HG SER 1 HG SER 1 -16.015 18.113 13.848 5 H LYS 2 H LYS 2 -11.452 17.327 13.968 6 HA LYS 2 HA LYS 2 -9.705 15.746 12.303 7 HB3 LYS 2 2HB LYS 2 -9.895 14.810 15.069 8 HG3 LYS 2 2HG LYS 2 -7.849 15.009 13.346 9 HD3 LYS 2 2HD LYS 2 -7.539 17.469 15.126 10 HE3 LYS 2 2HE LYS 2 -5.800 16.635 12.776 11 HZ1 LYS 2 3HZ LYS 2 -4.191 18.005 13.949 12 HZ2 LYS 2 1HZ LYS 2 -5.544 18.896 13.733 13 HZ3 LYS 2 2HZ LYS 2 -5.206 18.256 15.198 14 H SER 3 H SER 3 -9.420 13.369 12.659 15 HA SER 3 HA SER 3 -10.054 11.358 11.956 16 HB3 SER 3 2HB SER 3 -10.316 11.014 14.277 17 HG SER 3 HG SER 3 -12.497 10.913 15.144 18 H ILE 4 H ILE 4 -10.564 12.018 9.915 19 HA ILE 4 HA ILE 4 -13.434 12.162 9.153 20 HB ILE 4 HB ILE 4 -12.202 12.793 6.867 21 HG13 ILE 4 2HG1 ILE 4 -10.273 13.999 6.944 22 HG21 ILE 4 1HG2 ILE 4 -13.958 14.052 7.883 23 HG22 ILE 4 2HG2 ILE 4 -12.868 14.672 9.141 24 HG23 ILE 4 3HG2 ILE 4 -12.643 15.148 7.438 25 HD11 ILE 4 3HD1 ILE 4 -8.973 14.664 8.918 26 HD12 ILE 4 1HD1 ILE 4 -10.525 15.498 8.848 27 HD13 ILE 4 2HD1 ILE 4 -10.286 14.161 9.988 28 H VAL 5 H VAL 5 -10.526 10.328 8.257 29 HA VAL 5 HA VAL 5 -10.210 8.276 7.408 30 HB VAL 5 HB VAL 5 -13.112 7.529 7.827 31 HG11 VAL 5 1HG1 VAL 5 -11.500 5.916 6.732 32 HG12 VAL 5 2HG1 VAL 5 -10.578 5.915 8.250 33 HG13 VAL 5 3HG1 VAL 5 -12.250 5.334 8.227 34 HG21 VAL 5 3HG2 VAL 5 -12.409 6.797 10.148 35 HG22 VAL 5 1HG2 VAL 5 -11.029 7.904 9.977 36 HG23 VAL 5 2HG2 VAL 5 -12.683 8.520 9.910 37 H LEU 6 H LEU 6 -9.678 8.726 5.244 38 HA LEU 6 HA LEU 6 -11.479 9.535 3.321 39 HB3 LEU 6 2HB LEU 6 -9.183 7.793 2.445 40 HG LEU 6 HG LEU 6 -8.642 9.567 0.929 41 HD11 LEU 6 1HD1 LEU 6 -10.460 7.994 0.213 42 HD12 LEU 6 2HD1 LEU 6 -11.651 9.228 0.689 43 HD13 LEU 6 3HD1 LEU 6 -10.481 9.571 -0.596 44 HD21 LEU 6 3HD2 LEU 6 -9.869 11.639 0.710 45 HD22 LEU 6 1HD2 LEU 6 -10.981 11.189 2.011 46 HD23 LEU 6 2HD2 LEU 6 -9.270 11.487 2.374 47 H GLU 7 H GLU 7 -10.371 6.145 3.634 48 HA GLU 7 HA GLU 7 -12.803 4.881 3.786 49 HB3 GLU 7 2HB GLU 7 -12.381 3.861 1.177 50 HG3 GLU 7 2HG GLU 7 -14.473 5.585 2.474 51 HA PRO 8 HA PRO 8 -9.943 1.511 4.366 52 HB3 PRO 8 2HB PRO 8 -11.515 0.264 5.464 53 HG3 PRO 8 2HG PRO 8 -13.760 0.557 4.983 54 HD3 PRO 8 2HD PRO 8 -13.400 2.806 4.644 55 H ILE 9 H ILE 9 -8.743 -0.110 3.266 56 HA ILE 9 HA ILE 9 -8.794 0.123 0.297 57 HB ILE 9 HB ILE 9 -6.825 -1.462 1.944 58 HG13 ILE 9 2HG1 ILE 9 -5.254 0.407 1.812 59 HG21 ILE 9 1HG2 ILE 9 -6.822 -2.118 -0.350 60 HG22 ILE 9 2HG2 ILE 9 -6.749 -0.427 -0.886 61 HG23 ILE 9 3HG2 ILE 9 -5.373 -1.159 -0.044 62 HD11 ILE 9 3HD1 ILE 9 -6.059 2.714 1.410 63 HD12 ILE 9 1HD1 ILE 9 -6.057 1.734 -0.066 64 HD13 ILE 9 2HD1 ILE 9 -7.588 2.080 0.778 65 H TYR 10 H TYR 10 -10.028 -1.247 -0.821 66 HA TYR 10 HA TYR 10 -11.039 -3.736 0.375 67 HB3 TYR 10 2HB TYR 10 -11.694 -2.783 -2.382 68 HD1 TYR 10 2HD TYR 10 -13.632 -3.165 0.788 69 HD2 TYR 10 1HD TYR 10 -12.920 -4.635 -3.205 70 HE1 TYR 10 2HE TYR 10 -15.688 -4.562 0.938 71 HE2 TYR 10 1HE TYR 10 -15.008 -5.988 -3.073 72 HH TYR 10 HH TYR 10 -17.081 -6.021 -0.151 73 H TRP 11 H TRP 11 -8.808 -4.467 0.476 74 HA TRP 11 HA TRP 11 -7.227 -5.958 0.007 75 HB3 TRP 11 2HB TRP 11 -7.699 -7.805 -1.212 76 HD1 TRP 11 HD TRP 11 -9.917 -6.860 0.845 77 HE1 TRP 11 1HE TRP 11 -12.391 -7.462 0.560 78 HE3 TRP 11 3HE TRP 11 -9.953 -7.766 -4.202 79 HZ2 TRP 11 2HZ TRP 11 -14.147 -8.298 -1.563 80 HZ3 TRP 11 3HZ TRP 11 -12.084 -8.354 -5.341 81 HH2 TRP 11 HH TRP 11 -14.177 -8.641 -4.035 82 H ASN 12 H ASN 12 -8.036 -4.765 -3.190 83 HA ASN 12 HA ASN 12 -6.227 -2.725 -3.428 84 HB3 ASN 12 2HB ASN 12 -4.944 -4.498 -5.382 85 HD21 ASN 12 2HD2 ASN 12 -2.503 -4.906 -4.279 86 HD22 ASN 12 1HD2 ASN 12 -1.823 -3.370 -3.767 87 H SER 13 H SER 13 -7.883 -5.332 -5.104 88 HA SER 13 HA SER 13 -8.078 -4.332 -7.695 89 HB3 SER 13 2HB SER 13 -10.441 -5.784 -6.528 90 HG SER 13 HG SER 13 -9.982 -7.035 -8.452 91 H SER 14 H SER 14 -10.091 -3.506 -4.905 92 HA SER 14 HA SER 14 -11.244 -1.249 -6.481 93 HB3 SER 14 2HB SER 14 -12.684 -2.098 -4.019 94 HG SER 14 HG SER 14 -14.423 -1.533 -5.409 95 H ASN 15 H ASN 15 -10.645 0.672 -5.785 96 HA ASN 15 HA ASN 15 -9.405 1.010 -3.081 97 HB3 ASN 15 2HB ASN 15 -8.135 2.906 -4.561 98 HD21 ASN 15 2HD2 ASN 15 -6.261 0.976 -6.103 99 HD22 ASN 15 1HD2 ASN 15 -5.387 0.221 -4.782 100 H SER 16 H SER 16 -9.582 3.257 -2.241 101 HA SER 16 HA SER 16 -12.273 4.165 -2.315 102 HB3 SER 16 2HB SER 16 -10.743 4.611 -0.466 103 HG SER 16 HG SER 16 -9.196 6.345 -0.792 104 H LYS 17 H LYS 17 -9.399 5.427 -3.956 105 HA LYS 17 HA LYS 17 -10.815 7.446 -5.450 106 HB3 LYS 17 2HB LYS 17 -8.104 6.360 -6.253 107 HG3 LYS 17 2HG LYS 17 -9.099 8.419 -7.380 108 HD3 LYS 17 2HD LYS 17 -8.424 10.477 -5.713 109 HE3 LYS 17 2HE LYS 17 -11.179 9.882 -5.072 110 HZ1 LYS 17 3HZ LYS 17 -11.552 11.723 -6.628 111 HZ2 LYS 17 1HZ LYS 17 -10.321 12.090 -5.623 112 HZ3 LYS 17 2HZ LYS 17 -10.015 11.643 -7.167 113 H PHE 18 H PHE 18 -10.068 4.120 -6.148 114 HA PHE 18 HA PHE 18 -10.203 2.815 -8.049 115 HB3 PHE 18 2HB PHE 18 -12.906 4.099 -7.673 116 HD1 PHE 18 1HD PHE 18 -11.406 0.886 -9.041 117 HD2 PHE 18 2HD PHE 18 -14.572 3.805 -9.245 118 HE1 PHE 18 1HE PHE 18 -12.405 -0.322 -10.964 119 HE2 PHE 18 2HE PHE 18 -15.571 2.591 -11.158 120 HZ PHE 18 HZ PHE 18 -14.480 0.534 -12.034 121 H LEU 19 H LEU 19 -8.569 4.490 -9.036 122 HA LEU 19 HA LEU 19 -9.758 5.703 -11.480 123 HB3 LEU 19 2HB LEU 19 -7.351 7.065 -10.527 124 HG LEU 19 HG LEU 19 -10.245 7.763 -11.181 125 HD11 LEU 19 1HD1 LEU 19 -9.734 9.188 -9.341 126 HD12 LEU 19 2HD1 LEU 19 -8.143 9.617 -10.030 127 HD13 LEU 19 3HD1 LEU 19 -9.653 10.143 -10.822 128 HD21 LEU 19 3HD2 LEU 19 -9.252 9.092 -12.960 129 HD22 LEU 19 1HD2 LEU 19 -7.615 8.726 -12.376 130 HD23 LEU 19 2HD2 LEU 19 -8.626 7.439 -13.072 131 HA PRO 20 HA PRO 20 -6.928 2.650 -13.216 132 HB3 PRO 20 2HB PRO 20 -8.666 1.840 -14.453 133 HG3 PRO 20 2HG PRO 20 -10.432 3.232 -15.165 134 HD3 PRO 20 2HD PRO 20 -10.302 3.843 -12.911 135 H GLY 21 H GLY 21 -4.930 3.414 -13.230 136 HA2 GLY 21 2HA GLY 21 -3.437 4.545 -15.220 137 H GLN 22 H GLN 22 -3.052 6.782 -12.718 138 HA GLN 22 HA GLN 22 -0.642 5.672 -11.708 139 HB3 GLN 22 2HB GLN 22 -1.019 7.340 -9.806 140 HG3 GLN 22 2HG GLN 22 -1.193 8.426 -12.643 141 HE21 GLN 22 2HE2 GLN 22 -1.489 10.670 -12.558 142 HE22 GLN 22 1HE2 GLN 22 -0.940 11.671 -11.224 143 H GLY 23 H GLY 23 -3.931 4.975 -10.613 144 HA2 GLY 23 2HA GLY 23 -4.165 2.749 -9.647 145 H LEU 24 H LEU 24 -3.024 4.583 -6.857 146 HA LEU 24 HA LEU 24 -5.775 5.432 -6.082 147 HB3 LEU 24 2HB LEU 24 -3.896 3.651 -4.552 148 HG LEU 24 HG LEU 24 -4.523 5.569 -2.997 149 HD11 LEU 24 1HD1 LEU 24 -6.904 5.787 -3.814 150 HD12 LEU 24 2HD1 LEU 24 -7.246 4.229 -3.022 151 HD13 LEU 24 3HD1 LEU 24 -6.732 5.617 -2.063 152 HD21 LEU 24 3HD2 LEU 24 -5.240 3.973 -1.159 153 HD22 LEU 24 1HD2 LEU 24 -5.308 2.702 -2.391 154 HD23 LEU 24 2HD2 LEU 24 -3.774 3.523 -2.031 155 H VAL 25 H VAL 25 -5.861 7.402 -5.139 156 HA VAL 25 HA VAL 25 -3.307 8.919 -4.670 157 HB VAL 25 HB VAL 25 -6.038 9.879 -5.590 158 HG11 VAL 25 1HG1 VAL 25 -5.182 11.544 -4.047 159 HG12 VAL 25 2HG1 VAL 25 -3.590 11.518 -4.844 160 HG13 VAL 25 3HG1 VAL 25 -5.024 12.139 -5.698 161 HG21 VAL 25 3HG2 VAL 25 -4.821 10.671 -7.582 162 HG22 VAL 25 1HG2 VAL 25 -3.306 10.002 -6.932 163 HG23 VAL 25 2HG2 VAL 25 -4.639 8.922 -7.399 164 H LEU 26 H LEU 26 -2.953 9.470 -2.611 165 HA LEU 26 HA LEU 26 -5.228 9.391 -0.701 166 HB3 LEU 26 2HB LEU 26 -3.079 9.692 0.900 167 HG LEU 26 HG LEU 26 -2.868 7.255 1.138 168 HD11 LEU 26 1HD1 LEU 26 -4.664 8.352 2.332 169 HD12 LEU 26 2HD1 LEU 26 -5.749 8.266 0.933 170 HD13 LEU 26 3HD1 LEU 26 -5.236 6.785 1.706 171 HD21 LEU 26 3HD2 LEU 26 -4.070 5.693 -0.151 172 HD22 LEU 26 1HD2 LEU 26 -4.964 6.955 -1.027 173 HD23 LEU 26 2HD2 LEU 26 -3.232 6.728 -1.328 174 H TYR 27 H TYR 27 -5.587 10.935 0.778 175 HA TYR 27 HA TYR 27 -5.259 13.656 -0.195 176 HB3 TYR 27 2HB TYR 27 -6.527 13.538 2.390 177 HD1 TYR 27 1HD TYR 27 -8.122 12.658 -0.862 178 HD2 TYR 27 2HD TYR 27 -7.108 15.814 1.899 179 HE1 TYR 27 1HE TYR 27 -9.580 14.239 -2.127 180 HE2 TYR 27 2HE TYR 27 -8.556 17.392 0.632 181 HH TYR 27 HH TYR 27 -9.963 17.666 -1.152 182 HA PRO 28 HA PRO 28 -1.702 14.168 2.616 183 HB3 PRO 28 2HB PRO 28 -0.547 15.009 0.867 184 HG3 PRO 28 2HG PRO 28 -1.564 16.111 -0.900 185 HD3 PRO 28 2HD PRO 28 -3.111 14.430 -0.790 186 H GLN 29 H GLN 29 -3.597 14.240 4.181 187 HA GLN 29 HA GLN 29 -3.690 16.893 5.515 188 HB3 GLN 29 2HB GLN 29 -6.276 15.899 5.874 189 HG3 GLN 29 2HG GLN 29 -6.907 17.650 4.150 190 HE21 GLN 29 2HE2 GLN 29 -4.004 19.188 5.434 191 HE22 GLN 29 1HE2 GLN 29 -4.802 19.849 6.855 192 H ILE 30 H ILE 30 -3.048 16.814 7.416 193 HA ILE 30 HA ILE 30 -2.650 14.420 8.991 194 HB ILE 30 HB ILE 30 -2.291 17.371 9.607 195 HG13 ILE 30 2HG1 ILE 30 0.104 17.012 9.208 196 HG21 ILE 30 1HG2 ILE 30 -2.430 16.056 11.701 197 HG22 ILE 30 2HG2 ILE 30 -1.117 15.020 11.114 198 HG23 ILE 30 3HG2 ILE 30 -0.817 16.728 11.429 199 HD11 ILE 30 3HD1 ILE 30 0.933 15.158 7.884 200 HD12 ILE 30 1HD1 ILE 30 0.375 14.555 9.442 201 HD13 ILE 30 2HD1 ILE 30 -0.617 14.314 7.977 202 H GLY 31 H GLY 31 -4.363 13.437 9.821 203 HA2 GLY 31 2HA GLY 31 -5.909 13.808 11.913 204 H ASP 32 H ASP 32 -6.016 13.051 8.518 205 HA ASP 32 HA ASP 32 -8.357 11.272 8.718 206 HB3 ASP 32 2HB ASP 32 -6.427 11.679 6.407 207 H LYS 33 H LYS 33 -7.976 8.976 7.753 208 HA LYS 33 HA LYS 33 -5.592 7.578 8.525 209 HB3 LYS 33 2HB LYS 33 -6.419 7.862 10.805 210 HG3 LYS 33 2HG LYS 33 -9.040 6.785 9.793 211 HD3 LYS 33 2HD LYS 33 -9.149 7.584 12.549 212 HE3 LYS 33 2HE LYS 33 -10.346 5.709 10.904 213 HZ1 LYS 33 3HZ LYS 33 -10.001 3.602 11.943 214 HZ2 LYS 33 1HZ LYS 33 -8.516 4.122 11.488 215 HZ3 LYS 33 2HZ LYS 33 -8.973 4.204 13.058 216 H LEU 34 H LEU 34 -5.587 5.425 7.889 217 HA LEU 34 HA LEU 34 -7.803 4.636 6.050 218 HB3 LEU 34 2HB LEU 34 -6.157 3.937 4.431 219 HG LEU 34 HG LEU 34 -5.173 5.818 3.562 220 HD11 LEU 34 1HD1 LEU 34 -7.603 5.835 3.340 221 HD12 LEU 34 2HD1 LEU 34 -7.760 6.785 4.833 222 HD13 LEU 34 3HD1 LEU 34 -6.968 7.492 3.425 223 HD21 LEU 34 3HD2 LEU 34 -4.785 7.937 4.500 224 HD22 LEU 34 1HD2 LEU 34 -5.581 7.548 6.001 225 HD23 LEU 34 2HD2 LEU 34 -4.056 6.735 5.571 226 H ASP 35 H ASP 35 -8.485 2.648 6.313 227 HA ASP 35 HA ASP 35 -6.890 0.673 7.857 228 HB3 ASP 35 2HB ASP 35 -8.641 0.712 9.156 229 H ILE 36 H ILE 36 -5.729 -0.434 6.412 230 HA ILE 36 HA ILE 36 -6.956 -1.470 3.959 231 HB ILE 36 HB ILE 36 -4.707 -0.851 3.695 232 HG13 ILE 36 2HG1 ILE 36 -5.586 -3.167 2.779 233 HG21 ILE 36 1HG2 ILE 36 -3.772 -0.815 5.902 234 HG22 ILE 36 2HG2 ILE 36 -3.986 -2.571 6.085 235 HG23 ILE 36 3HG2 ILE 36 -2.794 -1.921 4.949 236 HD11 ILE 36 3HD1 ILE 36 -3.448 -3.593 1.649 237 HD12 ILE 36 1HD1 ILE 36 -3.868 -1.872 1.635 238 HD13 ILE 36 2HD1 ILE 36 -2.624 -2.464 2.749 239 H ILE 37 H ILE 37 -7.958 -3.309 3.723 240 HA ILE 37 HA ILE 37 -7.769 -5.453 5.780 241 HB ILE 37 HB ILE 37 -10.249 -4.098 4.689 242 HG13 ILE 37 2HG1 ILE 37 -9.126 -3.388 6.895 243 HG21 ILE 37 1HG2 ILE 37 -10.668 -6.481 4.307 244 HG22 ILE 37 2HG2 ILE 37 -10.096 -6.879 5.948 245 HG23 ILE 37 3HG2 ILE 37 -11.601 -5.971 5.695 246 HD11 ILE 37 3HD1 ILE 37 -11.158 -3.197 8.186 247 HD12 ILE 37 1HD1 ILE 37 -11.488 -2.845 6.477 248 HD13 ILE 37 2HD1 ILE 37 -11.977 -4.405 7.186 249 H CYS 38 H CYS 38 -7.554 -7.429 4.927 250 HA CYS 38 HA CYS 38 -8.285 -7.901 2.081 251 HB3 CYS 38 2HB CYS 38 -6.208 -8.985 1.634 252 HA PRO 39 HA PRO 39 -9.928 -11.563 4.222 253 HB3 PRO 39 2HB PRO 39 -11.798 -11.304 2.856 254 HG3 PRO 39 2HG PRO 39 -11.606 -10.564 0.610 255 HD3 PRO 39 2HD PRO 39 -10.466 -8.932 1.838 256 H LYS 40 H LYS 40 -9.615 -13.917 4.104 257 HA LYS 40 HA LYS 40 -6.960 -14.649 3.029 258 HB3 LYS 40 2HB LYS 40 -8.907 -16.383 4.614 259 HG3 LYS 40 2HG LYS 40 -6.623 -17.222 5.469 260 HD3 LYS 40 2HD LYS 40 -8.132 -18.292 3.345 261 HE3 LYS 40 2HE LYS 40 -5.325 -17.723 2.491 262 HZ1 LYS 40 3HZ LYS 40 -5.151 -19.897 1.390 263 HZ2 LYS 40 1HZ LYS 40 -5.170 -20.125 3.020 264 HZ3 LYS 40 2HZ LYS 40 -6.496 -20.431 2.186 265 H VAL 41 H VAL 41 -10.313 -15.712 2.615 266 HA VAL 41 HA VAL 41 -11.459 -16.702 0.927 267 HB VAL 41 HB VAL 41 -9.086 -16.333 -0.898 268 HG11 VAL 41 1HG1 VAL 41 -11.221 -17.796 -1.515 269 HG12 VAL 41 2HG1 VAL 41 -11.888 -16.161 -1.806 270 HG13 VAL 41 3HG1 VAL 41 -10.463 -16.698 -2.683 271 HG21 VAL 41 3HG2 VAL 41 -10.369 -14.219 -1.590 272 HG22 VAL 41 1HG2 VAL 41 -11.348 -14.448 -0.139 273 HG23 VAL 41 2HG2 VAL 41 -9.601 -14.126 0.000 274 H ASP 42 H ASP 42 -11.918 -18.772 1.336 275 HA ASP 42 HA ASP 42 -10.414 -20.977 0.273 276 HB3 ASP 42 2HB ASP 42 -10.394 -21.956 2.872 277 H SER 43 H SER 43 -12.317 -20.919 3.290 278 HA SER 43 HA SER 43 -14.171 -22.927 2.324 279 HB3 SER 43 2HB SER 43 -13.964 -21.232 4.833 280 HG SER 43 HG SER 43 -15.523 -22.668 5.695 281 H LYS 44 H LYS 44 -14.334 -19.421 2.774 282 HA LYS 44 HA LYS 44 -17.161 -19.103 2.284 283 HB3 LYS 44 2HB LYS 44 -16.513 -16.662 2.059 284 HG3 LYS 44 2HG LYS 44 -15.509 -16.371 4.314 285 HD3 LYS 44 2HD LYS 44 -18.062 -17.558 3.760 286 HE3 LYS 44 2HE LYS 44 -16.635 -18.660 6.221 287 HZ1 LYS 44 3HZ LYS 44 -18.841 -19.443 6.870 288 HZ2 LYS 44 1HZ LYS 44 -18.831 -17.814 6.823 289 HZ3 LYS 44 2HZ LYS 44 -19.548 -18.660 5.623 290 H THR 45 H THR 45 -14.360 -18.772 0.139 291 HA THR 45 HA THR 45 -16.178 -18.618 -2.224 292 HB THR 45 HB THR 45 -13.649 -17.250 -1.621 293 HG1 THR 45 1HG THR 45 -14.835 -15.541 -2.561 294 HG21 THR 45 3HG2 THR 45 -13.522 -16.448 -4.020 295 HG22 THR 45 1HG2 THR 45 -12.970 -18.101 -3.772 296 HG23 THR 45 2HG2 THR 45 -14.598 -17.809 -4.453 297 H VAL 46 H VAL 46 -12.722 -19.556 -1.847 298 HA VAL 46 HA VAL 46 -13.127 -22.293 -2.264 299 HB VAL 46 HB VAL 46 -13.806 -21.234 -4.626 300 HG11 VAL 46 1HG1 VAL 46 -11.677 -20.083 -5.016 301 HG12 VAL 46 2HG1 VAL 46 -10.866 -21.680 -5.092 302 HG13 VAL 46 3HG1 VAL 46 -12.115 -21.250 -6.274 303 HG21 VAL 46 3HG2 VAL 46 -13.254 -23.345 -5.680 304 HG22 VAL 46 1HG2 VAL 46 -12.180 -23.763 -4.323 305 HG23 VAL 46 2HG2 VAL 46 -13.932 -23.575 -4.061 306 H GLY 47 H GLY 47 -10.829 -19.616 -2.812 307 HA2 GLY 47 2HA GLY 47 -8.823 -19.621 -1.417 308 H GLN 48 H GLN 48 -9.119 -18.564 -3.953 309 HA GLN 48 HA GLN 48 -6.429 -18.742 -5.051 310 HB3 GLN 48 2HB GLN 48 -7.302 -20.714 -6.094 311 HG3 GLN 48 2HG GLN 48 -9.807 -19.459 -6.136 312 HE21 GLN 48 2HE2 GLN 48 -11.332 -18.751 -7.618 313 HE22 GLN 48 1HE2 GLN 48 -10.989 -18.610 -9.333 314 H TYR 49 H TYR 49 -7.917 -16.584 -3.924 315 HA TYR 49 HA TYR 49 -8.865 -14.867 -6.111 316 HB3 TYR 49 2HB TYR 49 -8.446 -13.503 -3.562 317 HD1 TYR 49 2HD TYR 49 -11.023 -15.395 -5.612 318 HD2 TYR 49 1HD TYR 49 -10.091 -11.841 -3.342 319 HE1 TYR 49 2HE TYR 49 -13.186 -14.392 -6.296 320 HE2 TYR 49 1HE TYR 49 -12.287 -10.875 -3.982 321 HH TYR 49 HH TYR 49 -14.567 -12.567 -6.169 322 H GLU 50 H GLU 50 -5.901 -15.759 -5.703 323 HA GLU 50 HA GLU 50 -3.816 -14.981 -6.045 324 HB3 GLU 50 2HB GLU 50 -4.571 -12.185 -6.789 325 HG3 GLU 50 2HG GLU 50 -2.808 -14.382 -7.857 326 H TYR 51 H TYR 51 -2.374 -12.801 -5.435 327 HA TYR 51 HA TYR 51 -3.142 -11.972 -2.683 328 HB3 TYR 51 2HB TYR 51 -1.417 -13.825 -2.593 329 HD1 TYR 51 1HD TYR 51 0.770 -10.843 -2.754 330 HD2 TYR 51 2HD TYR 51 -0.270 -14.569 -4.667 331 HE1 TYR 51 1HE TYR 51 2.721 -10.617 -4.283 332 HE2 TYR 51 2HE TYR 51 1.743 -14.381 -6.124 333 HH TYR 51 HH TYR 51 3.597 -13.114 -6.668 334 H TYR 52 H TYR 52 -1.799 -10.101 -1.953 335 HA TYR 52 HA TYR 52 -1.052 -8.242 -4.160 336 HB3 TYR 52 2HB TYR 52 -2.382 -6.480 -2.979 337 HD1 TYR 52 2HD TYR 52 -2.981 -6.845 -5.490 338 HD2 TYR 52 1HD TYR 52 -4.971 -8.876 -2.262 339 HE1 TYR 52 2HE TYR 52 -4.906 -7.343 -7.000 340 HE2 TYR 52 1HE TYR 52 -6.897 -9.373 -3.767 341 HH TYR 52 HH TYR 52 -6.921 -8.393 -7.213 342 H LYS 53 H LYS 53 0.539 -6.716 -3.541 343 HA LYS 53 HA LYS 53 1.570 -6.841 -0.749 344 HB3 LYS 53 2HB LYS 53 2.997 -8.423 -1.738 345 HG3 LYS 53 2HG LYS 53 3.280 -6.561 -4.122 346 HD3 LYS 53 2HD LYS 53 5.569 -7.331 -2.918 347 HE3 LYS 53 2HE LYS 53 6.477 -9.194 -4.332 348 HZ1 LYS 53 3HZ LYS 53 5.574 -11.007 -3.059 349 HZ2 LYS 53 1HZ LYS 53 5.741 -9.731 -2.050 350 HZ3 LYS 53 2HZ LYS 53 4.265 -10.152 -2.603 351 H VAL 54 H VAL 54 1.613 -4.869 0.031 352 HA VAL 54 HA VAL 54 2.101 -2.567 -1.842 353 HB VAL 54 HB VAL 54 0.347 -2.948 0.530 354 HG11 VAL 54 1HG1 VAL 54 1.716 -1.243 1.540 355 HG12 VAL 54 2HG1 VAL 54 1.714 -0.276 0.046 356 HG13 VAL 54 3HG1 VAL 54 0.218 -0.508 0.978 357 HG21 VAL 54 3HG2 VAL 54 -1.077 -1.427 -0.788 358 HG22 VAL 54 1HG2 VAL 54 0.249 -1.173 -1.941 359 HG23 VAL 54 2HG2 VAL 54 -0.495 -2.779 -1.777 360 H TYR 55 H TYR 55 4.054 -1.765 -1.868 361 HA TYR 55 HA TYR 55 5.580 -1.509 0.681 362 HB3 TYR 55 2HB TYR 55 6.666 -2.576 -1.954 363 HD1 TYR 55 1HD TYR 55 7.534 -2.112 1.723 364 HD2 TYR 55 2HD TYR 55 8.922 -2.121 -2.351 365 HE1 TYR 55 1HE TYR 55 9.779 -1.318 2.449 366 HE2 TYR 55 2HE TYR 55 11.201 -1.550 -1.587 367 HH TYR 55 HH TYR 55 12.483 -0.877 0.160 368 H MET 56 H MET 56 6.963 0.255 0.777 369 HA MET 56 HA MET 56 6.417 2.471 -1.079 370 HB3 MET 56 2HB MET 56 6.345 3.152 1.153 371 HG3 MET 56 2HG MET 56 8.635 1.301 1.599 372 HE1 MET 56 3HE MET 56 11.489 3.628 2.294 373 HE2 MET 56 1HE MET 56 10.997 1.966 1.894 374 HE3 MET 56 2HE MET 56 10.472 3.320 0.867 375 H VAL 57 H VAL 57 7.718 3.101 -2.698 376 HA VAL 57 HA VAL 57 10.608 2.489 -2.681 377 HB VAL 57 HB VAL 57 10.685 1.554 -4.832 378 HG11 VAL 57 1HG1 VAL 57 10.388 -0.032 -3.036 379 HG12 VAL 57 2HG1 VAL 57 8.632 -0.062 -3.340 380 HG13 VAL 57 3HG1 VAL 57 9.770 -0.646 -4.574 381 HG21 VAL 57 3HG2 VAL 57 8.690 0.838 -6.138 382 HG22 VAL 57 1HG2 VAL 57 7.641 1.647 -4.942 383 HG23 VAL 57 2HG2 VAL 57 8.740 2.581 -5.972 384 H ASP 58 H ASP 58 11.835 3.674 -4.274 385 HA ASP 58 HA ASP 58 10.912 6.327 -4.906 386 HB3 ASP 58 2HB ASP 58 13.008 6.431 -6.231 387 H LYS 59 H LYS 59 10.727 7.271 -7.064 388 HA LYS 59 HA LYS 59 9.062 6.027 -8.970 389 HB3 LYS 59 2HB LYS 59 10.584 7.868 -10.436 390 HG3 LYS 59 2HG LYS 59 8.889 9.578 -9.670 391 HD3 LYS 59 2HD LYS 59 7.534 7.013 -10.592 392 HE3 LYS 59 2HE LYS 59 7.142 10.001 -10.887 393 HZ1 LYS 59 3HZ LYS 59 5.655 9.592 -12.755 394 HZ2 LYS 59 1HZ LYS 59 7.188 9.219 -13.151 395 HZ3 LYS 59 2HZ LYS 59 6.123 8.032 -12.871 396 H ASP 60 H ASP 60 12.558 5.750 -8.697 397 HA ASP 60 HA ASP 60 13.133 4.654 -11.265 398 HB3 ASP 60 2HB ASP 60 14.508 3.939 -8.645 399 H GLN 61 H GLN 61 12.264 3.037 -8.206 400 HA GLN 61 HA GLN 61 12.202 0.305 -9.235 401 HB3 GLN 61 2HB GLN 61 10.894 0.066 -6.995 402 HG3 GLN 61 2HG GLN 61 12.862 0.726 -5.518 403 HE21 GLN 61 2HE2 GLN 61 14.214 -0.443 -8.620 404 HE22 GLN 61 1HE2 GLN 61 14.105 -2.130 -8.175 405 H ALA 62 H ALA 62 9.758 2.880 -8.689 406 HA ALA 62 HA ALA 62 7.457 1.397 -9.445 407 HB1 ALA 62 3HB ALA 62 6.403 3.503 -9.712 408 HB2 ALA 62 1HB ALA 62 7.499 3.628 -8.325 409 HB3 ALA 62 2HB ALA 62 7.955 4.345 -9.894 410 H ASP 63 H ASP 63 9.750 3.233 -11.508 411 HA ASP 63 HA ASP 63 8.356 2.639 -13.972 412 HB3 ASP 63 2HB ASP 63 11.239 3.527 -13.575 413 H ARG 64 H ARG 64 11.228 1.202 -12.369 414 HA ARG 64 HA ARG 64 11.728 -0.887 -14.318 415 HB3 ARG 64 2HB ARG 64 12.834 -1.997 -12.275 416 HG3 ARG 64 2HG ARG 64 13.694 0.811 -13.083 417 HD3 ARG 64 2HD ARG 64 14.953 -1.319 -11.372 418 HE ARG 64 HE ARG 64 16.259 -0.582 -13.709 419 HH11 ARG 64 1HH2 ARG 64 17.070 -0.176 -10.323 420 HH12 ARG 64 2HH2 ARG 64 18.770 -0.432 -10.618 421 HH21 ARG 64 1HH1 ARG 64 18.416 -0.868 -14.009 422 HH22 ARG 64 2HH1 ARG 64 19.508 -0.791 -12.657 423 H CYS 65 H CYS 65 9.259 -0.555 -11.952 424 HA CYS 65 HA CYS 65 7.752 -1.870 -11.007 425 HB3 CYS 65 2HB CYS 65 7.983 -3.511 -13.517 426 H THR 66 H THR 66 10.085 -2.148 -9.825 427 HA THR 66 HA THR 66 10.096 -5.023 -9.018 428 HB THR 66 HB THR 66 12.567 -4.917 -8.714 429 HG1 THR 66 1HG THR 66 13.577 -3.383 -10.201 430 HG21 THR 66 3HG2 THR 66 13.133 -5.336 -11.062 431 HG22 THR 66 1HG2 THR 66 11.580 -6.078 -10.659 432 HG23 THR 66 2HG2 THR 66 11.626 -4.572 -11.593 433 H ILE 67 H ILE 67 10.831 -5.447 -6.872 434 HA ILE 67 HA ILE 67 10.219 -3.199 -4.992 435 HB ILE 67 HB ILE 67 10.103 -6.116 -4.408 436 HG13 ILE 67 2HG1 ILE 67 7.659 -6.219 -4.791 437 HG21 ILE 67 1HG2 ILE 67 10.092 -4.556 -2.495 438 HG22 ILE 67 2HG2 ILE 67 8.475 -4.042 -3.066 439 HG23 ILE 67 3HG2 ILE 67 8.721 -5.698 -2.587 440 HD11 ILE 67 3HD1 ILE 67 6.611 -4.510 -6.248 441 HD12 ILE 67 1HD1 ILE 67 6.961 -3.931 -4.622 442 HD13 ILE 67 2HD1 ILE 67 8.009 -3.467 -5.999 443 H LYS 68 H LYS 68 11.776 -2.736 -3.482 444 HA LYS 68 HA LYS 68 14.428 -3.851 -3.856 445 HB3 LYS 68 2HB LYS 68 13.707 -2.120 -1.486 446 HG3 LYS 68 2HG LYS 68 16.119 -2.885 -2.302 447 HD3 LYS 68 2HD LYS 68 15.610 -0.414 -4.034 448 HE3 LYS 68 2HE LYS 68 18.045 -2.015 -3.245 449 HZ1 LYS 68 3HZ LYS 68 19.186 -1.091 -5.173 450 HZ2 LYS 68 1HZ LYS 68 18.005 -2.099 -5.665 451 HZ3 LYS 68 2HZ LYS 68 17.797 -0.480 -5.775 452 H LYS 69 H LYS 69 15.386 -5.507 -2.758 453 HA LYS 69 HA LYS 69 14.092 -7.121 -0.781 454 HB3 LYS 69 2HB LYS 69 15.974 -7.789 -2.311 455 HG3 LYS 69 2HG LYS 69 17.827 -6.758 -0.143 456 HD3 LYS 69 2HD LYS 69 18.319 -7.303 -3.103 457 HE3 LYS 69 2HE LYS 69 19.872 -6.178 -0.904 458 HZ1 LYS 69 3HZ LYS 69 21.851 -7.523 -1.260 459 HZ2 LYS 69 1HZ LYS 69 20.663 -8.468 -0.658 460 HZ3 LYS 69 2HZ LYS 69 21.049 -8.550 -2.247 461 H GLU 70 H GLU 70 15.699 -4.110 -0.387 462 HA GLU 70 HA GLU 70 16.163 -4.225 2.469 463 HB3 GLU 70 2HB GLU 70 16.377 -1.809 2.314 464 HG3 GLU 70 2HG GLU 70 17.666 -2.843 -0.228 465 H ASN 71 H ASN 71 13.249 -4.467 0.837 466 HA ASN 71 HA ASN 71 11.466 -3.090 2.530 467 HB3 ASN 71 2HB ASN 71 10.851 -4.181 0.405 468 HD21 ASN 71 2HD2 ASN 71 10.273 -5.997 -0.840 469 HD22 ASN 71 1HD2 ASN 71 10.685 -7.635 -0.329 470 H THR 72 H THR 72 9.986 -4.022 3.993 471 HA THR 72 HA THR 72 10.376 -6.148 5.790 472 HB THR 72 HB THR 72 11.985 -3.745 6.429 473 HG1 THR 72 1HG THR 72 13.195 -5.255 7.372 474 HG21 THR 72 3HG2 THR 72 11.797 -4.008 8.887 475 HG22 THR 72 1HG2 THR 72 10.326 -3.332 8.199 476 HG23 THR 72 2HG2 THR 72 10.377 -5.051 8.671 477 HA PRO 73 HA PRO 73 6.821 -3.406 7.279 478 HB3 PRO 73 2HB PRO 73 7.616 -1.272 7.704 479 HG3 PRO 73 2HG PRO 73 9.000 -0.131 6.187 480 HD3 PRO 73 2HD PRO 73 10.232 -2.091 6.186 481 H LEU 74 H LEU 74 7.533 -4.303 4.249 482 HA LEU 74 HA LEU 74 5.408 -3.618 2.539 483 HB3 LEU 74 2HB LEU 74 6.989 -6.214 2.799 484 HG LEU 74 HG LEU 74 5.245 -5.133 0.546 485 HD11 LEU 74 1HD1 LEU 74 7.624 -5.470 -0.259 486 HD12 LEU 74 2HD1 LEU 74 7.487 -7.170 0.225 487 HD13 LEU 74 3HD1 LEU 74 6.422 -6.500 -1.035 488 HD21 LEU 74 3HD2 LEU 74 4.708 -7.598 0.295 489 HD22 LEU 74 1HD2 LEU 74 5.670 -7.917 1.732 490 HD23 LEU 74 2HD2 LEU 74 4.186 -6.944 1.829 491 H LEU 75 H LEU 75 3.335 -4.045 2.526 492 HA LEU 75 HA LEU 75 2.159 -5.660 4.693 493 HB3 LEU 75 2HB LEU 75 0.966 -3.638 2.764 494 HG LEU 75 HG LEU 75 -0.677 -3.315 4.664 495 HD11 LEU 75 1HD1 LEU 75 -1.195 -4.419 2.442 496 HD12 LEU 75 2HD1 LEU 75 -1.056 -5.976 3.286 497 HD13 LEU 75 3HD1 LEU 75 -2.272 -4.792 3.798 498 HD21 LEU 75 3HD2 LEU 75 -1.241 -5.144 6.131 499 HD22 LEU 75 1HD2 LEU 75 0.005 -6.185 5.426 500 HD23 LEU 75 2HD2 LEU 75 0.470 -4.751 6.369 501 H ASN 76 H ASN 76 2.144 -7.732 4.200 502 HA ASN 76 HA ASN 76 1.708 -8.947 1.619 503 HB3 ASN 76 2HB ASN 76 1.491 -11.046 3.190 504 HD21 ASN 76 2HD2 ASN 76 3.778 -11.515 4.676 505 HD22 ASN 76 1HD2 ASN 76 5.119 -11.393 3.550 506 H CYS 77 H CYS 77 -0.365 -7.520 1.365 507 HA CYS 77 HA CYS 77 -2.798 -8.268 2.600 508 HB3 CYS 77 2HB CYS 77 -2.114 -7.082 -0.066 509 H ALA 78 H ALA 78 -4.291 -9.732 2.279 510 HA ALA 78 HA ALA 78 -5.315 -11.665 1.848 511 HB1 ALA 78 3HB ALA 78 -5.238 -12.772 -0.234 512 HB2 ALA 78 1HB ALA 78 -5.023 -11.055 -0.620 513 HB3 ALA 78 2HB ALA 78 -3.627 -12.160 -0.608 514 H LYS 79 H LYS 79 -1.846 -11.571 1.965 515 HA LYS 79 HA LYS 79 -0.187 -12.958 2.616 516 HB3 LYS 79 2HB LYS 79 -1.570 -14.408 4.711 517 HG3 LYS 79 2HG LYS 79 -0.094 -11.748 4.994 518 HD3 LYS 79 2HD LYS 79 -0.241 -14.240 6.736 519 HE3 LYS 79 2HE LYS 79 0.827 -11.524 7.558 520 HZ1 LYS 79 3HZ LYS 79 1.962 -12.903 9.199 521 HZ2 LYS 79 1HZ LYS 79 0.363 -13.228 9.277 522 HZ3 LYS 79 2HZ LYS 79 1.385 -14.276 8.542 523 HA PRO 80 HA PRO 80 -0.571 -17.172 1.047 524 HB3 PRO 80 2HB PRO 80 1.530 -17.773 1.676 525 HG3 PRO 80 2HG PRO 80 2.469 -17.018 3.670 526 HD3 PRO 80 2HD PRO 80 1.502 -14.962 3.226 527 H ASP 81 H ASP 81 -1.420 -16.952 4.523 528 HA ASP 81 HA ASP 81 -4.025 -18.154 4.077 529 HB3 ASP 81 2HB ASP 81 -2.252 -19.684 6.010 530 H GLN 82 H GLN 82 -3.795 -15.618 4.858 531 HA GLN 82 HA GLN 82 -5.118 -15.710 7.424 532 HB3 GLN 82 2HB GLN 82 -3.105 -13.656 7.807 533 HG3 GLN 82 2HG GLN 82 -3.602 -16.280 9.270 534 HE21 GLN 82 2HE2 GLN 82 -1.640 -16.753 10.309 535 HE22 GLN 82 1HE2 GLN 82 -0.725 -15.549 11.201 536 H ASP 83 H ASP 83 -6.333 -13.836 7.895 537 HA ASP 83 HA ASP 83 -6.760 -11.887 5.778 538 HB3 ASP 83 2HB ASP 83 -8.599 -12.453 7.241 539 H ILE 84 H ILE 84 -5.985 -9.842 5.629 540 HA ILE 84 HA ILE 84 -3.922 -8.943 7.607 541 HB ILE 84 HB ILE 84 -3.780 -9.010 4.743 542 HG13 ILE 84 2HG1 ILE 84 -1.890 -7.756 6.774 543 HG21 ILE 84 1HG2 ILE 84 -4.861 -6.736 4.761 544 HG22 ILE 84 2HG2 ILE 84 -3.523 -6.156 5.780 545 HG23 ILE 84 3HG2 ILE 84 -3.217 -6.756 4.143 546 HD11 ILE 84 3HD1 ILE 84 -0.608 -9.892 6.441 547 HD12 ILE 84 1HD1 ILE 84 -2.119 -10.126 7.335 548 HD13 ILE 84 2HD1 ILE 84 -2.035 -10.565 5.615 549 H LYS 85 H LYS 85 -4.138 -7.083 8.594 550 HA LYS 85 HA LYS 85 -6.233 -5.173 7.997 551 HB3 LYS 85 2HB LYS 85 -7.540 -6.854 9.180 552 HG3 LYS 85 2HG LYS 85 -7.481 -7.205 11.521 553 HD3 LYS 85 2HD LYS 85 -4.594 -7.731 10.732 554 HE3 LYS 85 2HE LYS 85 -6.613 -9.253 12.416 555 HZ1 LYS 85 3HZ LYS 85 -4.751 -10.710 12.853 556 HZ2 LYS 85 1HZ LYS 85 -4.982 -10.648 11.235 557 HZ3 LYS 85 2HZ LYS 85 -3.741 -9.827 11.922 558 H PHE 86 H PHE 86 -5.188 -3.355 8.114 559 HA PHE 86 HA PHE 86 -3.564 -2.681 10.509 560 HB3 PHE 86 2HB PHE 86 -2.027 -1.543 8.552 561 HD1 PHE 86 1HD PHE 86 -1.792 -5.251 8.731 562 HD2 PHE 86 2HD PHE 86 -0.538 -1.505 10.454 563 HE1 PHE 86 1HE PHE 86 -0.079 -6.440 10.076 564 HE2 PHE 86 2HE PHE 86 1.183 -2.695 11.786 565 HZ PHE 86 HZ PHE 86 1.407 -5.166 11.612 566 H THR 87 H THR 87 -3.965 -0.680 11.183 567 HA THR 87 HA THR 87 -5.252 1.239 9.308 568 HB THR 87 HB THR 87 -6.971 0.242 10.681 569 HG1 THR 87 1HG THR 87 -7.938 2.073 10.884 570 HG21 THR 87 3HG2 THR 87 -7.290 0.759 13.005 571 HG22 THR 87 1HG2 THR 87 -5.774 -0.137 12.824 572 HG23 THR 87 2HG2 THR 87 -5.746 1.622 13.095 573 H ILE 88 H ILE 88 -4.034 2.857 8.989 574 HA ILE 88 HA ILE 88 -2.257 3.895 11.156 575 HB ILE 88 HB ILE 88 -1.587 3.257 8.296 576 HG13 ILE 88 2HG1 ILE 88 -0.880 1.808 10.163 577 HG21 ILE 88 1HG2 ILE 88 -1.225 5.701 8.341 578 HG22 ILE 88 2HG2 ILE 88 -0.239 5.537 9.817 579 HG23 ILE 88 3HG2 ILE 88 0.294 4.846 8.268 580 HD11 ILE 88 3HD1 ILE 88 1.505 1.660 9.865 581 HD12 ILE 88 1HD1 ILE 88 0.783 2.052 8.286 582 HD13 ILE 88 2HD1 ILE 88 1.607 3.312 9.247 583 H LYS 89 H LYS 89 -2.336 5.928 11.561 584 HA LYS 89 HA LYS 89 -4.258 7.653 10.074 585 HB3 LYS 89 2HB LYS 89 -4.846 7.268 12.401 586 HG3 LYS 89 2HG LYS 89 -2.908 9.037 13.623 587 HD3 LYS 89 2HD LYS 89 -4.584 7.566 14.798 588 HE3 LYS 89 2HE LYS 89 -2.483 5.383 14.487 589 HZ1 LYS 89 3HZ LYS 89 -4.311 3.999 15.252 590 HZ2 LYS 89 1HZ LYS 89 -4.124 5.220 16.319 591 HZ3 LYS 89 2HZ LYS 89 -5.356 5.251 15.247 592 H PHE 90 H PHE 90 -3.687 9.676 9.427 593 HA PHE 90 HA PHE 90 -0.903 10.116 8.715 594 HB3 PHE 90 2HB PHE 90 -1.981 12.356 7.881 595 HD1 PHE 90 2HD PHE 90 -0.235 10.576 6.609 596 HD2 PHE 90 1HD PHE 90 -4.511 10.895 6.256 597 HE1 PHE 90 2HE PHE 90 -0.100 9.806 4.274 598 HE2 PHE 90 1HE PHE 90 -4.372 10.208 3.882 599 HZ PHE 90 HZ PHE 90 -2.159 9.642 2.888 600 H GLN 91 H GLN 91 -0.887 9.895 11.406 601 HA GLN 91 HA GLN 91 0.575 12.102 12.297 602 HB3 GLN 91 2HB GLN 91 -2.263 12.086 13.432 603 HG3 GLN 91 2HG GLN 91 0.248 12.851 14.740 604 HE21 GLN 91 2HE2 GLN 91 1.096 14.787 13.686 605 HE22 GLN 91 1HE2 GLN 91 0.333 16.329 14.031 606 H GLU 92 H GLU 92 1.965 10.444 12.986 607 HA GLU 92 HA GLU 92 1.455 9.634 15.705 608 HB3 GLU 92 2HB GLU 92 2.275 7.134 14.649 609 HG3 GLU 92 2HG GLU 92 0.105 6.300 15.432 610 H PHE 93 H PHE 93 3.136 11.274 15.757 611 HA PHE 93 HA PHE 93 5.793 10.688 14.818 612 HB3 PHE 93 2HB PHE 93 5.039 12.953 15.530 613 HD1 PHE 93 1HD PHE 93 2.980 13.112 16.989 614 HD2 PHE 93 2HD PHE 93 6.840 12.072 18.603 615 HE1 PHE 93 1HE PHE 93 2.133 13.513 19.285 616 HE2 PHE 93 2HE PHE 93 5.991 12.487 20.896 617 HZ PHE 93 HZ PHE 93 3.631 13.192 21.243 618 H SER 94 H SER 94 7.446 9.522 15.738 619 HA SER 94 HA SER 94 7.063 8.301 18.406 620 HB3 SER 94 2HB SER 94 7.642 6.672 15.912 621 HG SER 94 HG SER 94 7.493 5.007 17.695 622 HA PRO 95 HA PRO 95 11.406 9.417 18.333 623 HB3 PRO 95 2HB PRO 95 11.150 10.010 20.527 624 HG3 PRO 95 2HG PRO 95 9.688 8.866 21.966 625 HD3 PRO 95 2HD PRO 95 8.240 9.108 20.174 626 H ASN 96 H ASN 96 10.206 6.181 18.231 627 HA ASN 96 HA ASN 96 12.818 5.208 17.281 628 HB3 ASN 96 2HB ASN 96 11.490 3.603 19.484 629 HD21 ASN 96 2HD2 ASN 96 14.771 4.830 19.632 630 HD22 ASN 96 1HD2 ASN 96 15.548 3.320 19.173 631 H LEU 97 H LEU 97 10.303 5.632 15.847 632 HA LEU 97 HA LEU 97 10.096 2.969 14.659 633 HB3 LEU 97 2HB LEU 97 7.475 4.182 15.602 634 HG LEU 97 HG LEU 97 6.740 1.863 15.878 635 HD11 LEU 97 1HD1 LEU 97 6.302 3.082 13.741 636 HD12 LEU 97 2HD1 LEU 97 7.692 2.221 13.030 637 HD13 LEU 97 3HD1 LEU 97 6.282 1.316 13.606 638 HD21 LEU 97 3HD2 LEU 97 7.919 -0.030 15.031 639 HD22 LEU 97 1HD2 LEU 97 9.206 0.974 14.339 640 HD23 LEU 97 2HD2 LEU 97 9.036 0.841 16.105 641 H TRP 98 H TRP 98 10.750 3.715 12.661 642 HA TRP 98 HA TRP 98 9.638 6.130 11.470 643 HB3 TRP 98 2HB TRP 98 11.153 5.632 9.615 644 HD1 TRP 98 HD TRP 98 11.324 7.536 12.127 645 HE1 TRP 98 1HE TRP 98 13.605 8.149 13.117 646 HE3 TRP 98 3HE TRP 98 14.077 3.629 10.274 647 HZ2 TRP 98 2HZ TRP 98 16.291 7.072 13.118 648 HZ3 TRP 98 3HZ TRP 98 16.506 3.463 10.773 649 HH2 TRP 98 HH TRP 98 17.621 5.169 12.196 650 H GLY 99 H GLY 99 8.037 3.367 11.766 651 HA2 GLY 99 2HA GLY 99 7.252 2.736 9.019 652 H LEU 100 H LEU 100 5.216 3.570 11.862 653 HA LEU 100 HA LEU 100 3.173 4.890 10.215 654 HB3 LEU 100 2HB LEU 100 2.210 3.744 11.954 655 HG LEU 100 HG LEU 100 3.966 3.189 13.485 656 HD11 LEU 100 1HD1 LEU 100 5.401 5.135 13.588 657 HD12 LEU 100 2HD1 LEU 100 4.093 6.136 14.201 658 HD13 LEU 100 3HD1 LEU 100 4.774 4.850 15.209 659 HD21 LEU 100 3HD2 LEU 100 2.805 3.608 15.611 660 HD22 LEU 100 1HD2 LEU 100 1.841 4.876 14.835 661 HD23 LEU 100 2HD2 LEU 100 1.666 3.188 14.314 662 H GLU 101 H GLU 101 6.119 5.941 11.560 663 HA GLU 101 HA GLU 101 5.469 8.735 11.945 664 HB3 GLU 101 2HB GLU 101 8.148 8.600 11.064 665 HG3 GLU 101 2HG GLU 101 8.690 8.399 13.544 666 H PHE 102 H PHE 102 5.985 10.450 10.617 667 HA PHE 102 HA PHE 102 6.398 10.044 7.734 668 HB3 PHE 102 2HB PHE 102 4.361 11.521 7.332 669 HD1 PHE 102 2HD PHE 102 5.157 9.410 5.828 670 HD2 PHE 102 1HD PHE 102 2.112 9.447 8.882 671 HE1 PHE 102 2HE PHE 102 3.985 7.554 4.685 672 HE2 PHE 102 1HE PHE 102 0.940 7.595 7.724 673 HZ PHE 102 HZ PHE 102 1.877 6.643 5.631 674 H GLN 103 H GLN 103 6.858 11.994 6.623 675 HA GLN 103 HA GLN 103 8.120 14.056 8.397 676 HB3 GLN 103 2HB GLN 103 9.758 14.269 6.580 677 HG3 GLN 103 2HG GLN 103 9.410 11.313 7.276 678 HE21 GLN 103 2HE2 GLN 103 12.409 13.111 7.657 679 HE22 GLN 103 1HE2 GLN 103 13.213 12.366 6.284 680 H LYS 104 H LYS 104 7.795 16.255 7.886 681 HA LYS 104 HA LYS 104 5.495 16.873 6.214 682 HB3 LYS 104 2HB LYS 104 7.193 19.168 6.999 683 HG3 LYS 104 2HG LYS 104 4.438 18.415 8.032 684 HD3 LYS 104 2HD LYS 104 5.680 20.588 8.729 685 HE3 LYS 104 2HE LYS 104 4.750 21.336 5.908 686 HZ1 LYS 104 3HZ LYS 104 5.784 23.455 6.427 687 HZ2 LYS 104 1HZ LYS 104 4.636 23.151 7.548 688 HZ3 LYS 104 2HZ LYS 104 6.217 22.957 7.920 689 H ASN 105 H ASN 105 5.418 18.238 4.430 690 HA ASN 105 HA ASN 105 5.807 18.626 2.263 691 HB3 ASN 105 2HB ASN 105 8.603 19.530 3.033 692 HD21 ASN 105 2HD2 ASN 105 9.416 19.869 0.922 693 HD22 ASN 105 1HD2 ASN 105 8.566 20.835 -0.274 694 H LYS 106 H LYS 106 6.129 15.939 2.916 695 HA LYS 106 HA LYS 106 8.328 15.007 1.108 696 HB3 LYS 106 2HB LYS 106 7.771 13.130 3.292 697 HG3 LYS 106 2HG LYS 106 10.250 13.735 3.797 698 HD3 LYS 106 2HD LYS 106 9.421 12.583 1.109 699 HE3 LYS 106 2HE LYS 106 11.933 13.625 1.639 700 HZ1 LYS 106 3HZ LYS 106 13.341 11.692 1.906 701 HZ2 LYS 106 1HZ LYS 106 12.364 11.774 3.218 702 HZ3 LYS 106 2HZ LYS 106 12.068 10.685 2.040 703 H ASP 107 H ASP 107 7.821 13.681 -0.384 704 HA ASP 107 HA ASP 107 5.079 12.537 -0.590 705 HB3 ASP 107 2HB ASP 107 5.914 12.054 -2.956 706 H TYR 108 H TYR 108 4.712 10.417 -0.650 707 HA TYR 108 HA TYR 108 6.983 8.488 -0.835 708 HB3 TYR 108 2HB TYR 108 5.198 6.964 0.356 709 HD1 TYR 108 2HD TYR 108 7.543 6.306 0.854 710 HD2 TYR 108 1HD TYR 108 5.658 9.712 2.714 711 HE1 TYR 108 2HE TYR 108 9.266 6.274 2.643 712 HE2 TYR 108 1HE TYR 108 7.395 9.677 4.513 713 HH TYR 108 HH TYR 108 10.022 7.241 4.571 714 H TYR 109 H TYR 109 6.794 6.885 -2.167 715 HA TYR 109 HA TYR 109 4.434 6.638 -3.979 716 HB3 TYR 109 2HB TYR 109 6.394 5.541 -5.427 717 HD1 TYR 109 1HD TYR 109 4.722 6.356 -7.010 718 HD2 TYR 109 2HD TYR 109 7.268 9.055 -4.809 719 HE1 TYR 109 1HE TYR 109 4.170 8.193 -8.611 720 HE2 TYR 109 2HE TYR 109 6.723 10.880 -6.410 721 HH TYR 109 HH TYR 109 5.555 11.476 -8.293 722 H ILE 110 H ILE 110 3.490 4.748 -3.854 723 HA ILE 110 HA ILE 110 4.834 2.425 -2.522 724 HB ILE 110 HB ILE 110 1.976 3.212 -2.936 725 HG13 ILE 110 2HG1 ILE 110 3.455 2.333 -0.397 726 HG21 ILE 110 1HG2 ILE 110 1.900 0.869 -3.465 727 HG22 ILE 110 2HG2 ILE 110 2.861 0.468 -2.017 728 HG23 ILE 110 3HG2 ILE 110 1.214 1.121 -1.875 729 HD11 ILE 110 3HD1 ILE 110 2.902 4.692 0.428 730 HD12 ILE 110 1HD1 ILE 110 4.280 4.552 -0.659 731 HD13 ILE 110 2HD1 ILE 110 2.733 5.168 -1.266 732 H ILE 111 H ILE 111 4.532 0.322 -3.599 733 HA ILE 111 HA ILE 111 3.531 0.334 -6.368 734 HB ILE 111 HB ILE 111 6.059 0.811 -6.321 735 HG13 ILE 111 2HG1 ILE 111 5.050 0.243 -8.348 736 HG21 ILE 111 1HG2 ILE 111 6.556 -0.815 -4.469 737 HG22 ILE 111 2HG2 ILE 111 6.135 -2.112 -5.598 738 HG23 ILE 111 3HG2 ILE 111 7.554 -1.103 -5.898 739 HD11 ILE 111 3HD1 ILE 111 6.769 -0.763 -9.527 740 HD12 ILE 111 1HD1 ILE 111 7.629 -0.235 -8.070 741 HD13 ILE 111 2HD1 ILE 111 7.144 -1.936 -8.240 742 H SER 112 H SER 112 2.924 -1.770 -7.074 743 HA SER 112 HA SER 112 3.117 -4.021 -5.152 744 HB3 SER 112 2HB SER 112 0.756 -4.393 -5.097 745 HG SER 112 HG SER 112 -0.056 -2.495 -4.222 746 H THR 113 H THR 113 2.671 -6.079 -6.039 747 HA THR 113 HA THR 113 2.739 -6.236 -9.014 748 HB THR 113 HB THR 113 4.326 -8.103 -8.822 749 HG1 THR 113 1HG THR 113 5.345 -8.511 -6.976 750 HG21 THR 113 3HG2 THR 113 6.332 -6.770 -8.229 751 HG22 THR 113 1HG2 THR 113 5.225 -5.861 -9.272 752 HG23 THR 113 2HG2 THR 113 5.273 -5.517 -7.540 753 H SER 114 H SER 114 0.316 -6.425 -7.869 754 HA SER 114 HA SER 114 -0.674 -8.893 -7.077 755 HB3 SER 114 2HB SER 114 -1.888 -6.695 -7.256 756 HG SER 114 HG SER 114 -3.091 -6.478 -9.247 757 H ASN 115 H ASN 115 0.093 -7.979 -10.427 758 HA ASN 115 HA ASN 115 -1.004 -10.194 -11.774 759 HB3 ASN 115 2HB ASN 115 1.550 -9.505 -12.976 760 HD21 ASN 115 2HD2 ASN 115 1.320 -8.420 -15.088 761 HD22 ASN 115 1HD2 ASN 115 -0.235 -8.537 -15.891 762 H GLY 116 H GLY 116 1.668 -10.202 -9.585 763 HA2 GLY 116 2HA GLY 116 3.303 -11.678 -9.021 764 H SER 117 H SER 117 4.123 -10.806 -11.374 765 HA SER 117 HA SER 117 4.288 -12.385 -13.663 766 HB3 SER 117 2HB SER 117 6.445 -11.230 -14.099 767 HG SER 117 HG SER 117 5.538 -9.165 -14.038 768 H LEU 118 H LEU 118 5.915 -13.888 -14.488 769 HA LEU 118 HA LEU 118 6.479 -15.938 -12.675 770 HB3 LEU 118 2HB LEU 118 8.073 -15.669 -15.222 771 HG LEU 118 HG LEU 118 7.250 -17.914 -15.718 772 HD11 LEU 118 1HD1 LEU 118 9.365 -17.685 -14.396 773 HD12 LEU 118 2HD1 LEU 118 8.419 -18.016 -12.922 774 HD13 LEU 118 3HD1 LEU 118 8.525 -19.233 -14.200 775 HD21 LEU 118 3HD2 LEU 118 5.985 -19.279 -14.207 776 HD22 LEU 118 1HD2 LEU 118 5.985 -18.030 -12.952 777 HD23 LEU 118 2HD2 LEU 118 5.089 -17.772 -14.468 778 H GLU 119 H GLU 119 8.668 -13.292 -13.613 779 HA GLU 119 HA GLU 119 11.019 -14.213 -12.206 780 HB3 GLU 119 2HB GLU 119 11.575 -11.725 -12.237 781 HG3 GLU 119 2HG GLU 119 11.045 -11.694 -14.949 782 H GLY 120 H GLY 120 8.050 -12.896 -11.045 783 HA2 GLY 120 2HA GLY 120 9.048 -12.458 -8.264 784 H LEU 121 H LEU 121 7.835 -14.970 -9.657 785 HA LEU 121 HA LEU 121 5.200 -15.304 -8.738 786 HB3 LEU 121 2HB LEU 121 6.503 -16.755 -10.405 787 HG LEU 121 HG LEU 121 7.261 -18.218 -7.836 788 HD11 LEU 121 1HD1 LEU 121 6.034 -19.758 -9.240 789 HD12 LEU 121 2HD1 LEU 121 7.062 -19.350 -10.636 790 HD13 LEU 121 3HD1 LEU 121 7.755 -20.171 -9.212 791 HD21 LEU 121 3HD2 LEU 121 9.459 -18.416 -8.717 792 HD22 LEU 121 1HD2 LEU 121 8.962 -17.834 -10.311 793 HD23 LEU 121 2HD2 LEU 121 9.033 -16.713 -8.938 794 H ASP 122 H ASP 122 8.209 -15.896 -7.096 795 HA ASP 122 HA ASP 122 6.885 -16.121 -4.418 796 HB3 ASP 122 2HB ASP 122 8.860 -17.574 -3.813 797 H ASN 123 H ASN 123 8.904 -14.294 -6.374 798 HA ASN 123 HA ASN 123 10.480 -13.091 -4.133 799 HB3 ASN 123 2HB ASN 123 11.894 -12.126 -5.916 800 HD21 ASN 123 2HD2 ASN 123 12.374 -14.052 -8.168 801 HD22 ASN 123 1HD2 ASN 123 13.221 -15.373 -7.367 802 H GLN 124 H GLN 124 10.881 -10.625 -5.004 803 HA GLN 124 HA GLN 124 8.192 -9.386 -5.359 804 HB3 GLN 124 2HB GLN 124 8.746 -7.758 -3.780 805 HG3 GLN 124 2HG GLN 124 8.516 -10.344 -2.836 806 HE21 GLN 124 2HE2 GLN 124 9.290 -9.565 0.045 807 HE22 GLN 124 1HE2 GLN 124 10.965 -10.064 0.157 808 H GLU 125 H GLU 125 8.977 -9.799 -7.714 809 HA GLU 125 HA GLU 125 10.246 -7.328 -8.749 810 HB3 GLU 125 2HB GLU 125 11.869 -8.570 -10.104 811 HG3 GLU 125 2HG GLU 125 12.262 -9.321 -7.179 812 H GLY 126 H GLY 126 9.016 -6.640 -10.449 813 HA2 GLY 126 2HA GLY 126 7.867 -6.685 -12.429 814 H GLY 127 H GLY 127 5.675 -6.629 -12.908 815 HA2 GLY 127 2HA GLY 127 3.585 -8.244 -11.896 816 H VAL 128 H VAL 128 1.780 -6.173 -11.067 817 HA VAL 128 HA VAL 128 0.842 -5.221 -13.628 818 HB VAL 128 HB VAL 128 -0.711 -3.803 -12.064 819 HG11 VAL 128 1HG1 VAL 128 -1.361 -5.843 -13.382 820 HG12 VAL 128 2HG1 VAL 128 -1.006 -6.805 -11.935 821 HG13 VAL 128 3HG1 VAL 128 -2.263 -5.577 -11.883 822 HG21 VAL 128 3HG2 VAL 128 -1.020 -4.572 -9.854 823 HG22 VAL 128 1HG2 VAL 128 0.161 -5.868 -10.048 824 HG23 VAL 128 2HG2 VAL 128 0.708 -4.180 -10.020 825 H CYS 129 H CYS 129 2.900 -3.679 -11.169 826 HA CYS 129 HA CYS 129 2.788 -1.050 -12.154 827 HB3 CYS 129 2HB CYS 129 3.898 -1.353 -10.190 828 H GLN 130 H GLN 130 3.887 -3.771 -13.991 829 HA GLN 130 HA GLN 130 5.660 -2.258 -15.759 830 HB3 GLN 130 2HB GLN 130 4.722 -4.857 -16.753 831 HG3 GLN 130 2HG GLN 130 7.420 -4.104 -15.569 832 HE21 GLN 130 2HE2 GLN 130 8.832 -5.891 -15.583 833 HE22 GLN 130 1HE2 GLN 130 8.564 -7.306 -16.589 834 H THR 131 H THR 131 2.261 -3.292 -15.826 835 HA THR 131 HA THR 131 1.805 -1.835 -18.381 836 HB THR 131 HB THR 131 2.410 -4.170 -18.912 837 HG1 THR 131 1HG THR 131 0.647 -4.506 -20.312 838 HG21 THR 131 3HG2 THR 131 0.798 -5.989 -18.593 839 HG22 THR 131 1HG2 THR 131 1.440 -5.404 -17.054 840 HG23 THR 131 2HG2 THR 131 -0.207 -4.951 -17.558 841 H ARG 132 H ARG 132 1.060 -1.569 -15.524 842 HA ARG 132 HA ARG 132 -1.827 -0.860 -15.823 843 HB3 ARG 132 2HB ARG 132 -0.999 -2.036 -13.226 844 HG3 ARG 132 2HG ARG 132 -3.016 -3.366 -13.349 845 HD3 ARG 132 2HD ARG 132 -3.031 -0.584 -12.995 846 HE ARG 132 HE ARG 132 -4.425 0.175 -14.688 847 HH11 ARG 132 1HH2 ARG 132 -5.599 -2.995 -13.749 848 HH12 ARG 132 2HH2 ARG 132 -6.927 -2.950 -14.874 849 HH21 ARG 132 1HH1 ARG 132 -6.145 0.155 -16.127 850 HH22 ARG 132 2HH1 ARG 132 -7.235 -1.204 -16.160 851 H ALA 133 H ALA 133 1.212 -0.561 -14.073 852 HA ALA 133 HA ALA 133 2.094 0.878 -12.585 853 HB1 ALA 133 3HB ALA 133 1.664 3.242 -12.709 854 HB2 ALA 133 1HB ALA 133 1.801 2.555 -14.336 855 HB3 ALA 133 2HB ALA 133 0.205 2.976 -13.676 856 H MET 134 H MET 134 0.765 -0.908 -11.286 857 HA MET 134 HA MET 134 -1.186 0.271 -9.444 858 HB3 MET 134 2HB MET 134 0.382 -2.282 -9.049 859 HG3 MET 134 2HG MET 134 -2.131 -1.066 -7.835 860 HE1 MET 134 3HE MET 134 -4.024 -4.323 -8.431 861 HE2 MET 134 1HE MET 134 -4.163 -2.569 -8.159 862 HE3 MET 134 2HE MET 134 -3.198 -3.187 -9.524 863 H LYS 135 H LYS 135 -0.308 2.070 -8.681 864 HA LYS 135 HA LYS 135 1.600 1.807 -6.451 865 HB3 LYS 135 2HB LYS 135 3.083 2.362 -8.147 866 HG3 LYS 135 2HG LYS 135 1.735 4.921 -8.985 867 HD3 LYS 135 2HD LYS 135 3.491 3.098 -10.650 868 HE3 LYS 135 2HE LYS 135 3.088 6.087 -10.316 869 HZ1 LYS 135 3HZ LYS 135 4.974 6.342 -11.798 870 HZ2 LYS 135 1HZ LYS 135 5.465 5.634 -10.402 871 HZ3 LYS 135 2HZ LYS 135 5.297 4.742 -11.773 872 H ILE 136 H ILE 136 1.667 3.921 -5.213 873 HA ILE 136 HA ILE 136 -0.857 5.381 -5.422 874 HB ILE 136 HB ILE 136 -1.791 5.026 -3.411 875 HG13 ILE 136 2HG1 ILE 136 0.798 4.867 -2.228 876 HG21 ILE 136 1HG2 ILE 136 -1.916 2.910 -4.713 877 HG22 ILE 136 2HG2 ILE 136 -0.504 2.294 -3.852 878 HG23 ILE 136 3HG2 ILE 136 -1.999 2.620 -2.977 879 HD11 ILE 136 3HD1 ILE 136 -0.331 5.133 -0.121 880 HD12 ILE 136 1HD1 ILE 136 -0.999 6.241 -1.338 881 HD13 ILE 136 2HD1 ILE 136 -1.893 4.757 -0.875 882 H LEU 137 H LEU 137 -0.809 7.435 -4.863 883 HA LEU 137 HA LEU 137 1.830 8.652 -4.163 884 HB3 LEU 137 2HB LEU 137 -0.534 9.453 -5.758 885 HG LEU 137 HG LEU 137 -0.797 11.190 -4.001 886 HD11 LEU 137 1HD1 LEU 137 1.577 11.426 -3.213 887 HD12 LEU 137 2HD1 LEU 137 2.007 12.086 -4.797 888 HD13 LEU 137 3HD1 LEU 137 0.874 12.952 -3.740 889 HD21 LEU 137 3HD2 LEU 137 -0.761 13.072 -5.539 890 HD22 LEU 137 1HD2 LEU 137 0.345 12.194 -6.627 891 HD23 LEU 137 2HD2 LEU 137 -1.314 11.609 -6.374 892 H MET 138 H MET 138 2.178 9.085 -2.104 893 HA MET 138 HA MET 138 -0.078 9.926 -0.339 894 HB3 MET 138 2HB MET 138 2.173 8.151 0.653 895 HG3 MET 138 2HG MET 138 -0.723 8.401 1.516 896 HE1 MET 138 3HE MET 138 -0.768 5.660 4.025 897 HE2 MET 138 1HE MET 138 -1.588 7.156 3.532 898 HE3 MET 138 2HE MET 138 -1.187 5.915 2.318 899 H LYS 139 H LYS 139 0.451 12.117 -0.397 900 HA LYS 139 HA LYS 139 3.219 12.914 0.396 901 HB3 LYS 139 2HB LYS 139 0.938 14.636 -0.653 902 HG3 LYS 139 2HG LYS 139 3.373 15.865 -1.216 903 HD3 LYS 139 2HD LYS 139 2.906 17.461 0.696 904 HE3 LYS 139 2HE LYS 139 0.271 17.449 -0.513 905 HZ1 LYS 139 3HZ LYS 139 1.221 19.341 -1.733 906 HZ2 LYS 139 1HZ LYS 139 1.582 19.450 -0.143 907 HZ3 LYS 139 2HZ LYS 139 2.721 18.971 -1.218 908 H VAL 140 H VAL 140 3.638 14.137 2.165 909 HA VAL 140 HA VAL 140 1.499 14.475 4.233 910 HB VAL 140 HB VAL 140 4.343 13.472 4.615 911 HG11 VAL 140 1HG1 VAL 140 3.348 15.069 6.458 912 HG12 VAL 140 2HG1 VAL 140 2.215 13.732 6.781 913 HG13 VAL 140 3HG1 VAL 140 3.968 13.536 6.962 914 HG21 VAL 140 3HG2 VAL 140 3.180 11.443 5.512 915 HG22 VAL 140 1HG2 VAL 140 1.624 12.133 5.028 916 HG23 VAL 140 2HG2 VAL 140 2.848 11.697 3.813 917 H GLY 141 H GLY 141 1.239 16.503 4.628 918 HA2 GLY 141 2HA GLY 141 2.595 18.502 5.592 919 H GLN 142 H GLN 142 0.766 19.600 5.886 920 HA GLN 142 HA GLN 142 -1.298 20.095 3.974 921 HB3 GLN 142 2HB GLN 142 -1.722 20.161 6.364 922 HG3 GLN 142 2HG GLN 142 0.467 22.170 6.456 923 HE21 GLN 142 2HE2 GLN 142 -1.299 22.212 9.371 924 HE22 GLN 142 1HE2 GLN 142 -1.993 23.816 9.162 Start of MODEL 6 1 H1 SER 1 H SER 1 -16.918 18.137 14.299 2 HA SER 1 HA SER 1 -17.846 18.106 11.610 3 HB3 SER 1 2HB SER 1 -17.169 20.457 11.481 4 HG SER 1 HG SER 1 -14.920 20.946 11.755 5 H LYS 2 H LYS 2 -15.969 17.293 10.062 6 HA LYS 2 HA LYS 2 -13.926 15.696 11.531 7 HB3 LYS 2 2HB LYS 2 -15.112 14.431 9.086 8 HG3 LYS 2 2HG LYS 2 -14.434 13.440 11.891 9 HD3 LYS 2 2HD LYS 2 -14.554 11.625 9.503 10 HE3 LYS 2 2HE LYS 2 -13.947 11.090 12.037 11 HZ1 LYS 2 3HZ LYS 2 -15.903 10.323 13.233 12 HZ2 LYS 2 1HZ LYS 2 -16.134 11.900 12.890 13 HZ3 LYS 2 2HZ LYS 2 -16.907 10.748 12.025 14 H SER 3 H SER 3 -11.994 15.446 10.488 15 HA SER 3 HA SER 3 -11.102 17.610 8.834 16 HB3 SER 3 2HB SER 3 -9.598 16.762 10.445 17 HG SER 3 HG SER 3 -9.064 14.420 10.357 18 H ILE 4 H ILE 4 -10.528 14.197 8.151 19 HA ILE 4 HA ILE 4 -11.578 14.366 5.400 20 HB ILE 4 HB ILE 4 -9.124 13.127 4.942 21 HG13 ILE 4 2HG1 ILE 4 -7.326 14.303 5.531 22 HG21 ILE 4 1HG2 ILE 4 -10.419 14.356 3.333 23 HG22 ILE 4 2HG2 ILE 4 -10.058 15.891 4.150 24 HG23 ILE 4 3HG2 ILE 4 -8.755 14.962 3.369 25 HD11 ILE 4 3HD1 ILE 4 -7.178 16.457 6.713 26 HD12 ILE 4 1HD1 ILE 4 -7.790 16.612 5.061 27 HD13 ILE 4 2HD1 ILE 4 -8.901 16.732 6.440 28 H VAL 5 H VAL 5 -9.795 12.295 7.719 29 HA VAL 5 HA VAL 5 -9.761 9.988 7.969 30 HB VAL 5 HB VAL 5 -12.660 10.750 8.390 31 HG11 VAL 5 1HG1 VAL 5 -12.647 8.310 8.287 32 HG12 VAL 5 2HG1 VAL 5 -11.188 8.225 9.274 33 HG13 VAL 5 3HG1 VAL 5 -12.722 8.791 9.969 34 HG21 VAL 5 3HG2 VAL 5 -11.922 10.848 10.767 35 HG22 VAL 5 1HG2 VAL 5 -10.269 10.447 10.276 36 HG23 VAL 5 2HG2 VAL 5 -11.010 11.979 9.779 37 H LEU 6 H LEU 6 -9.019 9.233 6.033 38 HA LEU 6 HA LEU 6 -10.356 8.789 3.628 39 HB3 LEU 6 2HB LEU 6 -8.505 6.638 4.207 40 HG LEU 6 HG LEU 6 -8.577 9.016 2.380 41 HD11 LEU 6 1HD1 LEU 6 -6.405 9.331 3.490 42 HD12 LEU 6 2HD1 LEU 6 -5.972 7.647 3.124 43 HD13 LEU 6 3HD1 LEU 6 -6.215 8.823 1.804 44 HD21 LEU 6 3HD2 LEU 6 -7.833 7.329 0.742 45 HD22 LEU 6 1HD2 LEU 6 -7.630 6.129 2.035 46 HD23 LEU 6 2HD2 LEU 6 -9.250 6.735 1.628 47 H GLU 7 H GLU 7 -11.575 7.219 2.740 48 HA GLU 7 HA GLU 7 -13.351 5.828 4.464 49 HB3 GLU 7 2HB GLU 7 -13.462 4.657 1.840 50 HG3 GLU 7 2HG GLU 7 -15.301 5.709 3.577 51 HA PRO 8 HA PRO 8 -11.297 1.925 5.095 52 HB3 PRO 8 2HB PRO 8 -12.937 1.444 6.642 53 HG3 PRO 8 2HG PRO 8 -15.127 2.124 6.381 54 HD3 PRO 8 2HD PRO 8 -14.224 4.135 5.706 55 H ILE 9 H ILE 9 -10.444 0.347 3.796 56 HA ILE 9 HA ILE 9 -11.737 -0.212 1.153 57 HB ILE 9 HB ILE 9 -9.333 -0.688 0.410 58 HG13 ILE 9 2HG1 ILE 9 -7.510 0.278 1.322 59 HG21 ILE 9 1HG2 ILE 9 -10.774 0.973 -0.531 60 HG22 ILE 9 2HG2 ILE 9 -10.328 2.134 0.750 61 HG23 ILE 9 3HG2 ILE 9 -9.106 1.584 -0.429 62 HD11 ILE 9 3HD1 ILE 9 -7.365 1.928 3.137 63 HD12 ILE 9 1HD1 ILE 9 -8.153 2.627 1.716 64 HD13 ILE 9 2HD1 ILE 9 -9.121 2.131 3.126 65 H TYR 10 H TYR 10 -12.507 -2.099 1.039 66 HA TYR 10 HA TYR 10 -11.534 -4.324 2.745 67 HB3 TYR 10 2HB TYR 10 -13.784 -5.220 2.475 68 HD1 TYR 10 2HD TYR 10 -13.332 -4.718 4.903 69 HD2 TYR 10 1HD TYR 10 -14.967 -1.807 2.168 70 HE1 TYR 10 2HE TYR 10 -14.240 -3.423 6.829 71 HE2 TYR 10 1HE TYR 10 -15.907 -0.534 4.087 72 HH TYR 10 HH TYR 10 -15.445 -1.579 7.486 73 H TRP 11 H TRP 11 -9.784 -4.556 1.023 74 HA TRP 11 HA TRP 11 -8.767 -5.420 -0.763 75 HB3 TRP 11 2HB TRP 11 -10.662 -7.389 -0.202 76 HD1 TRP 11 HD TRP 11 -9.624 -6.919 -3.897 77 HE1 TRP 11 1HE TRP 11 -11.578 -7.619 -5.401 78 HE3 TRP 11 3HE TRP 11 -13.023 -8.229 -0.287 79 HZ2 TRP 11 2HZ TRP 11 -14.192 -8.806 -5.096 80 HZ3 TRP 11 3HZ TRP 11 -15.247 -9.133 -0.934 81 HH2 TRP 11 HH TRP 11 -15.823 -9.472 -3.323 82 H ASN 12 H ASN 12 -12.151 -4.782 -1.606 83 HA ASN 12 HA ASN 12 -12.165 -4.334 -4.282 84 HB3 ASN 12 2HB ASN 12 -13.867 -2.454 -3.730 85 HD21 ASN 12 2HD2 ASN 12 -15.885 -3.190 -4.211 86 HD22 ASN 12 1HD2 ASN 12 -16.399 -4.849 -3.928 87 H SER 13 H SER 13 -10.363 -3.541 -5.244 88 HA SER 13 HA SER 13 -8.914 -1.326 -4.340 89 HB3 SER 13 2HB SER 13 -8.887 -1.840 -7.287 90 HG SER 13 HG SER 13 -6.636 -1.913 -6.762 91 H SER 14 H SER 14 -11.817 -1.409 -6.205 92 HA SER 14 HA SER 14 -12.095 1.162 -7.318 93 HB3 SER 14 2HB SER 14 -13.412 -0.720 -8.007 94 HG SER 14 HG SER 14 -15.106 -1.447 -6.485 95 H ASN 15 H ASN 15 -11.067 1.682 -4.705 96 HA ASN 15 HA ASN 15 -13.071 2.698 -2.911 97 HB3 ASN 15 2HB ASN 15 -10.164 3.580 -3.270 98 HD21 ASN 15 2HD2 ASN 15 -12.524 2.701 -0.630 99 HD22 ASN 15 1HD2 ASN 15 -12.175 4.161 0.270 100 H SER 16 H SER 16 -13.358 5.022 -2.355 101 HA SER 16 HA SER 16 -14.046 6.798 -4.477 102 HB3 SER 16 2HB SER 16 -13.308 7.375 -1.583 103 HG SER 16 HG SER 16 -14.707 9.188 -1.966 104 H LYS 17 H LYS 17 -10.989 6.549 -2.567 105 HA LYS 17 HA LYS 17 -9.720 8.741 -4.071 106 HB3 LYS 17 2HB LYS 17 -7.792 7.351 -2.495 107 HG3 LYS 17 2HG LYS 17 -7.963 9.786 -2.809 108 HD3 LYS 17 2HD LYS 17 -9.685 10.214 -0.446 109 HE3 LYS 17 2HE LYS 17 -10.803 11.855 -2.017 110 HZ1 LYS 17 3HZ LYS 17 -8.849 13.278 -2.262 111 HZ2 LYS 17 1HZ LYS 17 -8.851 12.590 -0.783 112 HZ3 LYS 17 2HZ LYS 17 -7.835 12.040 -1.944 113 H PHE 18 H PHE 18 -10.185 5.547 -4.857 114 HA PHE 18 HA PHE 18 -7.656 4.958 -6.181 115 HB3 PHE 18 2HB PHE 18 -10.365 3.662 -6.556 116 HD1 PHE 18 2HD PHE 18 -6.994 2.228 -5.976 117 HD2 PHE 18 1HD PHE 18 -10.170 2.833 -8.819 118 HE1 PHE 18 2HE PHE 18 -5.931 0.581 -7.494 119 HE2 PHE 18 1HE PHE 18 -9.142 1.132 -10.316 120 HZ PHE 18 HZ PHE 18 -7.016 0.013 -9.662 121 H LEU 19 H LEU 19 -7.063 6.487 -7.622 122 HA LEU 19 HA LEU 19 -9.073 7.645 -9.424 123 HB3 LEU 19 2HB LEU 19 -6.268 8.695 -9.430 124 HG LEU 19 HG LEU 19 -9.080 9.716 -9.648 125 HD11 LEU 19 1HD1 LEU 19 -8.508 10.616 -7.449 126 HD12 LEU 19 2HD1 LEU 19 -7.020 11.328 -8.110 127 HD13 LEU 19 3HD1 LEU 19 -8.615 11.893 -8.667 128 HD21 LEU 19 3HD2 LEU 19 -8.036 11.415 -11.032 129 HD22 LEU 19 1HD2 LEU 19 -6.415 10.900 -10.516 130 HD23 LEU 19 2HD2 LEU 19 -7.427 9.819 -11.504 131 HA PRO 20 HA PRO 20 -7.655 4.815 -12.539 132 HB3 PRO 20 2HB PRO 20 -9.737 4.889 -13.450 133 HG3 PRO 20 2HG PRO 20 -11.047 6.836 -13.361 134 HD3 PRO 20 2HD PRO 20 -10.289 6.781 -11.160 135 H GLY 21 H GLY 21 -5.517 4.951 -12.882 136 HA2 GLY 21 2HA GLY 21 -4.321 5.852 -15.154 137 H GLN 22 H GLN 22 -3.486 6.464 -11.708 138 HA GLN 22 HA GLN 22 -0.962 4.864 -12.019 139 HB3 GLN 22 2HB GLN 22 -0.675 6.068 -9.598 140 HG3 GLN 22 2HG GLN 22 -0.051 7.210 -12.347 141 HE21 GLN 22 2HE2 GLN 22 0.172 9.453 -12.126 142 HE22 GLN 22 1HE2 GLN 22 0.932 10.212 -10.737 143 H GLY 23 H GLY 23 -3.896 5.144 -10.045 144 HA2 GLY 23 2HA GLY 23 -4.674 2.725 -9.521 145 H LEU 24 H LEU 24 -3.103 4.144 -6.701 146 HA LEU 24 HA LEU 24 -5.698 5.318 -5.742 147 HB3 LEU 24 2HB LEU 24 -3.766 3.396 -4.407 148 HG LEU 24 HG LEU 24 -4.289 5.067 -2.712 149 HD11 LEU 24 1HD1 LEU 24 -6.500 5.837 -3.554 150 HD12 LEU 24 2HD1 LEU 24 -7.215 4.290 -3.056 151 HD13 LEU 24 3HD1 LEU 24 -6.523 5.397 -1.847 152 HD21 LEU 24 3HD2 LEU 24 -5.259 3.492 -1.039 153 HD22 LEU 24 1HD2 LEU 24 -5.760 2.416 -2.353 154 HD23 LEU 24 2HD2 LEU 24 -4.031 2.710 -2.050 155 H VAL 25 H VAL 25 -5.556 7.304 -4.700 156 HA VAL 25 HA VAL 25 -2.796 8.479 -4.404 157 HB VAL 25 HB VAL 25 -5.484 9.888 -4.617 158 HG11 VAL 25 1HG1 VAL 25 -3.910 11.153 -3.184 159 HG12 VAL 25 2HG1 VAL 25 -2.630 10.967 -4.399 160 HG13 VAL 25 3HG1 VAL 25 -4.068 11.944 -4.751 161 HG21 VAL 25 3HG2 VAL 25 -4.547 10.732 -6.766 162 HG22 VAL 25 1HG2 VAL 25 -3.116 9.704 -6.546 163 HG23 VAL 25 2HG2 VAL 25 -4.715 8.977 -6.795 164 H LEU 26 H LEU 26 -2.049 8.809 -2.441 165 HA LEU 26 HA LEU 26 -3.916 8.737 -0.090 166 HB3 LEU 26 2HB LEU 26 -1.508 8.266 1.079 167 HG LEU 26 HG LEU 26 -1.794 5.895 1.172 168 HD11 LEU 26 1HD1 LEU 26 -3.195 7.329 2.620 169 HD12 LEU 26 2HD1 LEU 26 -4.472 7.298 1.379 170 HD13 LEU 26 3HD1 LEU 26 -3.999 5.804 2.186 171 HD21 LEU 26 3HD2 LEU 26 -3.597 4.723 0.073 172 HD22 LEU 26 1HD2 LEU 26 -4.107 6.209 -0.756 173 HD23 LEU 26 2HD2 LEU 26 -2.546 5.450 -1.149 174 H TYR 27 H TYR 27 -3.106 9.934 1.732 175 HA TYR 27 HA TYR 27 -1.595 12.412 1.103 176 HB3 TYR 27 2HB TYR 27 -3.886 12.952 2.828 177 HD1 TYR 27 2HD TYR 27 -3.296 13.259 -0.880 178 HD2 TYR 27 1HD TYR 27 -3.521 15.267 2.938 179 HE1 TYR 27 2HE TYR 27 -3.054 15.455 -2.023 180 HE2 TYR 27 1HE TYR 27 -3.282 17.467 1.790 181 HH TYR 27 HH TYR 27 -2.946 17.735 -1.771 182 HA PRO 28 HA PRO 28 -0.214 10.667 5.107 183 HB3 PRO 28 2HB PRO 28 1.650 9.856 3.990 184 HG3 PRO 28 2HG PRO 28 2.704 11.080 2.257 185 HD3 PRO 28 2HD PRO 28 0.486 11.094 1.429 186 H GLN 29 H GLN 29 -1.716 12.531 5.673 187 HA GLN 29 HA GLN 29 -0.121 14.767 6.864 188 HB3 GLN 29 2HB GLN 29 -2.625 15.825 6.777 189 HG3 GLN 29 2HG GLN 29 -0.921 16.119 4.309 190 HE21 GLN 29 2HE2 GLN 29 -0.354 18.920 5.543 191 HE22 GLN 29 1HE2 GLN 29 -1.863 19.778 5.251 192 H ILE 30 H ILE 30 -0.791 15.585 8.834 193 HA ILE 30 HA ILE 30 -1.809 13.463 10.603 194 HB ILE 30 HB ILE 30 -0.652 16.160 11.356 195 HG13 ILE 30 2HG1 ILE 30 1.404 14.862 11.957 196 HG21 ILE 30 1HG2 ILE 30 -2.063 15.096 13.122 197 HG22 ILE 30 2HG2 ILE 30 -1.057 13.635 13.035 198 HG23 ILE 30 3HG2 ILE 30 -0.356 15.167 13.574 199 HD11 ILE 30 3HD1 ILE 30 1.940 12.762 10.971 200 HD12 ILE 30 1HD1 ILE 30 0.423 12.489 11.816 201 HD13 ILE 30 2HD1 ILE 30 0.434 12.690 10.052 202 H GLY 31 H GLY 31 -3.823 13.357 11.143 203 HA2 GLY 31 2HA GLY 31 -5.831 14.716 12.059 204 H ASP 32 H ASP 32 -4.780 12.709 9.456 205 HA ASP 32 HA ASP 32 -7.506 11.563 9.107 206 HB3 ASP 32 2HB ASP 32 -7.401 12.354 7.033 207 H LYS 33 H LYS 33 -7.664 9.433 8.466 208 HA LYS 33 HA LYS 33 -5.453 7.592 9.133 209 HB3 LYS 33 2HB LYS 33 -6.458 7.829 11.261 210 HG3 LYS 33 2HG LYS 33 -9.082 7.961 9.834 211 HD3 LYS 33 2HD LYS 33 -8.607 6.661 12.542 212 HE3 LYS 33 2HE LYS 33 -10.941 8.272 11.515 213 HZ1 LYS 33 3HZ LYS 33 -12.342 7.027 13.094 214 HZ2 LYS 33 1HZ LYS 33 -11.874 6.077 11.859 215 HZ3 LYS 33 2HZ LYS 33 -11.167 5.925 13.321 216 H LEU 34 H LEU 34 -5.732 5.535 8.384 217 HA LEU 34 HA LEU 34 -7.869 4.979 6.417 218 HB3 LEU 34 2HB LEU 34 -6.580 5.857 4.778 219 HG LEU 34 HG LEU 34 -4.225 5.769 4.355 220 HD11 LEU 34 1HD1 LEU 34 -5.297 7.814 5.452 221 HD12 LEU 34 2HD1 LEU 34 -4.475 7.301 6.944 222 HD13 LEU 34 3HD1 LEU 34 -3.539 7.660 5.499 223 HD21 LEU 34 3HD2 LEU 34 -2.573 5.355 6.061 224 HD22 LEU 34 1HD2 LEU 34 -3.852 4.957 7.226 225 HD23 LEU 34 2HD2 LEU 34 -3.577 3.915 5.807 226 H ASP 35 H ASP 35 -8.282 2.891 6.230 227 HA ASP 35 HA ASP 35 -6.559 0.953 7.645 228 HB3 ASP 35 2HB ASP 35 -8.156 1.426 9.267 229 H ILE 36 H ILE 36 -5.885 -0.490 6.479 230 HA ILE 36 HA ILE 36 -7.109 -1.139 3.874 231 HB ILE 36 HB ILE 36 -4.490 -2.270 4.125 232 HG13 ILE 36 2HG1 ILE 36 -3.876 -0.628 5.778 233 HG21 ILE 36 1HG2 ILE 36 -5.811 -1.651 2.077 234 HG22 ILE 36 2HG2 ILE 36 -5.423 0.057 2.419 235 HG23 ILE 36 3HG2 ILE 36 -4.132 -1.111 2.050 236 HD11 ILE 36 3HD1 ILE 36 -2.032 0.493 4.794 237 HD12 ILE 36 1HD1 ILE 36 -2.206 -1.042 3.924 238 HD13 ILE 36 2HD1 ILE 36 -2.767 0.472 3.181 239 H ILE 37 H ILE 37 -8.221 -2.907 3.685 240 HA ILE 37 HA ILE 37 -7.590 -5.264 5.421 241 HB ILE 37 HB ILE 37 -10.261 -4.239 4.405 242 HG13 ILE 37 2HG1 ILE 37 -8.813 -3.878 6.934 243 HG21 ILE 37 1HG2 ILE 37 -10.330 -6.654 4.266 244 HG22 ILE 37 2HG2 ILE 37 -9.672 -6.805 5.916 245 HG23 ILE 37 3HG2 ILE 37 -11.288 -6.120 5.640 246 HD11 ILE 37 3HD1 ILE 37 -10.543 -2.199 7.330 247 HD12 ILE 37 1HD1 ILE 37 -9.949 -2.051 5.663 248 HD13 ILE 37 2HD1 ILE 37 -11.511 -2.827 5.985 249 H CYS 38 H CYS 38 -7.433 -7.182 4.471 250 HA CYS 38 HA CYS 38 -7.986 -7.524 1.587 251 HB3 CYS 38 2HB CYS 38 -5.336 -7.823 2.969 252 HA PRO 39 HA PRO 39 -9.512 -11.301 3.636 253 HB3 PRO 39 2HB PRO 39 -11.347 -11.032 2.239 254 HG3 PRO 39 2HG PRO 39 -11.143 -10.253 0.018 255 HD3 PRO 39 2HD PRO 39 -10.016 -8.625 1.256 256 H LYS 40 H LYS 40 -9.444 -13.752 2.776 257 HA LYS 40 HA LYS 40 -6.634 -14.345 1.947 258 HB3 LYS 40 2HB LYS 40 -8.348 -16.278 3.527 259 HG3 LYS 40 2HG LYS 40 -6.072 -16.633 4.603 260 HD3 LYS 40 2HD LYS 40 -6.339 -17.282 1.646 261 HE3 LYS 40 2HE LYS 40 -4.766 -19.244 2.607 262 HZ1 LYS 40 3HZ LYS 40 -2.898 -18.071 1.579 263 HZ2 LYS 40 1HZ LYS 40 -4.233 -17.984 0.656 264 HZ3 LYS 40 2HZ LYS 40 -3.757 -16.676 1.517 265 H VAL 41 H VAL 41 -6.611 -14.740 -0.082 266 HA VAL 41 HA VAL 41 -8.404 -15.759 -1.929 267 HB VAL 41 HB VAL 41 -6.429 -15.037 -2.827 268 HG11 VAL 41 1HG1 VAL 41 -4.949 -15.074 -0.920 269 HG12 VAL 41 2HG1 VAL 41 -4.807 -16.854 -1.029 270 HG13 VAL 41 3HG1 VAL 41 -4.171 -15.804 -2.313 271 HG21 VAL 41 3HG2 VAL 41 -5.308 -16.946 -3.942 272 HG22 VAL 41 1HG2 VAL 41 -6.145 -18.079 -2.922 273 HG23 VAL 41 2HG2 VAL 41 -7.088 -17.048 -4.032 274 H ASP 42 H ASP 42 -9.705 -17.354 -1.734 275 HA ASP 42 HA ASP 42 -9.266 -20.035 -1.984 276 HB3 ASP 42 2HB ASP 42 -10.170 -20.668 0.488 277 H SER 43 H SER 43 -11.359 -18.175 0.263 278 HA SER 43 HA SER 43 -13.821 -19.364 -0.837 279 HB3 SER 43 2HB SER 43 -13.247 -17.307 1.326 280 HG SER 43 HG SER 43 -15.448 -17.579 1.868 281 H LYS 44 H LYS 44 -12.232 -16.171 -0.853 282 HA LYS 44 HA LYS 44 -14.334 -14.859 -2.398 283 HB3 LYS 44 2HB LYS 44 -12.749 -12.934 -2.394 284 HG3 LYS 44 2HG LYS 44 -12.437 -12.592 0.001 285 HD3 LYS 44 2HD LYS 44 -15.026 -13.802 0.433 286 HE3 LYS 44 2HE LYS 44 -15.717 -11.316 -0.114 287 HZ1 LYS 44 3HZ LYS 44 -14.837 -10.589 2.044 288 HZ2 LYS 44 1HZ LYS 44 -15.504 -12.068 2.155 289 HZ3 LYS 44 2HZ LYS 44 -13.878 -11.909 2.148 290 H THR 45 H THR 45 -11.464 -16.571 -3.258 291 HA THR 45 HA THR 45 -10.334 -16.947 -5.209 292 HB THR 45 HB THR 45 -13.077 -16.837 -6.496 293 HG1 THR 45 1HG THR 45 -13.338 -18.926 -5.650 294 HG21 THR 45 3HG2 THR 45 -12.309 -18.861 -7.679 295 HG22 THR 45 1HG2 THR 45 -11.175 -17.547 -7.997 296 HG23 THR 45 2HG2 THR 45 -10.758 -18.805 -6.815 297 H VAL 46 H VAL 46 -10.249 -14.196 -4.591 298 HA VAL 46 HA VAL 46 -10.637 -12.683 -7.063 299 HB VAL 46 HB VAL 46 -10.934 -11.855 -4.656 300 HG11 VAL 46 1HG1 VAL 46 -8.661 -12.465 -3.793 301 HG12 VAL 46 2HG1 VAL 46 -7.968 -11.217 -4.861 302 HG13 VAL 46 3HG1 VAL 46 -9.095 -10.763 -3.571 303 HG21 VAL 46 3HG2 VAL 46 -10.324 -9.574 -5.303 304 HG22 VAL 46 1HG2 VAL 46 -9.482 -10.171 -6.723 305 HG23 VAL 46 2HG2 VAL 46 -11.235 -10.431 -6.559 306 H GLY 47 H GLY 47 -8.228 -14.791 -6.110 307 HA2 GLY 47 2HA GLY 47 -6.500 -14.383 -8.306 308 H GLN 48 H GLN 48 -7.002 -16.726 -7.762 309 HA GLN 48 HA GLN 48 -5.648 -18.191 -5.677 310 HB3 GLN 48 2HB GLN 48 -6.147 -20.152 -7.256 311 HG3 GLN 48 2HG GLN 48 -8.497 -18.489 -6.296 312 HE21 GLN 48 2HE2 GLN 48 -8.920 -21.232 -4.749 313 HE22 GLN 48 1HE2 GLN 48 -9.691 -22.217 -5.989 314 H TYR 49 H TYR 49 -3.729 -16.644 -6.250 315 HA TYR 49 HA TYR 49 -1.741 -17.945 -8.033 316 HB3 TYR 49 2HB TYR 49 -0.897 -15.493 -6.662 317 HD1 TYR 49 1HD TYR 49 -2.465 -16.644 -9.911 318 HD2 TYR 49 2HD TYR 49 0.807 -14.608 -7.953 319 HE1 TYR 49 1HE TYR 49 -1.342 -16.313 -12.116 320 HE2 TYR 49 2HE TYR 49 1.888 -14.242 -10.153 321 HH TYR 49 HH TYR 49 1.824 -14.652 -12.399 322 H GLU 50 H GLU 50 -1.745 -16.445 -4.806 323 HA GLU 50 HA GLU 50 -1.168 -18.668 -3.231 324 HB3 GLU 50 2HB GLU 50 1.399 -17.355 -2.930 325 HG3 GLU 50 2HG GLU 50 0.692 -20.128 -3.948 326 H TYR 51 H TYR 51 0.311 -15.423 -3.339 327 HA TYR 51 HA TYR 51 -1.005 -14.543 -0.831 328 HB3 TYR 51 2HB TYR 51 1.163 -14.103 0.178 329 HD1 TYR 51 1HD TYR 51 -0.686 -16.413 0.629 330 HD2 TYR 51 2HD TYR 51 3.379 -16.367 -0.805 331 HE1 TYR 51 1HE TYR 51 -0.393 -18.766 1.392 332 HE2 TYR 51 2HE TYR 51 3.676 -18.702 -0.022 333 HH TYR 51 HH TYR 51 2.671 -20.548 0.942 334 H TYR 52 H TYR 52 -0.441 -12.174 -0.367 335 HA TYR 52 HA TYR 52 0.276 -10.623 -2.821 336 HB3 TYR 52 2HB TYR 52 -1.618 -9.026 -1.983 337 HD1 TYR 52 1HD TYR 52 -0.848 -9.410 -4.554 338 HD2 TYR 52 2HD TYR 52 -3.939 -11.566 -2.439 339 HE1 TYR 52 1HE TYR 52 -1.999 -9.878 -6.711 340 HE2 TYR 52 2HE TYR 52 -5.100 -12.013 -4.597 341 HH TYR 52 HH TYR 52 -5.126 -11.599 -6.872 342 H LYS 53 H LYS 53 1.832 -9.288 -2.449 343 HA LYS 53 HA LYS 53 1.873 -7.735 0.076 344 HB3 LYS 53 2HB LYS 53 4.413 -7.806 -0.028 345 HG3 LYS 53 2HG LYS 53 2.638 -9.365 1.332 346 HD3 LYS 53 2HD LYS 53 3.452 -11.251 -0.466 347 HE3 LYS 53 2HE LYS 53 5.677 -10.810 1.352 348 HZ1 LYS 53 3HZ LYS 53 5.884 -13.020 2.225 349 HZ2 LYS 53 1HZ LYS 53 4.462 -12.400 2.758 350 HZ3 LYS 53 2HZ LYS 53 4.481 -13.506 1.535 351 H VAL 54 H VAL 54 2.649 -5.763 0.006 352 HA VAL 54 HA VAL 54 2.847 -4.443 -2.687 353 HB VAL 54 HB VAL 54 1.522 -3.388 -0.165 354 HG11 VAL 54 1HG1 VAL 54 2.507 -1.612 -1.360 355 HG12 VAL 54 2HG1 VAL 54 1.807 -2.149 -2.911 356 HG13 VAL 54 3HG1 VAL 54 0.764 -1.530 -1.602 357 HG21 VAL 54 3HG2 VAL 54 -0.595 -3.461 -1.430 358 HG22 VAL 54 1HG2 VAL 54 0.242 -4.206 -2.812 359 HG23 VAL 54 2HG2 VAL 54 0.073 -5.089 -1.275 360 H TYR 55 H TYR 55 4.435 -2.936 -2.906 361 HA TYR 55 HA TYR 55 6.480 -2.877 -0.736 362 HB3 TYR 55 2HB TYR 55 8.101 -3.272 -2.432 363 HD1 TYR 55 1HD TYR 55 7.353 -5.339 -0.786 364 HD2 TYR 55 2HD TYR 55 6.191 -4.788 -4.907 365 HE1 TYR 55 1HE TYR 55 6.961 -7.797 -1.014 366 HE2 TYR 55 2HE TYR 55 5.827 -7.239 -5.139 367 HH TYR 55 HH TYR 55 5.902 -9.286 -4.092 368 H MET 56 H MET 56 7.839 -1.028 -0.579 369 HA MET 56 HA MET 56 6.635 1.451 -1.729 370 HB3 MET 56 2HB MET 56 7.594 2.639 0.079 371 HG3 MET 56 2HG MET 56 6.547 0.022 1.219 372 HE1 MET 56 3HE MET 56 5.574 4.083 3.156 373 HE2 MET 56 1HE MET 56 6.109 3.933 1.461 374 HE3 MET 56 2HE MET 56 4.572 3.214 1.980 375 H VAL 57 H VAL 57 7.647 2.617 -3.191 376 HA VAL 57 HA VAL 57 10.499 2.699 -3.750 377 HB VAL 57 HB VAL 57 9.711 1.685 -6.182 378 HG11 VAL 57 1HG1 VAL 57 11.811 1.228 -4.952 379 HG12 VAL 57 2HG1 VAL 57 10.962 -0.101 -4.109 380 HG13 VAL 57 3HG1 VAL 57 11.101 -0.086 -5.900 381 HG21 VAL 57 3HG2 VAL 57 8.590 -0.336 -6.051 382 HG22 VAL 57 1HG2 VAL 57 8.573 -0.373 -4.272 383 HG23 VAL 57 2HG2 VAL 57 7.567 0.781 -5.152 384 H ASP 58 H ASP 58 10.991 4.129 -5.406 385 HA ASP 58 HA ASP 58 9.354 6.375 -5.590 386 HB3 ASP 58 2HB ASP 58 11.088 7.305 -6.934 387 H LYS 59 H LYS 59 8.342 7.502 -7.467 388 HA LYS 59 HA LYS 59 6.824 5.962 -9.301 389 HB3 LYS 59 2HB LYS 59 7.906 8.781 -9.598 390 HG3 LYS 59 2HG LYS 59 6.354 7.428 -11.503 391 HD3 LYS 59 2HD LYS 59 4.505 8.797 -9.564 392 HE3 LYS 59 2HE LYS 59 3.049 9.091 -11.755 393 HZ1 LYS 59 3HZ LYS 59 3.829 11.404 -11.888 394 HZ2 LYS 59 1HZ LYS 59 3.673 10.944 -10.332 395 HZ3 LYS 59 2HZ LYS 59 5.152 11.052 -11.005 396 H ASP 60 H ASP 60 10.176 7.058 -9.643 397 HA ASP 60 HA ASP 60 10.522 6.456 -12.408 398 HB3 ASP 60 2HB ASP 60 12.694 6.107 -10.329 399 H GLN 61 H GLN 61 10.405 4.329 -9.627 400 HA GLN 61 HA GLN 61 11.376 1.907 -10.992 401 HB3 GLN 61 2HB GLN 61 10.361 0.987 -8.695 402 HG3 GLN 61 2HG GLN 61 12.290 1.848 -7.382 403 HE21 GLN 61 2HE2 GLN 61 13.760 2.068 -10.618 404 HE22 GLN 61 1HE2 GLN 61 14.305 0.393 -10.619 405 H ALA 62 H ALA 62 8.205 3.394 -10.147 406 HA ALA 62 HA ALA 62 6.576 1.298 -11.247 407 HB1 ALA 62 3HB ALA 62 4.823 3.067 -11.427 408 HB2 ALA 62 1HB ALA 62 5.562 3.044 -9.823 409 HB3 ALA 62 2HB ALA 62 6.008 4.296 -10.994 410 H ASP 63 H ASP 63 8.151 4.073 -12.766 411 HA ASP 63 HA ASP 63 6.897 4.158 -15.240 412 HB3 ASP 63 2HB ASP 63 9.886 4.556 -14.963 413 H ARG 64 H ARG 64 9.353 1.905 -14.162 414 HA ARG 64 HA ARG 64 9.408 0.420 -16.764 415 HB3 ARG 64 2HB ARG 64 11.353 -0.775 -15.613 416 HG3 ARG 64 2HG ARG 64 12.898 1.266 -15.586 417 HD3 ARG 64 2HD ARG 64 12.002 1.667 -18.199 418 HE ARG 64 HE ARG 64 14.183 0.419 -17.047 419 HH11 ARG 64 1HH2 ARG 64 12.218 -0.370 -19.839 420 HH12 ARG 64 2HH2 ARG 64 13.561 -1.095 -20.685 421 HH21 ARG 64 1HH1 ARG 64 15.845 -0.493 -18.189 422 HH22 ARG 64 2HH1 ARG 64 15.555 -1.154 -19.775 423 H CYS 65 H CYS 65 7.569 0.389 -14.021 424 HA CYS 65 HA CYS 65 6.656 -1.096 -12.600 425 HB3 CYS 65 2HB CYS 65 6.480 -2.748 -15.130 426 H THR 66 H THR 66 9.246 -0.947 -12.099 427 HA THR 66 HA THR 66 9.909 -3.738 -11.385 428 HB THR 66 HB THR 66 12.263 -3.411 -11.658 429 HG1 THR 66 1HG THR 66 13.075 -1.550 -12.630 430 HG21 THR 66 3HG2 THR 66 12.488 -3.291 -14.067 431 HG22 THR 66 1HG2 THR 66 10.918 -4.048 -13.752 432 HG23 THR 66 2HG2 THR 66 10.980 -2.361 -14.204 433 H ILE 67 H ILE 67 10.644 -4.062 -9.308 434 HA ILE 67 HA ILE 67 10.332 -1.728 -7.438 435 HB ILE 67 HB ILE 67 10.278 -4.644 -6.637 436 HG13 ILE 67 2HG1 ILE 67 7.806 -4.538 -6.629 437 HG21 ILE 67 1HG2 ILE 67 10.530 -2.881 -4.864 438 HG22 ILE 67 2HG2 ILE 67 8.867 -2.397 -5.246 439 HG23 ILE 67 3HG2 ILE 67 9.205 -4.029 -4.686 440 HD11 ILE 67 3HD1 ILE 67 6.525 -3.053 -7.968 441 HD12 ILE 67 1HD1 ILE 67 7.537 -2.009 -6.982 442 HD13 ILE 67 2HD1 ILE 67 7.955 -2.299 -8.687 443 H LYS 68 H LYS 68 12.015 -1.474 -5.834 444 HA LYS 68 HA LYS 68 14.649 -2.574 -6.633 445 HB3 LYS 68 2HB LYS 68 14.227 -0.634 -4.333 446 HG3 LYS 68 2HG LYS 68 16.513 -1.497 -5.152 447 HD3 LYS 68 2HD LYS 68 16.113 0.548 -7.376 448 HE3 LYS 68 2HE LYS 68 18.095 -1.724 -6.902 449 HZ1 LYS 68 3HZ LYS 68 19.174 -0.866 -8.890 450 HZ2 LYS 68 1HZ LYS 68 17.665 -1.350 -9.274 451 HZ3 LYS 68 2HZ LYS 68 18.002 0.244 -9.128 452 H LYS 69 H LYS 69 15.892 -3.934 -5.213 453 HA LYS 69 HA LYS 69 14.471 -5.517 -3.252 454 HB3 LYS 69 2HB LYS 69 16.494 -6.330 -4.400 455 HG3 LYS 69 2HG LYS 69 17.807 -4.039 -2.914 456 HD3 LYS 69 2HD LYS 69 19.365 -6.479 -3.802 457 HE3 LYS 69 2HE LYS 69 19.929 -4.038 -2.044 458 HZ1 LYS 69 3HZ LYS 69 22.203 -4.843 -2.084 459 HZ2 LYS 69 1HZ LYS 69 21.250 -6.003 -1.445 460 HZ3 LYS 69 2HZ LYS 69 21.801 -6.148 -2.980 461 H GLU 70 H GLU 70 15.944 -2.428 -2.959 462 HA GLU 70 HA GLU 70 16.013 -2.274 -0.064 463 HB3 GLU 70 2HB GLU 70 16.394 0.122 -0.468 464 HG3 GLU 70 2HG GLU 70 18.064 -1.272 -2.561 465 H ASN 71 H ASN 71 13.326 -2.581 -1.987 466 HA ASN 71 HA ASN 71 11.474 -0.809 -0.708 467 HB3 ASN 71 2HB ASN 71 11.099 -2.230 -2.796 468 HD21 ASN 71 2HD2 ASN 71 11.819 -4.359 -3.316 469 HD22 ASN 71 1HD2 ASN 71 11.119 -5.799 -2.544 470 H THR 72 H THR 72 9.594 -1.931 0.581 471 HA THR 72 HA THR 72 10.590 -3.749 2.670 472 HB THR 72 HB THR 72 10.670 -1.233 3.340 473 HG1 THR 72 1HG THR 72 10.362 -1.842 5.399 474 HG21 THR 72 3HG2 THR 72 8.696 -0.283 4.309 475 HG22 THR 72 1HG2 THR 72 8.312 -0.716 2.636 476 HG23 THR 72 2HG2 THR 72 7.736 -1.741 3.975 477 HA PRO 73 HA PRO 73 6.500 -5.461 1.815 478 HB3 PRO 73 2HB PRO 73 7.373 -7.480 2.517 479 HG3 PRO 73 2HG PRO 73 8.876 -7.633 4.322 480 HD3 PRO 73 2HD PRO 73 9.926 -5.930 3.144 481 H LEU 74 H LEU 74 5.827 -3.178 2.234 482 HA LEU 74 HA LEU 74 4.822 -2.146 4.694 483 HB3 LEU 74 2HB LEU 74 4.490 -1.616 1.786 484 HG LEU 74 HG LEU 74 2.120 -1.454 2.357 485 HD11 LEU 74 1HD1 LEU 74 2.092 -0.978 4.789 486 HD12 LEU 74 2HD1 LEU 74 2.954 0.550 4.501 487 HD13 LEU 74 3HD1 LEU 74 1.299 0.308 3.897 488 HD21 LEU 74 3HD2 LEU 74 1.777 0.788 1.653 489 HD22 LEU 74 1HD2 LEU 74 3.409 1.263 2.190 490 HD23 LEU 74 2HD2 LEU 74 3.205 0.137 0.826 491 H LEU 75 H LEU 75 3.045 -3.900 2.113 492 HA LEU 75 HA LEU 75 0.950 -4.546 4.145 493 HB3 LEU 75 2HB LEU 75 0.475 -4.744 1.172 494 HG LEU 75 HG LEU 75 -1.745 -3.769 1.757 495 HD11 LEU 75 1HD1 LEU 75 -1.466 -6.207 1.387 496 HD12 LEU 75 2HD1 LEU 75 -1.257 -6.431 3.138 497 HD13 LEU 75 3HD1 LEU 75 -2.781 -5.803 2.498 498 HD21 LEU 75 3HD2 LEU 75 -2.575 -3.678 3.966 499 HD22 LEU 75 1HD2 LEU 75 -1.184 -4.541 4.642 500 HD23 LEU 75 2HD2 LEU 75 -0.981 -2.888 4.028 501 H ASN 76 H ASN 76 0.673 -6.544 4.674 502 HA ASN 76 HA ASN 76 1.757 -8.791 3.063 503 HB3 ASN 76 2HB ASN 76 2.198 -8.186 6.005 504 HD21 ASN 76 2HD2 ASN 76 2.309 -9.928 7.349 505 HD22 ASN 76 1HD2 ASN 76 2.526 -11.582 6.817 506 H CYS 77 H CYS 77 -0.245 -9.362 2.286 507 HA CYS 77 HA CYS 77 -2.106 -10.470 4.330 508 HB3 CYS 77 2HB CYS 77 -2.990 -8.331 3.324 509 H ALA 78 H ALA 78 -3.554 -12.092 3.390 510 HA ALA 78 HA ALA 78 -3.734 -14.219 2.748 511 HB1 ALA 78 3HB ALA 78 -3.134 -14.784 0.379 512 HB2 ALA 78 1HB ALA 78 -4.134 -13.303 0.556 513 HB3 ALA 78 2HB ALA 78 -2.397 -13.181 0.235 514 H LYS 79 H LYS 79 -2.683 -15.425 4.174 515 HA LYS 79 HA LYS 79 -0.524 -17.113 3.524 516 HB3 LYS 79 2HB LYS 79 0.864 -15.947 5.683 517 HG3 LYS 79 2HG LYS 79 1.274 -16.011 2.701 518 HD3 LYS 79 2HD LYS 79 2.357 -13.925 3.816 519 HE3 LYS 79 2HE LYS 79 3.454 -15.258 5.700 520 HZ1 LYS 79 3HZ LYS 79 5.535 -16.394 5.009 521 HZ2 LYS 79 1HZ LYS 79 4.228 -17.177 4.435 522 HZ3 LYS 79 2HZ LYS 79 5.131 -16.254 3.438 523 HA PRO 80 HA PRO 80 -1.953 -18.056 7.952 524 HB3 PRO 80 2HB PRO 80 -1.646 -16.218 9.317 525 HG3 PRO 80 2HG PRO 80 -2.169 -14.059 8.639 526 HD3 PRO 80 2HD PRO 80 -1.002 -14.607 6.732 527 H ASP 81 H ASP 81 -4.297 -18.228 9.112 528 HA ASP 81 HA ASP 81 -6.252 -18.973 6.998 529 HB3 ASP 81 2HB ASP 81 -5.537 -20.849 8.178 530 H GLN 82 H GLN 82 -6.034 -16.233 7.827 531 HA GLN 82 HA GLN 82 -8.845 -15.719 8.460 532 HB3 GLN 82 2HB GLN 82 -7.327 -13.852 10.071 533 HG3 GLN 82 2HG GLN 82 -9.081 -16.138 11.046 534 HE21 GLN 82 2HE2 GLN 82 -10.296 -13.049 11.698 535 HE22 GLN 82 1HE2 GLN 82 -9.623 -12.876 13.318 536 H ASP 83 H ASP 83 -9.375 -13.372 8.298 537 HA ASP 83 HA ASP 83 -8.302 -12.030 5.971 538 HB3 ASP 83 2HB ASP 83 -10.618 -11.728 6.647 539 H ILE 84 H ILE 84 -6.948 -10.259 5.858 540 HA ILE 84 HA ILE 84 -5.431 -9.486 8.323 541 HB ILE 84 HB ILE 84 -4.535 -10.094 5.591 542 HG13 ILE 84 2HG1 ILE 84 -2.926 -9.444 8.096 543 HG21 ILE 84 1HG2 ILE 84 -4.447 -7.682 5.210 544 HG22 ILE 84 2HG2 ILE 84 -3.617 -7.428 6.764 545 HG23 ILE 84 3HG2 ILE 84 -2.808 -8.291 5.475 546 HD11 ILE 84 3HD1 ILE 84 -2.703 -11.889 8.388 547 HD12 ILE 84 1HD1 ILE 84 -4.345 -11.342 8.723 548 HD13 ILE 84 2HD1 ILE 84 -3.982 -12.155 7.176 549 H LYS 85 H LYS 85 -5.362 -7.487 8.946 550 HA LYS 85 HA LYS 85 -6.527 -5.284 7.396 551 HB3 LYS 85 2HB LYS 85 -8.458 -6.278 8.468 552 HG3 LYS 85 2HG LYS 85 -7.399 -5.531 11.218 553 HD3 LYS 85 2HD LYS 85 -8.990 -7.672 11.616 554 HE3 LYS 85 2HE LYS 85 -11.040 -6.026 11.557 555 HZ1 LYS 85 3HZ LYS 85 -10.253 -5.051 13.630 556 HZ2 LYS 85 1HZ LYS 85 -9.857 -6.627 13.582 557 HZ3 LYS 85 2HZ LYS 85 -8.711 -5.491 13.324 558 H PHE 86 H PHE 86 -5.608 -3.437 7.785 559 HA PHE 86 HA PHE 86 -3.750 -3.030 10.097 560 HB3 PHE 86 2HB PHE 86 -2.409 -1.830 8.086 561 HD1 PHE 86 1HD PHE 86 -2.781 -5.560 7.939 562 HD2 PHE 86 2HD PHE 86 -0.522 -2.204 9.441 563 HE1 PHE 86 1HE PHE 86 -1.049 -7.117 8.817 564 HE2 PHE 86 2HE PHE 86 1.219 -3.757 10.294 565 HZ PHE 86 HZ PHE 86 0.949 -6.214 10.001 566 H THR 87 H THR 87 -4.674 -1.402 11.159 567 HA THR 87 HA THR 87 -5.790 0.919 9.644 568 HB THR 87 HB THR 87 -7.345 -0.017 11.211 569 HG1 THR 87 1HG THR 87 -7.790 1.926 12.231 570 HG21 THR 87 3HG2 THR 87 -7.106 0.068 13.603 571 HG22 THR 87 1HG2 THR 87 -5.802 -0.930 12.950 572 HG23 THR 87 2HG2 THR 87 -5.462 0.734 13.485 573 H ILE 88 H ILE 88 -4.662 2.677 9.445 574 HA ILE 88 HA ILE 88 -2.422 3.281 11.332 575 HB ILE 88 HB ILE 88 -2.654 3.553 8.366 576 HG13 ILE 88 2HG1 ILE 88 -1.208 1.917 9.550 577 HG21 ILE 88 1HG2 ILE 88 -2.570 5.975 8.995 578 HG22 ILE 88 2HG2 ILE 88 -1.160 5.652 10.034 579 HG23 ILE 88 3HG2 ILE 88 -1.070 5.469 8.265 580 HD11 ILE 88 3HD1 ILE 88 0.855 2.235 8.367 581 HD12 ILE 88 1HD1 ILE 88 -0.453 2.788 7.294 582 HD13 ILE 88 2HD1 ILE 88 0.567 3.966 8.164 583 H LYS 89 H LYS 89 -2.781 4.809 12.623 584 HA LYS 89 HA LYS 89 -4.792 6.937 12.058 585 HB3 LYS 89 2HB LYS 89 -5.354 5.983 14.153 586 HG3 LYS 89 2HG LYS 89 -3.580 6.337 16.084 587 HD3 LYS 89 2HD LYS 89 -3.344 3.793 14.432 588 HE3 LYS 89 2HE LYS 89 -3.257 4.387 17.423 589 HZ1 LYS 89 3HZ LYS 89 -2.606 2.077 17.601 590 HZ2 LYS 89 1HZ LYS 89 -4.046 2.136 16.850 591 HZ3 LYS 89 2HZ LYS 89 -2.689 1.845 15.989 592 H PHE 90 H PHE 90 -4.188 9.035 12.168 593 HA PHE 90 HA PHE 90 -1.760 9.959 11.182 594 HB3 PHE 90 2HB PHE 90 -3.600 11.403 11.047 595 HD1 PHE 90 2HD PHE 90 -5.710 10.245 12.032 596 HD2 PHE 90 1HD PHE 90 -3.098 12.794 14.346 597 HE1 PHE 90 2HE PHE 90 -7.412 10.368 13.835 598 HE2 PHE 90 1HE PHE 90 -4.819 12.938 16.122 599 HZ PHE 90 HZ PHE 90 -6.973 11.712 15.882 600 H GLN 91 H GLN 91 0.146 9.290 12.087 601 HA GLN 91 HA GLN 91 0.780 10.346 14.786 602 HB3 GLN 91 2HB GLN 91 1.739 7.569 14.148 603 HG3 GLN 91 2HG GLN 91 2.255 8.833 16.286 604 HE21 GLN 91 2HE2 GLN 91 1.397 10.303 17.805 605 HE22 GLN 91 1HE2 GLN 91 -0.300 10.326 18.268 606 H GLU 92 H GLU 92 2.502 11.589 14.606 607 HA GLU 92 HA GLU 92 4.474 11.215 12.414 608 HB3 GLU 92 2HB GLU 92 4.401 13.335 14.584 609 HG3 GLU 92 2HG GLU 92 5.287 13.595 11.689 610 H PHE 93 H PHE 93 4.229 10.952 15.929 611 HA PHE 93 HA PHE 93 6.953 9.764 16.133 612 HB3 PHE 93 2HB PHE 93 6.102 11.266 18.513 613 HD1 PHE 93 2HD PHE 93 8.148 10.108 19.372 614 HD2 PHE 93 1HD PHE 93 8.286 12.825 16.016 615 HE1 PHE 93 2HE PHE 93 10.618 10.293 19.616 616 HE2 PHE 93 1HE PHE 93 10.753 13.010 16.268 617 HZ PHE 93 HZ PHE 93 11.922 11.737 18.061 618 H SER 94 H SER 94 6.976 7.880 17.218 619 HA SER 94 HA SER 94 4.588 7.053 18.818 620 HB3 SER 94 2HB SER 94 4.715 4.837 17.883 621 HG SER 94 HG SER 94 4.596 5.483 15.512 622 HA PRO 95 HA PRO 95 7.869 6.194 21.721 623 HB3 PRO 95 2HB PRO 95 6.364 6.499 23.407 624 HG3 PRO 95 2HG PRO 95 4.103 5.936 23.156 625 HD3 PRO 95 2HD PRO 95 4.365 6.963 21.094 626 H ASN 96 H ASN 96 5.804 3.422 20.787 627 HA ASN 96 HA ASN 96 8.005 1.912 19.742 628 HB3 ASN 96 2HB ASN 96 6.751 0.300 21.950 629 HD21 ASN 96 2HD2 ASN 96 9.771 0.786 22.959 630 HD22 ASN 96 1HD2 ASN 96 10.629 -0.378 21.964 631 H LEU 97 H LEU 97 7.042 1.135 17.926 632 HA LEU 97 HA LEU 97 4.624 -0.443 17.937 633 HB3 LEU 97 2HB LEU 97 4.012 1.758 16.106 634 HG LEU 97 HG LEU 97 2.710 0.548 18.586 635 HD11 LEU 97 1HD1 LEU 97 2.285 2.933 18.756 636 HD12 LEU 97 2HD1 LEU 97 1.754 2.999 17.063 637 HD13 LEU 97 3HD1 LEU 97 0.811 2.088 18.269 638 HD21 LEU 97 3HD2 LEU 97 0.875 0.100 16.953 639 HD22 LEU 97 1HD2 LEU 97 1.873 0.783 15.658 640 HD23 LEU 97 2HD2 LEU 97 2.383 -0.694 16.516 641 H TRP 98 H TRP 98 3.941 -0.595 15.377 642 HA TRP 98 HA TRP 98 6.041 -1.974 14.051 643 HB3 TRP 98 2HB TRP 98 4.353 -1.596 12.038 644 HD1 TRP 98 HD TRP 98 2.512 -2.877 15.137 645 HE1 TRP 98 1HE TRP 98 2.461 -5.443 15.087 646 HE3 TRP 98 3HE TRP 98 5.550 -3.669 11.086 647 HZ2 TRP 98 2HZ TRP 98 3.615 -7.577 13.499 648 HZ3 TRP 98 3HZ TRP 98 6.063 -5.977 10.327 649 HH2 TRP 98 HH TRP 98 5.111 -7.933 11.526 650 H GLY 99 H GLY 99 5.643 1.414 14.188 651 HA2 GLY 99 2HA GLY 99 7.415 2.825 13.377 652 H LEU 100 H LEU 100 4.745 3.354 13.489 653 HA LEU 100 HA LEU 100 3.509 4.011 10.943 654 HB3 LEU 100 2HB LEU 100 1.734 4.941 12.209 655 HG LEU 100 HG LEU 100 2.863 2.784 14.051 656 HD11 LEU 100 1HD1 LEU 100 1.231 4.227 15.155 657 HD12 LEU 100 2HD1 LEU 100 0.081 4.001 13.824 658 HD13 LEU 100 3HD1 LEU 100 0.531 2.624 14.857 659 HD21 LEU 100 3HD2 LEU 100 1.466 1.198 12.956 660 HD22 LEU 100 1HD2 LEU 100 0.634 2.451 12.022 661 HD23 LEU 100 2HD2 LEU 100 2.326 2.035 11.645 662 H GLU 101 H GLU 101 5.915 5.582 12.875 663 HA GLU 101 HA GLU 101 5.480 8.299 12.552 664 HB3 GLU 101 2HB GLU 101 7.944 8.551 12.563 665 HG3 GLU 101 2HG GLU 101 6.405 7.782 14.660 666 H PHE 102 H PHE 102 5.710 9.791 11.114 667 HA PHE 102 HA PHE 102 6.600 9.231 8.327 668 HB3 PHE 102 2HB PHE 102 3.876 9.809 9.349 669 HD1 PHE 102 1HD PHE 102 4.909 10.633 5.882 670 HD2 PHE 102 2HD PHE 102 3.593 12.179 9.687 671 HE1 PHE 102 1HE PHE 102 4.541 12.862 4.859 672 HE2 PHE 102 2HE PHE 102 3.166 14.401 8.646 673 HZ PHE 102 HZ PHE 102 3.636 14.738 6.237 674 H GLN 103 H GLN 103 7.136 11.232 7.175 675 HA GLN 103 HA GLN 103 7.792 13.568 8.922 676 HB3 GLN 103 2HB GLN 103 9.874 13.883 7.850 677 HG3 GLN 103 2HG GLN 103 9.569 11.607 9.436 678 HE21 GLN 103 2HE2 GLN 103 10.840 9.556 9.585 679 HE22 GLN 103 1HE2 GLN 103 11.252 8.711 8.097 680 H LYS 104 H LYS 104 6.912 15.387 8.158 681 HA LYS 104 HA LYS 104 5.554 15.664 5.625 682 HB3 LYS 104 2HB LYS 104 4.965 17.041 7.595 683 HG3 LYS 104 2HG LYS 104 7.855 17.872 7.353 684 HD3 LYS 104 2HD LYS 104 5.912 19.753 8.689 685 HE3 LYS 104 2HE LYS 104 8.731 19.951 7.518 686 HZ1 LYS 104 3HZ LYS 104 8.808 22.064 8.650 687 HZ2 LYS 104 1HZ LYS 104 7.539 22.095 7.631 688 HZ3 LYS 104 2HZ LYS 104 7.297 21.902 9.234 689 H ASN 105 H ASN 105 6.100 17.491 4.097 690 HA ASN 105 HA ASN 105 7.319 18.018 2.261 691 HB3 ASN 105 2HB ASN 105 9.726 18.474 4.029 692 HD21 ASN 105 2HD2 ASN 105 9.119 21.414 3.590 693 HD22 ASN 105 1HD2 ASN 105 9.578 21.690 1.915 694 H LYS 106 H LYS 106 7.058 15.365 2.535 695 HA LYS 106 HA LYS 106 9.359 14.301 1.022 696 HB3 LYS 106 2HB LYS 106 8.599 12.093 2.517 697 HG3 LYS 106 2HG LYS 106 10.955 12.981 1.939 698 HD3 LYS 106 2HD LYS 106 11.503 13.510 4.738 699 HE3 LYS 106 2HE LYS 106 11.906 15.773 2.874 700 HZ1 LYS 106 3HZ LYS 106 14.192 15.450 3.563 701 HZ2 LYS 106 1HZ LYS 106 13.248 15.379 4.892 702 HZ3 LYS 106 2HZ LYS 106 13.863 14.005 4.244 703 H ASP 107 H ASP 107 8.720 13.278 -0.670 704 HA ASP 107 HA ASP 107 5.866 12.701 -1.155 705 HB3 ASP 107 2HB ASP 107 6.358 12.618 -3.360 706 H TYR 108 H TYR 108 5.039 10.612 -1.372 707 HA TYR 108 HA TYR 108 6.834 8.316 -0.702 708 HB3 TYR 108 2HB TYR 108 4.246 7.589 0.145 709 HD1 TYR 108 2HD TYR 108 6.959 6.372 0.491 710 HD2 TYR 108 1HD TYR 108 4.619 8.973 3.027 711 HE1 TYR 108 2HE TYR 108 8.103 5.455 2.493 712 HE2 TYR 108 1HE TYR 108 5.746 8.022 5.034 713 HH TYR 108 HH TYR 108 8.271 5.492 4.779 714 H TYR 109 H TYR 109 6.510 6.477 -1.832 715 HA TYR 109 HA TYR 109 4.403 6.365 -3.913 716 HB3 TYR 109 2HB TYR 109 6.153 5.734 -5.575 717 HD1 TYR 109 1HD TYR 109 4.362 7.716 -5.999 718 HD2 TYR 109 2HD TYR 109 8.437 8.218 -4.661 719 HE1 TYR 109 1HE TYR 109 4.394 10.032 -6.925 720 HE2 TYR 109 2HE TYR 109 8.478 10.501 -5.634 721 HH TYR 109 HH TYR 109 7.294 12.121 -6.755 722 H ILE 110 H ILE 110 3.730 4.356 -4.325 723 HA ILE 110 HA ILE 110 5.050 2.005 -3.065 724 HB ILE 110 HB ILE 110 2.101 2.575 -2.750 725 HG13 ILE 110 2HG1 ILE 110 3.501 4.200 -1.316 726 HG21 ILE 110 1HG2 ILE 110 2.767 0.225 -2.810 727 HG22 ILE 110 2HG2 ILE 110 3.798 0.510 -1.376 728 HG23 ILE 110 3HG2 ILE 110 2.021 0.706 -1.298 729 HD11 ILE 110 3HD1 ILE 110 2.621 3.411 0.998 730 HD12 ILE 110 1HD1 ILE 110 1.499 4.041 -0.185 731 HD13 ILE 110 2HD1 ILE 110 1.615 2.301 0.042 732 H ILE 111 H ILE 111 4.720 0.134 -4.223 733 HA ILE 111 HA ILE 111 3.175 0.196 -6.767 734 HB ILE 111 HB ILE 111 6.150 -0.372 -6.581 735 HG13 ILE 111 2HG1 ILE 111 5.771 2.070 -6.231 736 HG21 ILE 111 1HG2 ILE 111 4.809 -1.519 -8.462 737 HG22 ILE 111 2HG2 ILE 111 4.522 0.111 -9.117 738 HG23 ILE 111 3HG2 ILE 111 6.162 -0.543 -8.989 739 HD11 ILE 111 3HD1 ILE 111 7.074 2.983 -8.052 740 HD12 ILE 111 1HD1 ILE 111 7.829 1.544 -7.338 741 HD13 ILE 111 2HD1 ILE 111 6.999 1.415 -8.879 742 H SER 112 H SER 112 2.586 -1.894 -7.394 743 HA SER 112 HA SER 112 3.629 -4.174 -5.747 744 HB3 SER 112 2HB SER 112 0.834 -4.014 -6.842 745 HG SER 112 HG SER 112 0.577 -5.564 -5.131 746 H THR 113 H THR 113 3.756 -6.134 -6.673 747 HA THR 113 HA THR 113 3.696 -6.343 -9.646 748 HB THR 113 HB THR 113 6.115 -7.231 -8.024 749 HG1 THR 113 1HG THR 113 7.066 -5.387 -8.900 750 HG21 THR 113 3HG2 THR 113 7.230 -7.233 -10.200 751 HG22 THR 113 1HG2 THR 113 5.757 -8.212 -10.362 752 HG23 THR 113 2HG2 THR 113 5.795 -6.536 -10.986 753 H SER 114 H SER 114 1.856 -7.689 -9.363 754 HA SER 114 HA SER 114 1.635 -10.044 -7.882 755 HB3 SER 114 2HB SER 114 0.121 -10.805 -9.751 756 HG SER 114 HG SER 114 -1.304 -9.088 -9.421 757 H ASN 115 H ASN 115 3.741 -9.525 -10.646 758 HA ASN 115 HA ASN 115 4.390 -12.274 -11.197 759 HB3 ASN 115 2HB ASN 115 6.475 -10.180 -11.622 760 HD21 ASN 115 2HD2 ASN 115 4.159 -10.981 -14.109 761 HD22 ASN 115 1HD2 ASN 115 5.167 -12.164 -14.922 762 H GLY 116 H GLY 116 4.974 -10.438 -8.430 763 HA2 GLY 116 2HA GLY 116 7.388 -11.637 -7.390 764 H SER 117 H SER 117 5.379 -13.578 -8.411 765 HA SER 117 HA SER 117 4.060 -15.131 -6.425 766 HB3 SER 117 2HB SER 117 3.840 -16.680 -8.128 767 HG SER 117 HG SER 117 3.994 -15.684 -10.192 768 H LEU 118 H LEU 118 4.960 -17.511 -5.852 769 HA LEU 118 HA LEU 118 7.362 -17.309 -4.369 770 HB3 LEU 118 2HB LEU 118 6.441 -19.957 -5.482 771 HG LEU 118 HG LEU 118 6.554 -20.769 -3.222 772 HD11 LEU 118 1HD1 LEU 118 8.706 -20.664 -4.549 773 HD12 LEU 118 2HD1 LEU 118 9.140 -19.225 -3.586 774 HD13 LEU 118 3HD1 LEU 118 8.881 -20.784 -2.788 775 HD21 LEU 118 3HD2 LEU 118 7.363 -19.467 -1.318 776 HD22 LEU 118 1HD2 LEU 118 7.446 -17.997 -2.305 777 HD23 LEU 118 2HD2 LEU 118 5.883 -18.762 -1.968 778 H GLU 119 H GLU 119 6.928 -18.579 -7.703 779 HA GLU 119 HA GLU 119 9.660 -19.336 -8.162 780 HB3 GLU 119 2HB GLU 119 9.042 -18.918 -10.597 781 HG3 GLU 119 2HG GLU 119 6.737 -20.504 -9.948 782 H GLY 120 H GLY 120 8.154 -16.206 -8.092 783 HA2 GLY 120 2HA GLY 120 10.654 -14.840 -8.988 784 H LEU 121 H LEU 121 10.050 -15.751 -6.185 785 HA LEU 121 HA LEU 121 9.031 -13.613 -4.665 786 HB3 LEU 121 2HB LEU 121 9.915 -16.163 -4.154 787 HG LEU 121 HG LEU 121 12.273 -15.065 -3.552 788 HD11 LEU 121 1HD1 LEU 121 11.246 -13.314 -2.025 789 HD12 LEU 121 2HD1 LEU 121 10.659 -14.626 -0.994 790 HD13 LEU 121 3HD1 LEU 121 12.408 -14.369 -1.214 791 HD21 LEU 121 3HD2 LEU 121 12.577 -16.753 -1.818 792 HD22 LEU 121 1HD2 LEU 121 10.815 -16.999 -1.729 793 HD23 LEU 121 2HD2 LEU 121 11.708 -17.399 -3.213 794 H ASP 122 H ASP 122 12.309 -14.171 -5.802 795 HA ASP 122 HA ASP 122 13.392 -11.632 -4.750 796 HB3 ASP 122 2HB ASP 122 15.440 -12.341 -5.878 797 H ASN 123 H ASN 123 11.650 -12.681 -7.551 798 HA ASN 123 HA ASN 123 12.699 -10.746 -9.444 799 HB3 ASN 123 2HB ASN 123 9.983 -12.106 -9.539 800 HD21 ASN 123 2HD2 ASN 123 9.147 -12.390 -11.749 801 HD22 ASN 123 1HD2 ASN 123 9.670 -11.234 -12.964 802 H GLN 124 H GLN 124 11.608 -8.996 -10.222 803 HA GLN 124 HA GLN 124 9.661 -7.503 -8.643 804 HB3 GLN 124 2HB GLN 124 11.523 -7.434 -7.121 805 HG3 GLN 124 2HG GLN 124 13.297 -6.072 -9.177 806 HE21 GLN 124 2HE2 GLN 124 12.637 -5.959 -5.999 807 HE22 GLN 124 1HE2 GLN 124 14.274 -6.050 -5.345 808 H GLU 125 H GLU 125 9.980 -8.289 -11.476 809 HA GLU 125 HA GLU 125 10.149 -5.615 -12.710 810 HB3 GLU 125 2HB GLU 125 11.695 -6.339 -14.426 811 HG3 GLU 125 2HG GLU 125 12.901 -7.213 -11.767 812 H GLY 126 H GLY 126 8.434 -5.312 -13.855 813 HA2 GLY 126 2HA GLY 126 6.746 -5.534 -15.385 814 H GLY 127 H GLY 127 4.532 -6.081 -15.089 815 HA2 GLY 127 2HA GLY 127 3.305 -8.143 -13.665 816 H VAL 128 H VAL 128 1.692 -6.844 -11.817 817 HA VAL 128 HA VAL 128 -0.246 -5.520 -13.431 818 HB VAL 128 HB VAL 128 -1.369 -4.954 -11.238 819 HG11 VAL 128 1HG1 VAL 128 -1.883 -6.965 -12.510 820 HG12 VAL 128 2HG1 VAL 128 -0.538 -7.835 -11.762 821 HG13 VAL 128 3HG1 VAL 128 -1.927 -7.308 -10.771 822 HG21 VAL 128 3HG2 VAL 128 -0.575 -5.944 -9.187 823 HG22 VAL 128 1HG2 VAL 128 0.902 -6.515 -9.987 824 HG23 VAL 128 2HG2 VAL 128 0.611 -4.778 -9.794 825 H CYS 129 H CYS 129 2.439 -4.062 -11.626 826 HA CYS 129 HA CYS 129 1.512 -1.377 -11.888 827 HB3 CYS 129 2HB CYS 129 3.240 -1.670 -10.420 828 H GLN 130 H GLN 130 2.356 -3.515 -14.450 829 HA GLN 130 HA GLN 130 3.405 -1.468 -16.241 830 HB3 GLN 130 2HB GLN 130 2.608 -4.248 -17.141 831 HG3 GLN 130 2HG GLN 130 5.285 -3.988 -17.590 832 HE21 GLN 130 2HE2 GLN 130 5.777 -4.473 -19.742 833 HE22 GLN 130 1HE2 GLN 130 4.579 -4.354 -21.022 834 H THR 131 H THR 131 0.308 -3.135 -15.806 835 HA THR 131 HA THR 131 -0.993 -1.275 -17.774 836 HB THR 131 HB THR 131 -1.491 -4.272 -17.639 837 HG1 THR 131 1HG THR 131 -0.667 -4.229 -19.748 838 HG21 THR 131 3HG2 THR 131 -2.914 -3.883 -19.659 839 HG22 THR 131 1HG2 THR 131 -3.574 -3.129 -18.211 840 HG23 THR 131 2HG2 THR 131 -2.739 -2.123 -19.418 841 H ARG 132 H ARG 132 -1.608 -3.633 -15.105 842 HA ARG 132 HA ARG 132 -4.306 -2.898 -14.562 843 HB3 ARG 132 2HB ARG 132 -2.651 -3.463 -12.176 844 HG3 ARG 132 2HG ARG 132 -5.244 -3.946 -12.732 845 HD3 ARG 132 2HD ARG 132 -4.238 -6.744 -12.771 846 HE ARG 132 HE ARG 132 -6.608 -5.329 -13.768 847 HH11 ARG 132 1HH2 ARG 132 -4.944 -8.417 -13.815 848 HH12 ARG 132 2HH2 ARG 132 -6.347 -9.262 -14.406 849 HH21 ARG 132 1HH1 ARG 132 -8.342 -6.469 -14.553 850 HH22 ARG 132 2HH1 ARG 132 -8.212 -8.184 -14.816 851 H ALA 133 H ALA 133 -1.352 -1.304 -13.795 852 HA ALA 133 HA ALA 133 -0.730 0.556 -12.724 853 HB1 ALA 133 3HB ALA 133 -2.118 2.525 -12.750 854 HB2 ALA 133 1HB ALA 133 -2.245 1.677 -14.301 855 HB3 ALA 133 2HB ALA 133 -3.566 1.563 -13.112 856 H MET 134 H MET 134 -0.553 -1.191 -11.078 857 HA MET 134 HA MET 134 -2.127 -0.576 -8.642 858 HB3 MET 134 2HB MET 134 -0.108 -2.826 -8.934 859 HG3 MET 134 2HG MET 134 -2.323 -1.952 -7.063 860 HE1 MET 134 3HE MET 134 -3.849 -4.731 -5.241 861 HE2 MET 134 1HE MET 134 -2.581 -3.599 -4.707 862 HE3 MET 134 2HE MET 134 -3.886 -3.038 -5.777 863 H LYS 135 H LYS 135 -0.961 1.597 -8.966 864 HA LYS 135 HA LYS 135 1.367 1.635 -7.111 865 HB3 LYS 135 2HB LYS 135 2.408 3.425 -8.316 866 HG3 LYS 135 2HG LYS 135 2.495 0.893 -9.206 867 HD3 LYS 135 2HD LYS 135 0.778 1.213 -11.006 868 HE3 LYS 135 2HE LYS 135 2.509 3.538 -11.641 869 HZ1 LYS 135 3HZ LYS 135 2.124 3.250 -14.048 870 HZ2 LYS 135 1HZ LYS 135 3.130 2.096 -13.489 871 HZ3 LYS 135 2HZ LYS 135 1.592 1.725 -13.819 872 H ILE 136 H ILE 136 1.688 3.674 -6.082 873 HA ILE 136 HA ILE 136 -0.695 5.377 -5.930 874 HB ILE 136 HB ILE 136 -1.194 5.063 -3.723 875 HG13 ILE 136 2HG1 ILE 136 1.728 4.601 -3.239 876 HG21 ILE 136 1HG2 ILE 136 -1.536 2.835 -4.721 877 HG22 ILE 136 2HG2 ILE 136 0.077 2.338 -4.168 878 HG23 ILE 136 3HG2 ILE 136 -1.185 2.764 -3.001 879 HD11 ILE 136 3HD1 ILE 136 1.298 6.002 -1.312 880 HD12 ILE 136 1HD1 ILE 136 0.748 6.845 -2.736 881 HD13 ILE 136 2HD1 ILE 136 -0.418 6.048 -1.684 882 H LEU 137 H LEU 137 -0.413 7.439 -5.223 883 HA LEU 137 HA LEU 137 2.389 8.435 -4.938 884 HB3 LEU 137 2HB LEU 137 0.391 9.009 -7.004 885 HG LEU 137 HG LEU 137 0.070 11.137 -5.751 886 HD11 LEU 137 1HD1 LEU 137 2.455 11.446 -4.871 887 HD12 LEU 137 2HD1 LEU 137 2.946 11.769 -6.529 888 HD13 LEU 137 3HD1 LEU 137 1.779 12.825 -5.723 889 HD21 LEU 137 3HD2 LEU 137 0.401 12.539 -7.726 890 HD22 LEU 137 1HD2 LEU 137 1.542 11.343 -8.397 891 HD23 LEU 137 2HD2 LEU 137 -0.181 10.926 -8.206 892 H MET 138 H MET 138 2.716 9.578 -3.242 893 HA MET 138 HA MET 138 0.524 10.961 -1.753 894 HB3 MET 138 2HB MET 138 2.233 10.784 0.149 895 HG3 MET 138 2HG MET 138 1.215 8.101 -0.772 896 HE1 MET 138 3HE MET 138 1.557 6.098 2.425 897 HE2 MET 138 1HE MET 138 0.490 6.286 1.014 898 HE3 MET 138 2HE MET 138 2.259 6.180 0.795 899 H LYS 139 H LYS 139 0.664 13.063 -2.049 900 HA LYS 139 HA LYS 139 3.340 14.399 -2.352 901 HB3 LYS 139 2HB LYS 139 1.265 16.150 -3.212 902 HG3 LYS 139 2HG LYS 139 3.302 14.456 -4.707 903 HD3 LYS 139 2HD LYS 139 1.360 15.175 -6.156 904 HE3 LYS 139 2HE LYS 139 2.546 17.960 -5.995 905 HZ1 LYS 139 3HZ LYS 139 0.422 18.528 -6.965 906 HZ2 LYS 139 1HZ LYS 139 1.029 17.297 -7.842 907 HZ3 LYS 139 2HZ LYS 139 -0.170 17.026 -6.766 908 H VAL 140 H VAL 140 3.952 15.441 -0.648 909 HA VAL 140 HA VAL 140 2.167 17.159 0.864 910 HB VAL 140 HB VAL 140 2.401 14.507 1.747 911 HG11 VAL 140 1HG1 VAL 140 4.610 14.814 2.754 912 HG12 VAL 140 2HG1 VAL 140 3.999 16.215 3.691 913 HG13 VAL 140 3HG1 VAL 140 3.346 14.592 3.963 914 HG21 VAL 140 3HG2 VAL 140 1.107 15.270 3.624 915 HG22 VAL 140 1HG2 VAL 140 1.575 16.957 3.328 916 HG23 VAL 140 2HG2 VAL 140 0.569 16.073 2.153 917 H GLY 141 H GLY 141 3.225 18.940 1.348 918 HA2 GLY 141 2HA GLY 141 5.723 19.490 2.343 919 H GLN 142 H GLN 142 4.018 21.155 2.722 920 HA GLN 142 HA GLN 142 4.260 23.411 0.787 921 HB3 GLN 142 2HB GLN 142 1.745 22.692 2.355 922 HG3 GLN 142 2HG GLN 142 0.905 24.215 0.312 923 HE21 GLN 142 2HE2 GLN 142 2.976 26.277 2.335 924 HE22 GLN 142 1HE2 GLN 142 1.661 26.763 3.401 Start of MODEL 7 1 H1 SER 1 H SER 1 -19.746 13.869 14.450 2 HA SER 1 HA SER 1 -18.643 12.202 12.430 3 HB3 SER 1 2HB SER 1 -18.307 13.852 10.593 4 HG SER 1 HG SER 1 -20.370 13.542 9.760 5 H LYS 2 H LYS 2 -16.472 12.330 12.386 6 HA LYS 2 HA LYS 2 -15.121 14.306 14.122 7 HB3 LYS 2 2HB LYS 2 -13.478 12.314 12.654 8 HG3 LYS 2 2HG LYS 2 -13.948 13.129 15.542 9 HD3 LYS 2 2HD LYS 2 -11.736 11.216 14.842 10 HE3 LYS 2 2HE LYS 2 -12.128 12.474 17.093 11 HZ1 LYS 2 3HZ LYS 2 -13.633 11.321 18.584 12 HZ2 LYS 2 1HZ LYS 2 -14.511 11.804 17.295 13 HZ3 LYS 2 2HZ LYS 2 -14.063 10.239 17.444 14 H SER 3 H SER 3 -12.768 14.736 13.063 15 HA SER 3 HA SER 3 -12.934 17.036 11.572 16 HB3 SER 3 2HB SER 3 -10.950 16.456 12.774 17 HG SER 3 HG SER 3 -9.670 14.611 11.897 18 H ILE 4 H ILE 4 -11.741 14.019 10.156 19 HA ILE 4 HA ILE 4 -13.190 14.430 7.615 20 HB ILE 4 HB ILE 4 -10.710 13.743 6.627 21 HG13 ILE 4 2HG1 ILE 4 -8.991 14.952 7.275 22 HG21 ILE 4 1HG2 ILE 4 -12.323 15.104 5.498 23 HG22 ILE 4 2HG2 ILE 4 -12.005 16.471 6.588 24 HG23 ILE 4 3HG2 ILE 4 -10.735 15.885 5.486 25 HD11 ILE 4 3HD1 ILE 4 -8.900 16.799 8.938 26 HD12 ILE 4 1HD1 ILE 4 -9.611 17.218 7.371 27 HD13 ILE 4 2HD1 ILE 4 -10.655 16.964 8.782 28 H VAL 5 H VAL 5 -10.957 12.403 9.485 29 HA VAL 5 HA VAL 5 -10.506 10.128 9.360 30 HB VAL 5 HB VAL 5 -12.450 8.879 10.305 31 HG11 VAL 5 1HG1 VAL 5 -10.747 10.016 11.669 32 HG12 VAL 5 2HG1 VAL 5 -11.661 11.520 11.603 33 HG13 VAL 5 3HG1 VAL 5 -12.338 10.096 12.435 34 HG21 VAL 5 3HG2 VAL 5 -14.398 10.110 11.099 35 HG22 VAL 5 1HG2 VAL 5 -13.833 11.603 10.323 36 HG23 VAL 5 2HG2 VAL 5 -14.342 10.223 9.337 37 H LEU 6 H LEU 6 -9.894 9.859 7.219 38 HA LEU 6 HA LEU 6 -11.392 9.312 4.994 39 HB3 LEU 6 2HB LEU 6 -9.174 7.522 4.891 40 HG LEU 6 HG LEU 6 -9.415 10.426 4.031 41 HD11 LEU 6 1HD1 LEU 6 -7.045 9.760 4.402 42 HD12 LEU 6 2HD1 LEU 6 -7.271 8.388 3.289 43 HD13 LEU 6 3HD1 LEU 6 -7.419 10.073 2.714 44 HD21 LEU 6 3HD2 LEU 6 -9.591 9.391 1.759 45 HD22 LEU 6 1HD2 LEU 6 -9.603 7.779 2.511 46 HD23 LEU 6 2HD2 LEU 6 -10.931 8.925 2.805 47 H GLU 7 H GLU 7 -12.239 7.577 3.907 48 HA GLU 7 HA GLU 7 -13.647 5.725 5.539 49 HB3 GLU 7 2HB GLU 7 -14.041 4.664 3.109 50 HG3 GLU 7 2HG GLU 7 -15.275 7.234 2.870 51 HA PRO 8 HA PRO 8 -10.972 2.238 5.781 52 HB3 PRO 8 2HB PRO 8 -12.342 1.099 7.202 53 HG3 PRO 8 2HG PRO 8 -14.558 1.721 7.307 54 HD3 PRO 8 2HD PRO 8 -14.105 3.890 6.724 55 H ILE 9 H ILE 9 -9.885 0.986 4.310 56 HA ILE 9 HA ILE 9 -10.831 0.985 1.496 57 HB ILE 9 HB ILE 9 -8.373 -0.332 2.624 58 HG13 ILE 9 2HG1 ILE 9 -7.009 1.567 2.056 59 HG21 ILE 9 1HG2 ILE 9 -8.876 -1.195 0.466 60 HG22 ILE 9 2HG2 ILE 9 -9.132 0.432 -0.194 61 HG23 ILE 9 3HG2 ILE 9 -7.502 -0.101 0.302 62 HD11 ILE 9 3HD1 ILE 9 -8.021 3.790 1.553 63 HD12 ILE 9 1HD1 ILE 9 -8.182 2.643 0.216 64 HD13 ILE 9 2HD1 ILE 9 -9.582 3.001 1.260 65 H TYR 10 H TYR 10 -12.123 -0.578 0.793 66 HA TYR 10 HA TYR 10 -12.286 -3.194 2.194 67 HB3 TYR 10 2HB TYR 10 -14.352 -2.144 2.237 68 HD1 TYR 10 2HD TYR 10 -14.221 0.290 1.849 69 HD2 TYR 10 1HD TYR 10 -14.809 -2.468 -1.380 70 HE1 TYR 10 2HE TYR 10 -14.622 2.204 0.311 71 HE2 TYR 10 1HE TYR 10 -15.299 -0.557 -2.922 72 HH TYR 10 HH TYR 10 -15.038 2.846 -1.842 73 H TRP 11 H TRP 11 -10.328 -4.093 1.202 74 HA TRP 11 HA TRP 11 -9.938 -4.341 -1.602 75 HB3 TRP 11 2HB TRP 11 -9.054 -6.755 -0.352 76 HD1 TRP 11 HD TRP 11 -6.449 -4.515 0.615 77 HE1 TRP 11 1HE TRP 11 -4.625 -4.249 -1.184 78 HE3 TRP 11 3HE TRP 11 -8.882 -6.579 -3.425 79 HZ2 TRP 11 2HZ TRP 11 -4.333 -4.673 -3.988 80 HZ3 TRP 11 3HZ TRP 11 -7.795 -6.613 -5.637 81 HH2 TRP 11 HH TRP 11 -5.522 -5.652 -5.945 82 H ASN 12 H ASN 12 -12.406 -5.850 0.281 83 HA ASN 12 HA ASN 12 -13.169 -8.080 -1.262 84 HB3 ASN 12 2HB ASN 12 -14.985 -5.915 -0.097 85 HD21 ASN 12 2HD2 ASN 12 -14.827 -9.434 0.485 86 HD22 ASN 12 1HD2 ASN 12 -16.374 -9.771 -0.267 87 H SER 13 H SER 13 -13.396 -4.651 -2.061 88 HA SER 13 HA SER 13 -14.467 -5.258 -4.771 89 HB3 SER 13 2HB SER 13 -15.432 -2.774 -3.413 90 HG SER 13 HG SER 13 -17.356 -3.532 -4.549 91 H SER 14 H SER 14 -14.507 -2.509 -5.580 92 HA SER 14 HA SER 14 -11.757 -1.911 -6.165 93 HB3 SER 14 2HB SER 14 -12.673 0.250 -6.984 94 HG SER 14 HG SER 14 -14.033 -0.712 -8.536 95 H ASN 15 H ASN 15 -10.872 0.404 -5.688 96 HA ASN 15 HA ASN 15 -10.742 0.787 -2.747 97 HB3 ASN 15 2HB ASN 15 -8.924 2.404 -3.434 98 HD21 ASN 15 2HD2 ASN 15 -7.838 0.955 -2.000 99 HD22 ASN 15 1HD2 ASN 15 -7.139 -0.543 -2.586 100 H SER 16 H SER 16 -10.809 3.073 -1.870 101 HA SER 16 HA SER 16 -13.181 4.511 -2.559 102 HB3 SER 16 2HB SER 16 -10.679 5.490 -1.125 103 HG SER 16 HG SER 16 -12.087 7.071 -0.297 104 H LYS 17 H LYS 17 -9.762 5.136 -3.474 105 HA LYS 17 HA LYS 17 -10.504 7.368 -5.166 106 HB3 LYS 17 2HB LYS 17 -7.862 6.043 -5.639 107 HG3 LYS 17 2HG LYS 17 -8.583 8.364 -6.439 108 HD3 LYS 17 2HD LYS 17 -8.088 9.123 -3.513 109 HE3 LYS 17 2HE LYS 17 -8.082 10.605 -5.966 110 HZ1 LYS 17 3HZ LYS 17 -9.802 12.231 -5.411 111 HZ2 LYS 17 1HZ LYS 17 -10.503 10.778 -5.664 112 HZ3 LYS 17 2HZ LYS 17 -10.313 11.341 -4.141 113 H PHE 18 H PHE 18 -10.144 3.982 -5.794 114 HA PHE 18 HA PHE 18 -10.099 2.758 -7.781 115 HB3 PHE 18 2HB PHE 18 -12.656 4.357 -7.695 116 HD1 PHE 18 2HD PHE 18 -11.499 1.005 -9.036 117 HD2 PHE 18 1HD PHE 18 -13.925 4.518 -9.637 118 HE1 PHE 18 2HE PHE 18 -12.302 0.087 -11.198 119 HE2 PHE 18 1HE PHE 18 -14.718 3.604 -11.800 120 HZ PHE 18 HZ PHE 18 -13.893 1.395 -12.593 121 H LEU 19 H LEU 19 -8.151 4.042 -8.542 122 HA LEU 19 HA LEU 19 -8.802 5.801 -10.834 123 HB3 LEU 19 2HB LEU 19 -6.013 5.698 -9.811 124 HG LEU 19 HG LEU 19 -6.163 8.114 -9.890 125 HD11 LEU 19 1HD1 LEU 19 -5.614 7.007 -12.010 126 HD12 LEU 19 2HD1 LEU 19 -7.339 6.935 -12.441 127 HD13 LEU 19 3HD1 LEU 19 -6.528 8.499 -12.289 128 HD21 LEU 19 3HD2 LEU 19 -8.116 9.354 -10.561 129 HD22 LEU 19 1HD2 LEU 19 -9.050 7.880 -10.837 130 HD23 LEU 19 2HD2 LEU 19 -8.557 8.318 -9.190 131 HA PRO 20 HA PRO 20 -7.538 2.064 -13.082 132 HB3 PRO 20 2HB PRO 20 -9.683 2.017 -13.904 133 HG3 PRO 20 2HG PRO 20 -10.879 3.997 -14.383 134 HD3 PRO 20 2HD PRO 20 -10.198 4.463 -12.242 135 H GLY 21 H GLY 21 -5.483 3.176 -12.737 136 HA2 GLY 21 2HA GLY 21 -3.862 3.476 -15.082 137 H GLN 22 H GLN 22 -2.869 5.684 -12.692 138 HA GLN 22 HA GLN 22 -0.617 4.268 -11.859 139 HB3 GLN 22 2HB GLN 22 -0.642 5.865 -9.866 140 HG3 GLN 22 2HG GLN 22 -1.010 7.071 -12.643 141 HE21 GLN 22 2HE2 GLN 22 1.533 8.568 -12.100 142 HE22 GLN 22 1HE2 GLN 22 1.048 9.871 -11.026 143 H GLY 23 H GLY 23 -3.828 4.143 -10.252 144 HA2 GLY 23 2HA GLY 23 -4.235 1.767 -9.485 145 H LEU 24 H LEU 24 -2.781 3.557 -6.810 146 HA LEU 24 HA LEU 24 -5.441 4.439 -5.771 147 HB3 LEU 24 2HB LEU 24 -3.233 2.991 -4.261 148 HG LEU 24 HG LEU 24 -4.551 4.730 -2.874 149 HD11 LEU 24 1HD1 LEU 24 -6.786 4.365 -3.827 150 HD12 LEU 24 2HD1 LEU 24 -6.692 2.647 -3.388 151 HD13 LEU 24 3HD1 LEU 24 -6.806 3.877 -2.121 152 HD21 LEU 24 3HD2 LEU 24 -4.793 3.197 -0.975 153 HD22 LEU 24 1HD2 LEU 24 -4.679 1.799 -2.070 154 HD23 LEU 24 2HD2 LEU 24 -3.289 2.893 -1.853 155 H VAL 25 H VAL 25 -5.405 6.498 -4.892 156 HA VAL 25 HA VAL 25 -2.761 7.778 -4.364 157 HB VAL 25 HB VAL 25 -4.965 9.213 -5.874 158 HG11 VAL 25 1HG1 VAL 25 -3.416 10.628 -4.556 159 HG12 VAL 25 2HG1 VAL 25 -2.034 9.876 -5.378 160 HG13 VAL 25 3HG1 VAL 25 -3.194 10.863 -6.294 161 HG21 VAL 25 3HG2 VAL 25 -3.516 9.086 -7.877 162 HG22 VAL 25 1HG2 VAL 25 -2.457 7.943 -7.030 163 HG23 VAL 25 2HG2 VAL 25 -4.138 7.510 -7.409 164 H LEU 26 H LEU 26 -2.784 8.346 -2.283 165 HA LEU 26 HA LEU 26 -5.268 9.529 -1.145 166 HB3 LEU 26 2HB LEU 26 -4.250 8.247 1.051 167 HG LEU 26 HG LEU 26 -5.983 6.788 1.164 168 HD11 LEU 26 1HD1 LEU 26 -6.772 9.189 0.799 169 HD12 LEU 26 2HD1 LEU 26 -7.240 8.685 -0.845 170 HD13 LEU 26 3HD1 LEU 26 -7.975 7.893 0.565 171 HD21 LEU 26 3HD2 LEU 26 -7.260 5.846 -0.678 172 HD22 LEU 26 1HD2 LEU 26 -6.250 6.699 -1.848 173 HD23 LEU 26 2HD2 LEU 26 -5.543 5.454 -0.806 174 H TYR 27 H TYR 27 -4.873 10.680 0.916 175 HA TYR 27 HA TYR 27 -2.240 12.108 0.803 176 HB3 TYR 27 2HB TYR 27 -4.890 13.463 1.286 177 HD1 TYR 27 1HD TYR 27 -3.173 14.607 2.978 178 HD2 TYR 27 2HD TYR 27 -2.891 14.856 -1.308 179 HE1 TYR 27 1HE TYR 27 -1.711 16.627 3.182 180 HE2 TYR 27 2HE TYR 27 -1.450 16.881 -1.088 181 HH TYR 27 HH TYR 27 -0.444 18.393 0.403 182 HA PRO 28 HA PRO 28 -2.873 10.529 5.077 183 HB3 PRO 28 2HB PRO 28 -1.463 8.787 4.696 184 HG3 PRO 28 2HG PRO 28 0.190 8.907 3.069 185 HD3 PRO 28 2HD PRO 28 -1.485 9.864 1.780 186 H GLN 29 H GLN 29 -3.318 12.944 5.138 187 HA GLN 29 HA GLN 29 -1.212 14.629 6.335 188 HB3 GLN 29 2HB GLN 29 -2.616 15.820 4.889 189 HG3 GLN 29 2HG GLN 29 -4.924 14.569 6.323 190 HE21 GLN 29 2HE2 GLN 29 -5.414 16.037 3.204 191 HE22 GLN 29 1HE2 GLN 29 -6.336 17.411 3.791 192 H ILE 30 H ILE 30 -1.554 15.770 8.344 193 HA ILE 30 HA ILE 30 -2.315 13.862 10.435 194 HB ILE 30 HB ILE 30 -0.933 16.531 10.768 195 HG13 ILE 30 2HG1 ILE 30 1.187 15.207 10.880 196 HG21 ILE 30 1HG2 ILE 30 -1.924 15.530 12.839 197 HG22 ILE 30 2HG2 ILE 30 -0.947 14.070 12.575 198 HG23 ILE 30 3HG2 ILE 30 -0.159 15.620 12.888 199 HD11 ILE 30 3HD1 ILE 30 1.287 13.066 9.593 200 HD12 ILE 30 1HD1 ILE 30 0.444 12.889 11.135 201 HD13 ILE 30 2HD1 ILE 30 -0.457 12.958 9.601 202 H GLY 31 H GLY 31 -4.329 13.805 10.955 203 HA2 GLY 31 2HA GLY 31 -5.938 15.461 12.362 204 H ASP 32 H ASP 32 -5.652 13.157 9.794 205 HA ASP 32 HA ASP 32 -8.257 11.903 10.479 206 HB3 ASP 32 2HB ASP 32 -8.873 12.662 8.419 207 H LYS 33 H LYS 33 -8.394 9.721 9.533 208 HA LYS 33 HA LYS 33 -5.919 8.120 9.874 209 HB3 LYS 33 2HB LYS 33 -6.824 8.156 12.088 210 HG3 LYS 33 2HG LYS 33 -9.473 8.218 10.806 211 HD3 LYS 33 2HD LYS 33 -9.042 6.461 13.246 212 HE3 LYS 33 2HE LYS 33 -11.545 7.341 11.728 213 HZ1 LYS 33 3HZ LYS 33 -12.689 6.161 13.507 214 HZ2 LYS 33 1HZ LYS 33 -11.705 5.118 12.724 215 HZ3 LYS 33 2HZ LYS 33 -11.279 5.702 14.189 216 H LEU 34 H LEU 34 -6.002 6.160 8.902 217 HA LEU 34 HA LEU 34 -8.289 5.519 7.160 218 HB3 LEU 34 2HB LEU 34 -7.242 6.640 5.510 219 HG LEU 34 HG LEU 34 -4.929 6.513 4.758 220 HD11 LEU 34 1HD1 LEU 34 -5.790 8.530 5.970 221 HD12 LEU 34 2HD1 LEU 34 -5.014 7.919 7.437 222 HD13 LEU 34 3HD1 LEU 34 -4.040 8.306 6.026 223 HD21 LEU 34 3HD2 LEU 34 -3.089 5.988 6.224 224 HD22 LEU 34 1HD2 LEU 34 -4.219 5.634 7.554 225 HD23 LEU 34 2HD2 LEU 34 -4.172 4.575 6.118 226 H ASP 35 H ASP 35 -8.715 3.467 7.019 227 HA ASP 35 HA ASP 35 -6.840 1.529 8.273 228 HB3 ASP 35 2HB ASP 35 -8.248 1.298 9.925 229 H ILE 36 H ILE 36 -6.136 0.143 6.873 230 HA ILE 36 HA ILE 36 -7.736 -0.522 4.503 231 HB ILE 36 HB ILE 36 -5.153 -0.205 4.592 232 HG13 ILE 36 2HG1 ILE 36 -6.303 -0.813 2.578 233 HG21 ILE 36 1HG2 ILE 36 -4.884 -1.800 6.469 234 HG22 ILE 36 2HG2 ILE 36 -5.273 -3.154 5.370 235 HG23 ILE 36 3HG2 ILE 36 -3.848 -2.157 5.095 236 HD11 ILE 36 3HD1 ILE 36 -4.653 -1.998 1.360 237 HD12 ILE 36 1HD1 ILE 36 -3.819 -1.001 2.570 238 HD13 ILE 36 2HD1 ILE 36 -4.009 -2.760 2.824 239 H ILE 37 H ILE 37 -8.746 -2.474 4.137 240 HA ILE 37 HA ILE 37 -8.579 -4.648 6.154 241 HB ILE 37 HB ILE 37 -11.045 -3.195 5.165 242 HG13 ILE 37 2HG1 ILE 37 -9.928 -2.715 7.430 243 HG21 ILE 37 1HG2 ILE 37 -11.522 -5.505 4.556 244 HG22 ILE 37 2HG2 ILE 37 -11.020 -6.066 6.173 245 HG23 ILE 37 3HG2 ILE 37 -12.471 -5.067 5.957 246 HD11 ILE 37 3HD1 ILE 37 -11.961 -2.515 8.689 247 HD12 ILE 37 1HD1 ILE 37 -12.250 -2.027 7.009 248 HD13 ILE 37 2HD1 ILE 37 -12.823 -3.608 7.596 249 H CYS 38 H CYS 38 -8.320 -6.590 5.197 250 HA CYS 38 HA CYS 38 -9.235 -6.908 2.397 251 HB3 CYS 38 2HB CYS 38 -6.797 -8.383 3.361 252 HA PRO 39 HA PRO 39 -11.350 -10.301 4.507 253 HB3 PRO 39 2HB PRO 39 -13.191 -9.705 3.211 254 HG3 PRO 39 2HG PRO 39 -12.934 -8.959 0.985 255 HD3 PRO 39 2HD PRO 39 -11.434 -7.519 2.028 256 H LYS 40 H LYS 40 -11.761 -12.742 3.632 257 HA LYS 40 HA LYS 40 -9.112 -13.731 2.718 258 HB3 LYS 40 2HB LYS 40 -9.847 -14.607 4.862 259 HG3 LYS 40 2HG LYS 40 -12.419 -15.010 3.555 260 HD3 LYS 40 2HD LYS 40 -11.038 -17.493 4.658 261 HE3 LYS 40 2HE LYS 40 -13.989 -16.996 4.057 262 HZ1 LYS 40 3HZ LYS 40 -14.204 -19.256 4.963 263 HZ2 LYS 40 1HZ LYS 40 -13.259 -19.290 3.627 264 HZ3 LYS 40 2HZ LYS 40 -12.586 -19.402 5.108 265 H VAL 41 H VAL 41 -9.017 -15.585 1.401 266 HA VAL 41 HA VAL 41 -11.037 -15.758 -0.776 267 HB VAL 41 HB VAL 41 -8.055 -15.292 -1.162 268 HG11 VAL 41 1HG1 VAL 41 -9.077 -16.766 -2.895 269 HG12 VAL 41 2HG1 VAL 41 -10.300 -15.523 -3.193 270 HG13 VAL 41 3HG1 VAL 41 -8.610 -15.189 -3.557 271 HG21 VAL 41 3HG2 VAL 41 -8.713 -13.189 -2.305 272 HG22 VAL 41 1HG2 VAL 41 -10.390 -13.434 -1.772 273 HG23 VAL 41 2HG2 VAL 41 -9.090 -13.156 -0.587 274 H ASP 42 H ASP 42 -11.460 -17.765 -1.072 275 HA ASP 42 HA ASP 42 -10.147 -20.023 -1.637 276 HB3 ASP 42 2HB ASP 42 -10.404 -21.304 0.679 277 H SER 43 H SER 43 -12.351 -20.440 1.098 278 HA SER 43 HA SER 43 -14.326 -21.689 -0.449 279 HB3 SER 43 2HB SER 43 -15.787 -21.459 1.532 280 HG SER 43 HG SER 43 -14.434 -22.587 2.899 281 H LYS 44 H LYS 44 -14.099 -18.230 0.340 282 HA LYS 44 HA LYS 44 -16.820 -17.601 -0.505 283 HB3 LYS 44 2HB LYS 44 -15.998 -15.212 -0.342 284 HG3 LYS 44 2HG LYS 44 -15.350 -15.229 2.084 285 HD3 LYS 44 2HD LYS 44 -17.409 -16.986 2.676 286 HE3 LYS 44 2HE LYS 44 -17.050 -14.181 2.634 287 HZ1 LYS 44 3HZ LYS 44 -19.296 -13.482 2.018 288 HZ2 LYS 44 1HZ LYS 44 -18.540 -14.075 0.698 289 HZ3 LYS 44 2HZ LYS 44 -19.673 -14.969 1.471 290 H THR 45 H THR 45 -13.657 -17.137 -2.044 291 HA THR 45 HA THR 45 -14.802 -16.232 -4.577 292 HB THR 45 HB THR 45 -11.989 -16.969 -3.732 293 HG1 THR 45 1HG THR 45 -11.892 -14.612 -4.022 294 HG21 THR 45 3HG2 THR 45 -11.198 -15.825 -5.746 295 HG22 THR 45 1HG2 THR 45 -12.157 -17.229 -6.208 296 HG23 THR 45 2HG2 THR 45 -12.870 -15.603 -6.312 297 H VAL 46 H VAL 46 -12.732 -19.107 -3.892 298 HA VAL 46 HA VAL 46 -14.396 -21.042 -4.838 299 HB VAL 46 HB VAL 46 -13.832 -19.650 -7.122 300 HG11 VAL 46 1HG1 VAL 46 -11.437 -20.165 -7.100 301 HG12 VAL 46 2HG1 VAL 46 -11.833 -21.898 -7.285 302 HG13 VAL 46 3HG1 VAL 46 -12.297 -20.732 -8.536 303 HG21 VAL 46 3HG2 VAL 46 -14.603 -21.589 -8.346 304 HG22 VAL 46 1HG2 VAL 46 -14.257 -22.641 -6.948 305 HG23 VAL 46 2HG2 VAL 46 -15.520 -21.388 -6.845 306 H GLY 47 H GLY 47 -10.977 -20.056 -4.704 307 HA2 GLY 47 2HA GLY 47 -9.855 -21.870 -3.035 308 H GLN 48 H GLN 48 -8.870 -19.528 -3.677 309 HA GLN 48 HA GLN 48 -6.283 -19.914 -4.892 310 HB3 GLN 48 2HB GLN 48 -7.374 -19.851 -6.969 311 HG3 GLN 48 2HG GLN 48 -8.591 -17.110 -6.519 312 HE21 GLN 48 2HE2 GLN 48 -9.114 -20.355 -8.089 313 HE22 GLN 48 1HE2 GLN 48 -9.657 -19.654 -9.607 314 H TYR 49 H TYR 49 -6.123 -19.206 -2.619 315 HA TYR 49 HA TYR 49 -6.606 -17.003 -1.263 316 HB3 TYR 49 2HB TYR 49 -5.118 -18.062 -0.027 317 HD1 TYR 49 1HD TYR 49 -2.710 -18.238 -2.898 318 HD2 TYR 49 2HD TYR 49 -5.372 -20.412 -0.285 319 HE1 TYR 49 1HE TYR 49 -1.904 -20.397 -3.856 320 HE2 TYR 49 2HE TYR 49 -4.558 -22.555 -1.230 321 HH TYR 49 HH TYR 49 -3.187 -23.561 -2.744 322 H GLU 50 H GLU 50 -4.364 -16.818 -3.979 323 HA GLU 50 HA GLU 50 -3.161 -15.012 -4.834 324 HB3 GLU 50 2HB GLU 50 -6.058 -14.231 -5.312 325 HG3 GLU 50 2HG GLU 50 -3.434 -13.559 -6.537 326 H TYR 51 H TYR 51 -2.453 -14.375 -2.637 327 HA TYR 51 HA TYR 51 -3.396 -11.820 -1.569 328 HB3 TYR 51 2HB TYR 51 -2.619 -13.380 0.017 329 HD1 TYR 51 2HD TYR 51 0.829 -12.670 -1.180 330 HD2 TYR 51 1HD TYR 51 -2.236 -15.659 -0.686 331 HE1 TYR 51 2HE TYR 51 2.493 -14.461 -1.666 332 HE2 TYR 51 1HE TYR 51 -0.575 -17.453 -1.191 333 HH TYR 51 HH TYR 51 2.863 -16.701 -1.888 334 H TYR 52 H TYR 52 -1.866 -10.081 -1.215 335 HA TYR 52 HA TYR 52 0.038 -9.612 -3.469 336 HB3 TYR 52 2HB TYR 52 -0.918 -7.486 -3.943 337 HD1 TYR 52 2HD TYR 52 -1.401 -9.764 -5.534 338 HD2 TYR 52 1HD TYR 52 -4.212 -7.701 -2.993 339 HE1 TYR 52 2HE TYR 52 -3.271 -10.553 -6.967 340 HE2 TYR 52 1HE TYR 52 -6.083 -8.546 -4.393 341 HH TYR 52 HH TYR 52 -5.525 -10.499 -7.344 342 H LYS 53 H LYS 53 1.640 -8.047 -2.984 343 HA LYS 53 HA LYS 53 2.089 -7.492 -0.063 344 HB3 LYS 53 2HB LYS 53 4.471 -8.145 -0.544 345 HG3 LYS 53 2HG LYS 53 2.232 -10.156 -0.503 346 HD3 LYS 53 2HD LYS 53 5.103 -10.761 -1.246 347 HE3 LYS 53 2HE LYS 53 4.434 -13.172 -0.553 348 HZ1 LYS 53 3HZ LYS 53 5.336 -12.818 1.664 349 HZ2 LYS 53 1HZ LYS 53 6.161 -11.908 0.587 350 HZ3 LYS 53 2HZ LYS 53 5.064 -11.209 1.576 351 H VAL 54 H VAL 54 1.848 -5.386 -0.014 352 HA VAL 54 HA VAL 54 2.803 -3.523 -2.074 353 HB VAL 54 HB VAL 54 1.167 -3.382 0.326 354 HG11 VAL 54 1HG1 VAL 54 2.699 -2.167 1.546 355 HG12 VAL 54 2HG1 VAL 54 3.157 -1.165 0.185 356 HG13 VAL 54 3HG1 VAL 54 1.543 -1.003 0.902 357 HG21 VAL 54 3HG2 VAL 54 0.094 -1.542 -0.888 358 HG22 VAL 54 1HG2 VAL 54 1.428 -1.551 -2.074 359 HG23 VAL 54 2HG2 VAL 54 0.380 -2.918 -1.960 360 H TYR 55 H TYR 55 4.792 -2.735 -2.295 361 HA TYR 55 HA TYR 55 6.632 -2.792 0.081 362 HB3 TYR 55 2HB TYR 55 8.427 -3.225 -1.604 363 HD1 TYR 55 2HD TYR 55 8.428 -4.686 0.525 364 HD2 TYR 55 1HD TYR 55 6.239 -5.710 -3.041 365 HE1 TYR 55 2HE TYR 55 8.454 -7.076 1.204 366 HE2 TYR 55 1HE TYR 55 6.264 -8.104 -2.364 367 HH TYR 55 HH TYR 55 7.839 -9.201 0.668 368 H MET 56 H MET 56 7.501 -0.893 0.561 369 HA MET 56 HA MET 56 7.015 1.508 -0.958 370 HB3 MET 56 2HB MET 56 9.206 1.021 1.098 371 HG3 MET 56 2HG MET 56 7.621 3.547 0.496 372 HE1 MET 56 3HE MET 56 11.444 5.209 1.520 373 HE2 MET 56 1HE MET 56 11.263 4.007 0.224 374 HE3 MET 56 2HE MET 56 10.186 5.420 0.275 375 H VAL 57 H VAL 57 8.238 2.518 -2.511 376 HA VAL 57 HA VAL 57 10.999 1.726 -2.994 377 HB VAL 57 HB VAL 57 9.360 0.124 -4.316 378 HG11 VAL 57 1HG1 VAL 57 7.981 1.824 -5.405 379 HG12 VAL 57 2HG1 VAL 57 9.439 2.501 -6.187 380 HG13 VAL 57 3HG1 VAL 57 8.905 0.884 -6.608 381 HG21 VAL 57 3HG2 VAL 57 11.056 -0.004 -6.126 382 HG22 VAL 57 1HG2 VAL 57 11.803 1.442 -5.466 383 HG23 VAL 57 2HG2 VAL 57 11.705 -0.014 -4.491 384 H ASP 58 H ASP 58 12.045 3.199 -4.646 385 HA ASP 58 HA ASP 58 11.292 5.954 -4.226 386 HB3 ASP 58 2HB ASP 58 13.037 6.463 -5.869 387 H LYS 59 H LYS 59 10.431 7.488 -5.731 388 HA LYS 59 HA LYS 59 8.407 6.715 -7.501 389 HB3 LYS 59 2HB LYS 59 8.688 8.981 -6.571 390 HG3 LYS 59 2HG LYS 59 11.266 9.032 -7.334 391 HD3 LYS 59 2HD LYS 59 10.048 10.985 -9.291 392 HE3 LYS 59 2HE LYS 59 12.689 9.494 -9.459 393 HZ1 LYS 59 3HZ LYS 59 13.395 11.528 -10.513 394 HZ2 LYS 59 1HZ LYS 59 12.045 11.023 -11.269 395 HZ3 LYS 59 2HZ LYS 59 11.974 12.274 -10.210 396 H ASP 60 H ASP 60 11.805 7.106 -8.331 397 HA ASP 60 HA ASP 60 11.423 6.848 -11.187 398 HB3 ASP 60 2HB ASP 60 14.006 5.967 -9.929 399 H GLN 61 H GLN 61 12.286 4.563 -8.600 400 HA GLN 61 HA GLN 61 12.629 2.231 -10.247 401 HB3 GLN 61 2HB GLN 61 12.527 1.077 -8.040 402 HG3 GLN 61 2HG GLN 61 14.268 3.594 -8.086 403 HE21 GLN 61 2HE2 GLN 61 15.997 3.629 -6.517 404 HE22 GLN 61 1HE2 GLN 61 15.851 2.603 -5.103 405 H ALA 62 H ALA 62 9.861 3.585 -8.459 406 HA ALA 62 HA ALA 62 8.019 1.473 -8.912 407 HB1 ALA 62 3HB ALA 62 6.377 3.036 -8.293 408 HB2 ALA 62 1HB ALA 62 7.786 3.431 -7.309 409 HB3 ALA 62 2HB ALA 62 7.420 4.429 -8.717 410 H ASP 63 H ASP 63 9.168 4.072 -11.023 411 HA ASP 63 HA ASP 63 7.197 3.495 -13.127 412 HB3 ASP 63 2HB ASP 63 9.587 5.027 -13.908 413 H ARG 64 H ARG 64 10.614 2.734 -12.416 414 HA ARG 64 HA ARG 64 11.178 1.236 -14.830 415 HB3 ARG 64 2HB ARG 64 13.004 0.192 -13.406 416 HG3 ARG 64 2HG ARG 64 12.857 3.221 -13.229 417 HD3 ARG 64 2HD ARG 64 14.757 1.646 -12.089 418 HE ARG 64 HE ARG 64 15.350 1.551 -14.929 419 HH11 ARG 64 1HH2 ARG 64 17.007 1.855 -11.859 420 HH12 ARG 64 2HH2 ARG 64 18.533 1.346 -12.532 421 HH21 ARG 64 1HH1 ARG 64 17.317 0.947 -15.728 422 HH22 ARG 64 2HH1 ARG 64 18.697 0.851 -14.676 423 H CYS 65 H CYS 65 9.094 0.469 -12.287 424 HA CYS 65 HA CYS 65 8.068 -1.376 -11.556 425 HB3 CYS 65 2HB CYS 65 7.479 -3.137 -13.142 426 H THR 66 H THR 66 10.081 -1.210 -10.218 427 HA THR 66 HA THR 66 10.983 -3.981 -9.775 428 HB THR 66 HB THR 66 13.297 -3.162 -9.221 429 HG1 THR 66 1HG THR 66 13.870 -1.189 -10.336 430 HG21 THR 66 3HG2 THR 66 14.158 -3.142 -11.475 431 HG22 THR 66 1HG2 THR 66 12.796 -4.263 -11.432 432 HG23 THR 66 2HG2 THR 66 12.597 -2.654 -12.141 433 H ILE 67 H ILE 67 11.826 -4.260 -7.576 434 HA ILE 67 HA ILE 67 10.706 -2.338 -5.558 435 HB ILE 67 HB ILE 67 11.422 -5.220 -4.962 436 HG13 ILE 67 2HG1 ILE 67 9.329 -6.088 -5.246 437 HG21 ILE 67 1HG2 ILE 67 11.324 -4.030 -2.966 438 HG22 ILE 67 2HG2 ILE 67 9.864 -3.139 -3.461 439 HG23 ILE 67 3HG2 ILE 67 9.789 -4.883 -3.092 440 HD11 ILE 67 3HD1 ILE 67 7.550 -4.372 -6.331 441 HD12 ILE 67 1HD1 ILE 67 7.616 -4.755 -4.604 442 HD13 ILE 67 2HD1 ILE 67 8.400 -3.285 -5.206 443 H LYS 68 H LYS 68 12.160 -2.057 -3.633 444 HA LYS 68 HA LYS 68 15.056 -2.339 -4.346 445 HB3 LYS 68 2HB LYS 68 14.624 -0.826 -1.894 446 HG3 LYS 68 2HG LYS 68 15.346 1.065 -3.578 447 HD3 LYS 68 2HD LYS 68 17.222 -1.241 -2.927 448 HE3 LYS 68 2HE LYS 68 18.734 1.052 -3.172 449 HZ1 LYS 68 3HZ LYS 68 19.467 0.149 -5.305 450 HZ2 LYS 68 1HZ LYS 68 19.309 -1.053 -4.223 451 HZ3 LYS 68 2HZ LYS 68 18.179 -0.847 -5.393 452 H LYS 69 H LYS 69 16.377 -3.651 -3.253 453 HA LYS 69 HA LYS 69 15.502 -5.582 -1.340 454 HB3 LYS 69 2HB LYS 69 17.500 -5.731 -2.826 455 HG3 LYS 69 2HG LYS 69 18.322 -3.293 -1.791 456 HD3 LYS 69 2HD LYS 69 18.988 -4.612 0.358 457 HE3 LYS 69 2HE LYS 69 21.260 -5.408 -1.521 458 HZ1 LYS 69 3HZ LYS 69 21.981 -6.701 0.378 459 HZ2 LYS 69 1HZ LYS 69 21.829 -5.149 0.860 460 HZ3 LYS 69 2HZ LYS 69 20.694 -6.253 1.273 461 H GLU 70 H GLU 70 16.300 -2.268 -0.861 462 HA GLU 70 HA GLU 70 16.609 -2.413 2.043 463 HB3 GLU 70 2HB GLU 70 16.492 0.027 1.953 464 HG3 GLU 70 2HG GLU 70 18.230 -0.766 -0.392 465 H ASN 71 H ASN 71 13.937 -3.093 0.203 466 HA ASN 71 HA ASN 71 11.820 -2.019 1.794 467 HB3 ASN 71 2HB ASN 71 11.518 -3.190 -0.385 468 HD21 ASN 71 2HD2 ASN 71 10.542 -5.479 -1.081 469 HD22 ASN 71 1HD2 ASN 71 11.638 -6.819 -0.784 470 H THR 72 H THR 72 10.460 -3.564 3.093 471 HA THR 72 HA THR 72 11.409 -5.578 4.809 472 HB THR 72 HB THR 72 12.069 -2.841 5.727 473 HG1 THR 72 1HG THR 72 13.561 -4.024 6.833 474 HG21 THR 72 3HG2 THR 72 11.704 -3.332 8.133 475 HG22 THR 72 1HG2 THR 72 10.183 -3.098 7.290 476 HG23 THR 72 2HG2 THR 72 10.721 -4.746 7.694 477 HA PRO 73 HA PRO 73 7.110 -4.188 6.149 478 HB3 PRO 73 2HB PRO 73 6.811 -1.961 6.523 479 HG3 PRO 73 2HG PRO 73 8.111 -0.417 5.413 480 HD3 PRO 73 2HD PRO 73 9.942 -1.788 5.295 481 H LEU 74 H LEU 74 5.481 -5.300 5.311 482 HA LEU 74 HA LEU 74 4.911 -5.177 2.424 483 HB3 LEU 74 2HB LEU 74 6.250 -7.247 3.052 484 HG LEU 74 HG LEU 74 4.621 -7.948 5.019 485 HD11 LEU 74 1HD1 LEU 74 2.446 -7.923 3.893 486 HD12 LEU 74 2HD1 LEU 74 3.067 -8.854 2.546 487 HD13 LEU 74 3HD1 LEU 74 2.877 -9.596 4.138 488 HD21 LEU 74 3HD2 LEU 74 5.036 -10.351 4.436 489 HD22 LEU 74 1HD2 LEU 74 5.565 -9.814 2.809 490 HD23 LEU 74 2HD2 LEU 74 6.461 -9.312 4.262 491 H LEU 75 H LEU 75 2.800 -4.941 1.983 492 HA LEU 75 HA LEU 75 0.761 -5.662 3.976 493 HB3 LEU 75 2HB LEU 75 0.905 -2.817 2.920 494 HG LEU 75 HG LEU 75 -0.060 -2.871 5.594 495 HD11 LEU 75 1HD1 LEU 75 -0.481 -1.219 3.739 496 HD12 LEU 75 2HD1 LEU 75 -1.715 -2.332 3.114 497 HD13 LEU 75 3HD1 LEU 75 -1.851 -1.618 4.733 498 HD21 LEU 75 3HD2 LEU 75 -2.205 -4.021 5.488 499 HD22 LEU 75 1HD2 LEU 75 -1.809 -4.725 3.914 500 HD23 LEU 75 2HD2 LEU 75 -0.874 -5.168 5.369 501 H ASN 76 H ASN 76 -0.834 -3.598 2.028 502 HA ASN 76 HA ASN 76 -2.200 -3.740 0.262 503 HB3 ASN 76 2HB ASN 76 -0.899 -6.203 -0.917 504 HD21 ASN 76 2HD2 ASN 76 -0.109 -5.214 -3.270 505 HD22 ASN 76 1HD2 ASN 76 -1.491 -4.547 -4.123 506 H CYS 77 H CYS 77 -1.526 -7.241 0.703 507 HA CYS 77 HA CYS 77 -3.883 -7.733 2.289 508 HB3 CYS 77 2HB CYS 77 -3.968 -8.630 -0.617 509 H ALA 78 H ALA 78 -2.005 -8.639 3.496 510 HA ALA 78 HA ALA 78 -0.573 -10.902 2.391 511 HB1 ALA 78 3HB ALA 78 0.366 -11.094 4.649 512 HB2 ALA 78 1HB ALA 78 0.413 -9.420 4.063 513 HB3 ALA 78 2HB ALA 78 -0.799 -9.906 5.266 514 H LYS 79 H LYS 79 -2.919 -10.755 5.097 515 HA LYS 79 HA LYS 79 -3.961 -12.468 6.278 516 HB3 LYS 79 2HB LYS 79 -5.163 -12.194 3.563 517 HG3 LYS 79 2HG LYS 79 -7.247 -13.260 4.896 518 HD3 LYS 79 2HD LYS 79 -5.405 -14.307 2.842 519 HE3 LYS 79 2HE LYS 79 -7.290 -16.334 4.097 520 HZ1 LYS 79 3HZ LYS 79 -5.741 -17.816 2.901 521 HZ2 LYS 79 1HZ LYS 79 -6.369 -16.729 1.849 522 HZ3 LYS 79 2HZ LYS 79 -4.840 -16.540 2.424 523 HA PRO 80 HA PRO 80 -1.324 -16.024 5.131 524 HB3 PRO 80 2HB PRO 80 0.412 -15.442 6.471 525 HG3 PRO 80 2HG PRO 80 0.120 -13.914 8.203 526 HD3 PRO 80 2HD PRO 80 -1.278 -12.740 6.784 527 H ASP 81 H ASP 81 -3.391 -15.717 8.057 528 HA ASP 81 HA ASP 81 -5.030 -17.978 7.163 529 HB3 ASP 81 2HB ASP 81 -3.687 -18.115 9.889 530 H GLN 82 H GLN 82 -5.212 -14.982 7.982 531 HA GLN 82 HA GLN 82 -7.776 -15.070 9.381 532 HB3 GLN 82 2HB GLN 82 -5.295 -13.797 10.639 533 HG3 GLN 82 2HG GLN 82 -8.214 -13.614 11.518 534 HE21 GLN 82 2HE2 GLN 82 -7.257 -11.024 12.793 535 HE22 GLN 82 1HE2 GLN 82 -6.565 -11.544 14.330 536 H ASP 83 H ASP 83 -8.896 -13.021 9.187 537 HA ASP 83 HA ASP 83 -8.542 -11.433 6.917 538 HB3 ASP 83 2HB ASP 83 -10.552 -11.572 8.490 539 H ILE 84 H ILE 84 -7.434 -9.577 6.368 540 HA ILE 84 HA ILE 84 -5.410 -8.644 8.351 541 HB ILE 84 HB ILE 84 -4.986 -9.387 5.708 542 HG13 ILE 84 2HG1 ILE 84 -3.238 -7.571 7.418 543 HG21 ILE 84 1HG2 ILE 84 -5.950 -7.165 4.958 544 HG22 ILE 84 2HG2 ILE 84 -4.631 -6.362 5.822 545 HG23 ILE 84 3HG2 ILE 84 -4.277 -7.459 4.475 546 HD11 ILE 84 3HD1 ILE 84 -1.987 -9.699 7.925 547 HD12 ILE 84 1HD1 ILE 84 -3.565 -9.611 8.714 548 HD13 ILE 84 2HD1 ILE 84 -3.356 -10.612 7.267 549 H LYS 85 H LYS 85 -5.450 -6.744 9.177 550 HA LYS 85 HA LYS 85 -7.025 -4.571 8.031 551 HB3 LYS 85 2HB LYS 85 -8.808 -5.560 9.255 552 HG3 LYS 85 2HG LYS 85 -6.849 -5.826 11.554 553 HD3 LYS 85 2HD LYS 85 -9.744 -6.581 11.846 554 HE3 LYS 85 2HE LYS 85 -7.920 -7.192 13.508 555 HZ1 LYS 85 3HZ LYS 85 -7.190 -5.395 14.970 556 HZ2 LYS 85 1HZ LYS 85 -6.724 -5.041 13.448 557 HZ3 LYS 85 2HZ LYS 85 -8.009 -4.277 14.110 558 H PHE 86 H PHE 86 -6.054 -2.705 8.363 559 HA PHE 86 HA PHE 86 -3.925 -2.432 10.444 560 HB3 PHE 86 2HB PHE 86 -2.947 -1.319 7.978 561 HD1 PHE 86 2HD PHE 86 -2.521 -4.873 8.982 562 HD2 PHE 86 1HD PHE 86 -0.895 -0.886 9.154 563 HE1 PHE 86 2HE PHE 86 -0.387 -5.784 9.864 564 HE2 PHE 86 1HE PHE 86 1.242 -1.799 10.030 565 HZ PHE 86 HZ PHE 86 1.502 -4.247 10.377 566 H THR 87 H THR 87 -4.734 -0.820 11.586 567 HA THR 87 HA THR 87 -5.927 1.536 10.205 568 HB THR 87 HB THR 87 -7.356 0.522 11.850 569 HG1 THR 87 1HG THR 87 -7.845 2.423 12.823 570 HG21 THR 87 3HG2 THR 87 -6.979 0.592 14.220 571 HG22 THR 87 1HG2 THR 87 -5.674 -0.354 13.495 572 HG23 THR 87 2HG2 THR 87 -5.375 1.323 14.014 573 H ILE 88 H ILE 88 -4.896 3.346 10.014 574 HA ILE 88 HA ILE 88 -2.537 3.934 11.772 575 HB ILE 88 HB ILE 88 -2.997 4.375 8.836 576 HG13 ILE 88 2HG1 ILE 88 -1.576 2.563 9.665 577 HG21 ILE 88 1HG2 ILE 88 -2.743 6.713 9.617 578 HG22 ILE 88 2HG2 ILE 88 -1.279 6.258 10.526 579 HG23 ILE 88 3HG2 ILE 88 -1.326 6.206 8.749 580 HD11 ILE 88 3HD1 ILE 88 0.422 2.923 8.390 581 HD12 ILE 88 1HD1 ILE 88 -0.883 3.757 7.530 582 HD13 ILE 88 2HD1 ILE 88 0.286 4.677 8.511 583 H LYS 89 H LYS 89 -2.787 5.483 13.086 584 HA LYS 89 HA LYS 89 -4.879 7.562 12.716 585 HB3 LYS 89 2HB LYS 89 -5.119 6.504 14.832 586 HG3 LYS 89 2HG LYS 89 -2.165 7.030 15.338 587 HD3 LYS 89 2HD LYS 89 -2.410 5.915 17.451 588 HE3 LYS 89 2HE LYS 89 -3.246 8.492 17.044 589 HZ1 LYS 89 3HZ LYS 89 -5.178 8.780 18.462 590 HZ2 LYS 89 1HZ LYS 89 -5.622 7.766 17.259 591 HZ3 LYS 89 2HZ LYS 89 -5.302 7.181 18.751 592 H PHE 90 H PHE 90 -4.345 9.631 12.403 593 HA PHE 90 HA PHE 90 -2.045 10.630 11.318 594 HB3 PHE 90 2HB PHE 90 -4.022 11.971 11.400 595 HD1 PHE 90 1HD PHE 90 -5.854 10.751 12.808 596 HD2 PHE 90 2HD PHE 90 -3.038 13.556 14.480 597 HE1 PHE 90 1HE PHE 90 -7.224 10.901 14.862 598 HE2 PHE 90 2HE PHE 90 -4.431 13.730 16.521 599 HZ PHE 90 HZ PHE 90 -6.504 12.372 16.734 600 H GLN 91 H GLN 91 -2.693 10.468 14.815 601 HA GLN 91 HA GLN 91 0.008 11.458 15.485 602 HB3 GLN 91 2HB GLN 91 -2.348 10.740 17.263 603 HG3 GLN 91 2HG GLN 91 0.226 11.134 18.109 604 HE21 GLN 91 2HE2 GLN 91 1.032 12.823 19.759 605 HE22 GLN 91 1HE2 GLN 91 0.945 14.500 19.236 606 H GLU 92 H GLU 92 1.308 9.673 14.842 607 HA GLU 92 HA GLU 92 1.349 7.516 16.866 608 HB3 GLU 92 2HB GLU 92 1.505 6.883 13.901 609 HG3 GLU 92 2HG GLU 92 2.692 5.309 15.616 610 H PHE 93 H PHE 93 3.021 9.208 17.466 611 HA PHE 93 HA PHE 93 5.489 9.394 16.066 612 HB3 PHE 93 2HB PHE 93 4.699 10.736 18.113 613 HD1 PHE 93 1HD PHE 93 3.223 9.409 19.764 614 HD2 PHE 93 2HD PHE 93 7.512 9.003 19.619 615 HE1 PHE 93 1HE PHE 93 3.199 8.321 21.996 616 HE2 PHE 93 2HE PHE 93 7.485 7.923 21.852 617 HZ PHE 93 HZ PHE 93 5.328 7.563 23.034 618 H SER 94 H SER 94 7.318 8.096 15.965 619 HA SER 94 HA SER 94 7.369 5.541 17.479 620 HB3 SER 94 2HB SER 94 7.653 5.657 14.451 621 HG SER 94 HG SER 94 7.250 3.273 15.056 622 HA PRO 95 HA PRO 95 11.586 6.985 17.544 623 HB3 PRO 95 2HB PRO 95 11.845 6.010 19.589 624 HG3 PRO 95 2HG PRO 95 10.658 4.079 20.170 625 HD3 PRO 95 2HD PRO 95 8.866 5.125 19.148 626 H ASN 96 H ASN 96 10.557 4.176 15.784 627 HA ASN 96 HA ASN 96 13.087 3.749 14.372 628 HB3 ASN 96 2HB ASN 96 10.448 2.611 13.437 629 HD21 ASN 96 2HD2 ASN 96 11.327 -0.033 14.393 630 HD22 ASN 96 1HD2 ASN 96 12.685 -0.479 13.372 631 H LEU 97 H LEU 97 10.167 5.612 13.846 632 HA LEU 97 HA LEU 97 9.341 6.931 12.260 633 HB3 LEU 97 2HB LEU 97 11.965 7.085 10.801 634 HG LEU 97 HG LEU 97 9.596 8.773 11.011 635 HD11 LEU 97 1HD1 LEU 97 10.740 9.776 12.959 636 HD12 LEU 97 2HD1 LEU 97 12.180 10.079 11.964 637 HD13 LEU 97 3HD1 LEU 97 10.646 10.908 11.602 638 HD21 LEU 97 3HD2 LEU 97 10.743 10.104 9.295 639 HD22 LEU 97 1HD2 LEU 97 12.258 9.229 9.605 640 HD23 LEU 97 2HD2 LEU 97 10.857 8.368 8.932 641 H TRP 98 H TRP 98 10.833 4.037 11.149 642 HA TRP 98 HA TRP 98 9.425 3.950 8.560 643 HB3 TRP 98 2HB TRP 98 10.546 1.565 8.716 644 HD1 TRP 98 HD TRP 98 12.148 5.096 8.838 645 HE1 TRP 98 1HE TRP 98 13.699 5.336 6.809 646 HE3 TRP 98 3HE TRP 98 11.759 0.339 6.956 647 HZ2 TRP 98 2HZ TRP 98 14.651 3.684 4.651 648 HZ3 TRP 98 3HZ TRP 98 13.020 -0.296 4.911 649 HH2 TRP 98 HH TRP 98 14.456 1.360 3.747 650 H GLY 99 H GLY 99 8.305 3.469 11.644 651 HA2 GLY 99 2HA GLY 99 6.777 1.008 11.295 652 H LEU 100 H LEU 100 5.327 4.115 12.046 653 HA LEU 100 HA LEU 100 3.506 4.027 9.681 654 HB3 LEU 100 2HB LEU 100 1.574 4.270 11.141 655 HG LEU 100 HG LEU 100 3.301 1.939 12.094 656 HD11 LEU 100 1HD1 LEU 100 1.907 2.490 13.932 657 HD12 LEU 100 2HD1 LEU 100 0.467 2.611 12.890 658 HD13 LEU 100 3HD1 LEU 100 1.273 1.043 13.153 659 HD21 LEU 100 3HD2 LEU 100 1.901 0.534 10.812 660 HD22 LEU 100 1HD2 LEU 100 0.715 1.809 10.526 661 HD23 LEU 100 2HD2 LEU 100 2.304 1.876 9.730 662 H GLU 101 H GLU 101 5.751 5.858 11.210 663 HA GLU 101 HA GLU 101 4.378 8.422 11.409 664 HB3 GLU 101 2HB GLU 101 6.842 9.272 11.207 665 HG3 GLU 101 2HG GLU 101 6.623 7.554 13.628 666 H PHE 102 H PHE 102 4.294 10.071 10.023 667 HA PHE 102 HA PHE 102 4.814 9.552 7.163 668 HB3 PHE 102 2HB PHE 102 2.695 10.674 8.293 669 HD1 PHE 102 1HD PHE 102 4.112 12.139 10.318 670 HD2 PHE 102 2HD PHE 102 3.107 13.391 6.318 671 HE1 PHE 102 1HE PHE 102 4.189 14.508 11.035 672 HE2 PHE 102 2HE PHE 102 3.194 15.759 7.036 673 HZ PHE 102 HZ PHE 102 3.743 16.324 9.395 674 H GLN 103 H GLN 103 5.819 11.416 5.909 675 HA GLN 103 HA GLN 103 7.900 12.901 7.459 676 HB3 GLN 103 2HB GLN 103 9.418 12.768 5.584 677 HG3 GLN 103 2HG GLN 103 9.184 10.752 7.346 678 HE21 GLN 103 2HE2 GLN 103 9.489 8.350 7.267 679 HE22 GLN 103 1HE2 GLN 103 8.675 7.441 6.006 680 H LYS 104 H LYS 104 8.292 15.027 6.726 681 HA LYS 104 HA LYS 104 6.055 16.186 5.138 682 HB3 LYS 104 2HB LYS 104 8.044 17.816 6.748 683 HG3 LYS 104 2HG LYS 104 5.598 18.740 7.424 684 HD3 LYS 104 2HD LYS 104 6.989 19.559 4.846 685 HE3 LYS 104 2HE LYS 104 5.052 21.128 6.602 686 HZ1 LYS 104 3HZ LYS 104 5.023 22.592 4.667 687 HZ2 LYS 104 1HZ LYS 104 6.559 22.459 5.209 688 HZ3 LYS 104 2HZ LYS 104 6.083 21.661 3.862 689 H ASN 105 H ASN 105 6.397 17.564 3.447 690 HA ASN 105 HA ASN 105 7.200 18.155 1.440 691 HB3 ASN 105 2HB ASN 105 9.939 18.561 2.664 692 HD21 ASN 105 2HD2 ASN 105 11.065 20.349 1.689 693 HD22 ASN 105 1HD2 ASN 105 10.477 21.081 0.201 694 H LYS 106 H LYS 106 7.041 15.456 1.792 695 HA LYS 106 HA LYS 106 9.231 14.309 0.102 696 HB3 LYS 106 2HB LYS 106 8.305 12.378 2.074 697 HG3 LYS 106 2HG LYS 106 10.697 12.711 3.001 698 HD3 LYS 106 2HD LYS 106 10.648 11.924 0.067 699 HE3 LYS 106 2HE LYS 106 12.111 10.776 2.493 700 HZ1 LYS 106 3HZ LYS 106 13.486 9.739 0.822 701 HZ2 LYS 106 1HZ LYS 106 11.939 9.330 0.504 702 HZ3 LYS 106 2HZ LYS 106 12.693 10.465 -0.402 703 H ASP 107 H ASP 107 8.503 12.867 -1.424 704 HA ASP 107 HA ASP 107 5.556 12.324 -1.531 705 HB3 ASP 107 2HB ASP 107 6.589 11.247 -3.827 706 H TYR 108 H TYR 108 4.755 10.403 -1.065 707 HA TYR 108 HA TYR 108 6.595 8.115 -0.527 708 HB3 TYR 108 2HB TYR 108 3.847 7.448 -0.118 709 HD1 TYR 108 1HD TYR 108 5.773 5.638 0.402 710 HD2 TYR 108 2HD TYR 108 4.683 9.019 2.861 711 HE1 TYR 108 1HE TYR 108 6.672 4.478 2.418 712 HE2 TYR 108 2HE TYR 108 5.569 7.845 4.864 713 HH TYR 108 HH TYR 108 6.526 5.948 5.680 714 H TYR 109 H TYR 109 6.680 6.400 -1.813 715 HA TYR 109 HA TYR 109 4.611 5.960 -3.882 716 HB3 TYR 109 2HB TYR 109 7.317 5.283 -4.765 717 HD1 TYR 109 1HD TYR 109 5.259 4.189 -6.141 718 HD2 TYR 109 2HD TYR 109 6.570 8.287 -6.325 719 HE1 TYR 109 1HE TYR 109 4.575 4.333 -8.504 720 HE2 TYR 109 2HE TYR 109 5.813 8.424 -8.694 721 HH TYR 109 HH TYR 109 4.908 7.276 -10.475 722 H ILE 110 H ILE 110 4.079 3.916 -4.152 723 HA ILE 110 HA ILE 110 5.637 1.702 -2.870 724 HB ILE 110 HB ILE 110 2.638 2.125 -2.716 725 HG13 ILE 110 2HG1 ILE 110 3.648 3.631 -1.117 726 HG21 ILE 110 1HG2 ILE 110 3.112 -0.222 -2.932 727 HG22 ILE 110 2HG2 ILE 110 4.210 -0.128 -1.531 728 HG23 ILE 110 3HG2 ILE 110 2.469 0.204 -1.377 729 HD11 ILE 110 3HD1 ILE 110 3.014 2.911 1.058 730 HD12 ILE 110 1HD1 ILE 110 1.836 2.189 -0.042 731 HD13 ILE 110 2HD1 ILE 110 3.143 1.203 0.638 732 H ILE 111 H ILE 111 5.414 -0.249 -3.976 733 HA ILE 111 HA ILE 111 3.749 -0.355 -6.416 734 HB ILE 111 HB ILE 111 6.086 0.477 -6.989 735 HG13 ILE 111 2HG1 ILE 111 4.837 -0.480 -8.780 736 HG21 ILE 111 1HG2 ILE 111 7.201 -0.981 -5.208 737 HG22 ILE 111 2HG2 ILE 111 6.859 -2.325 -6.324 738 HG23 ILE 111 3HG2 ILE 111 7.966 -1.037 -6.796 739 HD11 ILE 111 3HD1 ILE 111 6.486 -1.830 -10.090 740 HD12 ILE 111 1HD1 ILE 111 7.176 -0.332 -9.462 741 HD13 ILE 111 2HD1 ILE 111 7.553 -1.911 -8.729 742 H SER 112 H SER 112 3.432 -2.626 -7.120 743 HA SER 112 HA SER 112 4.325 -4.724 -5.205 744 HB3 SER 112 2HB SER 112 2.223 -5.747 -4.967 745 HG SER 112 HG SER 112 0.838 -3.606 -4.573 746 H THR 113 H THR 113 4.036 -6.952 -6.117 747 HA THR 113 HA THR 113 4.326 -6.951 -9.093 748 HB THR 113 HB THR 113 6.289 -8.187 -9.058 749 HG1 THR 113 1HG THR 113 7.199 -9.054 -7.253 750 HG21 THR 113 3HG2 THR 113 7.881 -6.752 -8.032 751 HG22 THR 113 1HG2 THR 113 6.478 -5.687 -8.281 752 HG23 THR 113 2HG2 THR 113 6.783 -6.387 -6.682 753 H SER 114 H SER 114 1.953 -7.595 -8.016 754 HA SER 114 HA SER 114 1.328 -10.166 -7.261 755 HB3 SER 114 2HB SER 114 -0.081 -7.952 -8.663 756 HG SER 114 HG SER 114 -2.005 -9.131 -8.711 757 H ASN 115 H ASN 115 2.231 -9.324 -10.531 758 HA ASN 115 HA ASN 115 1.376 -11.729 -11.879 759 HB3 ASN 115 2HB ASN 115 3.659 -10.650 -13.188 760 HD21 ASN 115 2HD2 ASN 115 3.191 -10.107 -15.331 761 HD22 ASN 115 1HD2 ASN 115 1.546 -10.080 -15.937 762 H GLY 116 H GLY 116 4.006 -11.080 -9.733 763 HA2 GLY 116 2HA GLY 116 5.954 -12.088 -9.158 764 H SER 117 H SER 117 6.332 -11.470 -11.810 765 HA SER 117 HA SER 117 6.542 -13.409 -13.720 766 HB3 SER 117 2HB SER 117 7.597 -11.846 -15.009 767 HG SER 117 HG SER 117 7.354 -9.684 -14.031 768 H LEU 118 H LEU 118 7.753 -15.202 -14.023 769 HA LEU 118 HA LEU 118 9.585 -16.146 -12.130 770 HB3 LEU 118 2HB LEU 118 10.207 -17.796 -14.034 771 HG LEU 118 HG LEU 118 7.966 -18.873 -14.207 772 HD11 LEU 118 1HD1 LEU 118 9.535 -19.493 -12.439 773 HD12 LEU 118 2HD1 LEU 118 8.884 -18.216 -11.384 774 HD13 LEU 118 3HD1 LEU 118 7.864 -19.584 -11.868 775 HD21 LEU 118 3HD2 LEU 118 6.114 -18.181 -12.832 776 HD22 LEU 118 1HD2 LEU 118 7.011 -16.786 -12.217 777 HD23 LEU 118 2HD2 LEU 118 6.518 -16.856 -13.932 778 H GLU 119 H GLU 119 10.263 -14.157 -14.904 779 HA GLU 119 HA GLU 119 13.082 -14.385 -15.163 780 HB3 GLU 119 2HB GLU 119 12.912 -12.118 -16.140 781 HG3 GLU 119 2HG GLU 119 10.512 -13.844 -16.910 782 H GLY 120 H GLY 120 11.162 -12.677 -12.731 783 HA2 GLY 120 2HA GLY 120 13.583 -11.973 -11.210 784 H LEU 121 H LEU 121 11.352 -13.754 -10.706 785 HA LEU 121 HA LEU 121 9.389 -12.764 -9.010 786 HB3 LEU 121 2HB LEU 121 9.724 -15.102 -10.089 787 HG LEU 121 HG LEU 121 11.523 -15.483 -7.776 788 HD11 LEU 121 1HD1 LEU 121 9.429 -16.122 -6.644 789 HD12 LEU 121 2HD1 LEU 121 9.124 -17.319 -7.926 790 HD13 LEU 121 3HD1 LEU 121 10.543 -17.481 -6.861 791 HD21 LEU 121 3HD2 LEU 121 12.022 -17.586 -8.816 792 HD22 LEU 121 1HD2 LEU 121 10.644 -17.418 -9.923 793 HD23 LEU 121 2HD2 LEU 121 12.025 -16.299 -10.032 794 H ASP 122 H ASP 122 12.691 -13.388 -8.280 795 HA ASP 122 HA ASP 122 12.423 -12.323 -5.504 796 HB3 ASP 122 2HB ASP 122 14.344 -14.432 -6.554 797 H ASN 123 H ASN 123 13.675 -11.771 -8.591 798 HA ASN 123 HA ASN 123 16.027 -10.197 -7.802 799 HB3 ASN 123 2HB ASN 123 14.641 -10.016 -10.487 800 HD21 ASN 123 2HD2 ASN 123 15.993 -7.910 -10.184 801 HD22 ASN 123 1HD2 ASN 123 17.656 -8.024 -10.765 802 H GLN 124 H GLN 124 12.967 -9.702 -7.002 803 HA GLN 124 HA GLN 124 11.605 -7.920 -6.603 804 HB3 GLN 124 2HB GLN 124 12.917 -5.723 -6.209 805 HG3 GLN 124 2HG GLN 124 12.490 -7.867 -4.505 806 HE21 GLN 124 2HE2 GLN 124 13.764 -9.498 -3.578 807 HE22 GLN 124 1HE2 GLN 124 15.499 -9.376 -3.388 808 H GLU 125 H GLU 125 11.311 -8.657 -9.171 809 HA GLU 125 HA GLU 125 11.303 -6.094 -10.741 810 HB3 GLU 125 2HB GLU 125 10.878 -7.555 -12.700 811 HG3 GLU 125 2HG GLU 125 13.456 -8.027 -11.156 812 H GLY 126 H GLY 126 9.545 -5.116 -11.266 813 HA2 GLY 126 2HA GLY 126 6.908 -5.920 -10.328 814 H GLY 127 H GLY 127 5.656 -7.249 -11.405 815 HA2 GLY 127 2HA GLY 127 5.808 -7.477 -14.381 816 H VAL 128 H VAL 128 3.425 -6.781 -11.770 817 HA VAL 128 HA VAL 128 1.278 -6.246 -13.703 818 HB VAL 128 HB VAL 128 -0.053 -5.485 -11.825 819 HG11 VAL 128 1HG1 VAL 128 0.281 -7.953 -12.370 820 HG12 VAL 128 2HG1 VAL 128 1.362 -7.956 -10.962 821 HG13 VAL 128 3HG1 VAL 128 -0.352 -7.554 -10.771 822 HG21 VAL 128 3HG2 VAL 128 0.686 -5.587 -9.527 823 HG22 VAL 128 1HG2 VAL 128 2.341 -6.003 -10.030 824 HG23 VAL 128 2HG2 VAL 128 1.665 -4.423 -10.434 825 H CYS 129 H CYS 129 3.584 -4.258 -11.828 826 HA CYS 129 HA CYS 129 2.658 -1.704 -12.443 827 HB3 CYS 129 2HB CYS 129 5.390 -2.879 -12.061 828 H GLN 130 H GLN 130 4.342 -3.947 -14.546 829 HA GLN 130 HA GLN 130 5.146 -2.311 -16.630 830 HB3 GLN 130 2HB GLN 130 4.145 -5.114 -17.155 831 HG3 GLN 130 2HG GLN 130 6.808 -5.165 -17.655 832 HE21 GLN 130 2HE2 GLN 130 6.292 -3.046 -20.119 833 HE22 GLN 130 1HE2 GLN 130 5.516 -4.159 -21.235 834 H THR 131 H THR 131 1.866 -3.492 -16.004 835 HA THR 131 HA THR 131 0.823 -1.757 -18.188 836 HB THR 131 HB THR 131 0.224 -4.731 -18.017 837 HG1 THR 131 1HG THR 131 0.904 -4.619 -20.188 838 HG21 THR 131 3HG2 THR 131 -1.289 -4.298 -19.991 839 HG22 THR 131 1HG2 THR 131 -1.912 -3.646 -18.479 840 HG23 THR 131 2HG2 THR 131 -1.148 -2.553 -19.658 841 H ARG 132 H ARG 132 -0.266 -4.091 -15.636 842 HA ARG 132 HA ARG 132 -2.804 -2.868 -15.082 843 HB3 ARG 132 2HB ARG 132 -0.896 -4.650 -13.592 844 HG3 ARG 132 2HG ARG 132 -1.927 -3.289 -11.747 845 HD3 ARG 132 2HD ARG 132 -4.485 -4.554 -12.817 846 HE ARG 132 HE ARG 132 -3.910 -3.853 -10.148 847 HH11 ARG 132 1HH2 ARG 132 -6.356 -3.067 -12.509 848 HH12 ARG 132 2HH2 ARG 132 -7.594 -2.809 -11.311 849 HH21 ARG 132 1HH1 ARG 132 -5.559 -3.501 -8.629 850 HH22 ARG 132 2HH1 ARG 132 -7.136 -3.034 -9.179 851 H ALA 133 H ALA 133 0.439 -1.996 -14.137 852 HA ALA 133 HA ALA 133 1.320 -0.296 -12.894 853 HB1 ALA 133 3HB ALA 133 0.243 1.934 -13.121 854 HB2 ALA 133 1HB ALA 133 0.572 1.079 -14.647 855 HB3 ALA 133 2HB ALA 133 -1.074 1.137 -14.008 856 H MET 134 H MET 134 0.902 -1.916 -11.154 857 HA MET 134 HA MET 134 -0.966 -0.910 -9.071 858 HB3 MET 134 2HB MET 134 0.944 -3.237 -8.878 859 HG3 MET 134 2HG MET 134 -0.829 -1.870 -6.978 860 HE1 MET 134 3HE MET 134 -3.911 -3.937 -6.965 861 HE2 MET 134 1HE MET 134 -3.150 -2.421 -6.433 862 HE3 MET 134 2HE MET 134 -3.078 -2.886 -8.145 863 H LYS 135 H LYS 135 -0.046 1.137 -8.883 864 HA LYS 135 HA LYS 135 2.005 0.998 -6.785 865 HB3 LYS 135 2HB LYS 135 3.417 1.818 -8.492 866 HG3 LYS 135 2HG LYS 135 2.747 4.246 -9.412 867 HD3 LYS 135 2HD LYS 135 1.473 2.081 -11.038 868 HE3 LYS 135 2HE LYS 135 3.341 4.444 -11.380 869 HZ1 LYS 135 3HZ LYS 135 3.735 3.777 -13.647 870 HZ2 LYS 135 1HZ LYS 135 4.330 2.632 -12.649 871 HZ3 LYS 135 2HZ LYS 135 2.929 2.369 -13.460 872 H ILE 136 H ILE 136 2.048 3.004 -5.494 873 HA ILE 136 HA ILE 136 -0.528 4.389 -5.500 874 HB ILE 136 HB ILE 136 -1.218 4.040 -3.388 875 HG13 ILE 136 2HG1 ILE 136 1.631 3.889 -2.603 876 HG21 ILE 136 1HG2 ILE 136 -1.239 1.819 -4.501 877 HG22 ILE 136 2HG2 ILE 136 0.324 1.441 -3.733 878 HG23 ILE 136 3HG2 ILE 136 -1.123 1.703 -2.741 879 HD11 ILE 136 3HD1 ILE 136 0.933 5.111 -0.705 880 HD12 ILE 136 1HD1 ILE 136 0.247 5.876 -2.149 881 HD13 ILE 136 2HD1 ILE 136 -0.791 4.875 -1.105 882 H LEU 137 H LEU 137 -0.513 6.473 -4.727 883 HA LEU 137 HA LEU 137 2.184 7.666 -4.208 884 HB3 LEU 137 2HB LEU 137 0.952 9.681 -5.526 885 HG LEU 137 HG LEU 137 2.465 7.335 -6.743 886 HD11 LEU 137 1HD1 LEU 137 1.050 8.402 -8.467 887 HD12 LEU 137 2HD1 LEU 137 1.803 9.979 -8.096 888 HD13 LEU 137 3HD1 LEU 137 2.783 8.636 -8.749 889 HD21 LEU 137 3HD2 LEU 137 4.190 9.295 -6.924 890 HD22 LEU 137 1HD2 LEU 137 3.195 10.115 -5.737 891 HD23 LEU 137 2HD2 LEU 137 3.925 8.545 -5.350 892 H MET 138 H MET 138 2.335 9.072 -2.653 893 HA MET 138 HA MET 138 -0.099 10.198 -1.379 894 HB3 MET 138 2HB MET 138 1.080 9.746 0.858 895 HG3 MET 138 2HG MET 138 -0.077 7.459 -0.749 896 HE1 MET 138 3HE MET 138 -0.930 5.572 2.906 897 HE2 MET 138 1HE MET 138 -1.610 7.153 2.465 898 HE3 MET 138 2HE MET 138 -1.640 5.812 1.291 899 H LYS 139 H LYS 139 0.069 12.224 -1.683 900 HA LYS 139 HA LYS 139 2.577 13.776 -1.566 901 HB3 LYS 139 2HB LYS 139 0.682 15.654 -1.722 902 HG3 LYS 139 2HG LYS 139 0.360 14.691 -4.277 903 HD3 LYS 139 2HD LYS 139 2.795 16.063 -3.058 904 HE3 LYS 139 2HE LYS 139 2.441 15.012 -5.725 905 HZ1 LYS 139 3HZ LYS 139 2.893 17.090 -6.915 906 HZ2 LYS 139 1HZ LYS 139 1.408 17.150 -6.243 907 HZ3 LYS 139 2HZ LYS 139 2.648 17.974 -5.568 908 H VAL 140 H VAL 140 3.433 14.426 0.274 909 HA VAL 140 HA VAL 140 1.735 15.383 2.498 910 HB VAL 140 HB VAL 140 3.240 14.206 4.153 911 HG11 VAL 140 1HG1 VAL 140 0.835 13.667 3.694 912 HG12 VAL 140 2HG1 VAL 140 1.397 12.415 2.565 913 HG13 VAL 140 3HG1 VAL 140 1.808 12.317 4.293 914 HG21 VAL 140 3HG2 VAL 140 4.075 11.957 3.516 915 HG22 VAL 140 1HG2 VAL 140 3.759 12.311 1.806 916 HG23 VAL 140 2HG2 VAL 140 4.970 13.243 2.713 917 H GLY 141 H GLY 141 2.253 17.411 2.482 918 HA2 GLY 141 2HA GLY 141 4.234 18.592 3.793 919 H GLN 142 H GLN 142 3.289 18.883 0.346 920 HA GLN 142 HA GLN 142 3.056 21.802 0.557 921 HB3 GLN 142 2HB GLN 142 2.167 20.581 -1.978 922 HG3 GLN 142 2HG GLN 142 4.686 22.197 -1.533 923 HE21 GLN 142 2HE2 GLN 142 1.609 22.870 -3.275 924 HE22 GLN 142 1HE2 GLN 142 2.330 22.817 -4.878 Start of MODEL 8 1 H1 SER 1 H SER 1 -12.520 18.568 14.546 2 HA SER 1 HA SER 1 -10.975 16.232 15.054 3 HB3 SER 1 2HB SER 1 -12.313 15.613 16.891 4 HG SER 1 HG SER 1 -14.632 15.521 16.694 5 H LYS 2 H LYS 2 -10.498 16.282 12.895 6 HA LYS 2 HA LYS 2 -12.569 16.397 10.813 7 HB3 LYS 2 2HB LYS 2 -9.852 15.486 10.056 8 HG3 LYS 2 2HG LYS 2 -11.563 16.493 8.457 9 HD3 LYS 2 2HD LYS 2 -11.070 19.066 8.279 10 HE3 LYS 2 2HE LYS 2 -13.094 18.564 10.460 11 HZ1 LYS 2 3HZ LYS 2 -14.382 20.004 8.987 12 HZ2 LYS 2 1HZ LYS 2 -12.947 20.731 9.275 13 HZ3 LYS 2 2HZ LYS 2 -13.224 19.989 7.843 14 H SER 3 H SER 3 -13.058 14.788 9.353 15 HA SER 3 HA SER 3 -12.178 11.994 9.667 16 HB3 SER 3 2HB SER 3 -14.734 11.371 9.618 17 HG SER 3 HG SER 3 -14.648 11.215 11.919 18 H ILE 4 H ILE 4 -11.527 11.741 7.634 19 HA ILE 4 HA ILE 4 -13.406 12.344 5.382 20 HB ILE 4 HB ILE 4 -11.070 12.352 4.084 21 HG13 ILE 4 2HG1 ILE 4 -9.250 13.326 5.030 22 HG21 ILE 4 1HG2 ILE 4 -12.774 13.978 3.820 23 HG22 ILE 4 2HG2 ILE 4 -12.391 14.745 5.372 24 HG23 ILE 4 3HG2 ILE 4 -11.227 14.804 4.029 25 HD11 ILE 4 3HD1 ILE 4 -9.010 14.274 7.239 26 HD12 ILE 4 1HD1 ILE 4 -10.184 15.209 6.306 27 HD13 ILE 4 2HD1 ILE 4 -10.740 14.081 7.569 28 H VAL 5 H VAL 5 -11.042 10.057 6.681 29 HA VAL 5 HA VAL 5 -10.563 7.891 6.239 30 HB VAL 5 HB VAL 5 -13.431 7.536 5.365 31 HG11 VAL 5 1HG1 VAL 5 -11.866 5.533 5.255 32 HG12 VAL 5 2HG1 VAL 5 -11.427 5.817 6.941 33 HG13 VAL 5 3HG1 VAL 5 -13.065 5.314 6.534 34 HG21 VAL 5 3HG2 VAL 5 -13.922 7.170 7.792 35 HG22 VAL 5 1HG2 VAL 5 -12.365 7.941 8.164 36 HG23 VAL 5 2HG2 VAL 5 -13.635 8.847 7.323 37 H LEU 6 H LEU 6 -9.079 8.005 4.784 38 HA LEU 6 HA LEU 6 -9.731 7.717 1.889 39 HB3 LEU 6 2HB LEU 6 -7.070 8.303 2.124 40 HG LEU 6 HG LEU 6 -7.446 10.551 1.395 41 HD11 LEU 6 1HD1 LEU 6 -7.826 8.747 -0.280 42 HD12 LEU 6 2HD1 LEU 6 -9.574 8.827 0.062 43 HD13 LEU 6 3HD1 LEU 6 -8.733 10.226 -0.610 44 HD21 LEU 6 3HD2 LEU 6 -9.688 11.568 1.288 45 HD22 LEU 6 1HD2 LEU 6 -10.393 10.151 2.088 46 HD23 LEU 6 2HD2 LEU 6 -9.243 11.190 2.958 47 H GLU 7 H GLU 7 -7.578 6.657 0.829 48 HA GLU 7 HA GLU 7 -7.120 4.527 0.116 49 HB3 GLU 7 2HB GLU 7 -5.674 3.741 2.554 50 HG3 GLU 7 2HG GLU 7 -4.670 4.735 -0.133 51 HA PRO 8 HA PRO 8 -10.429 2.543 2.818 52 HB3 PRO 8 2HB PRO 8 -12.061 4.085 2.184 53 HG3 PRO 8 2HG PRO 8 -12.093 5.008 -0.005 54 HD3 PRO 8 2HD PRO 8 -9.871 5.424 0.555 55 H ILE 9 H ILE 9 -9.315 0.519 2.705 56 HA ILE 9 HA ILE 9 -9.878 -1.144 0.279 57 HB ILE 9 HB ILE 9 -7.728 -1.924 2.165 58 HG13 ILE 9 2HG1 ILE 9 -5.994 -0.656 1.103 59 HG21 ILE 9 1HG2 ILE 9 -8.349 -3.322 0.273 60 HG22 ILE 9 2HG2 ILE 9 -7.978 -1.995 -0.848 61 HG23 ILE 9 3HG2 ILE 9 -6.689 -2.727 0.106 62 HD11 ILE 9 3HD1 ILE 9 -6.551 1.485 0.034 63 HD12 ILE 9 1HD1 ILE 9 -6.740 0.026 -0.982 64 HD13 ILE 9 2HD1 ILE 9 -8.178 0.872 -0.326 65 H TYR 10 H TYR 10 -11.603 -2.361 0.654 66 HA TYR 10 HA TYR 10 -12.020 -3.651 3.331 67 HB3 TYR 10 2HB TYR 10 -14.412 -3.421 2.901 68 HD1 TYR 10 2HD TYR 10 -12.629 -2.022 4.773 69 HD2 TYR 10 1HD TYR 10 -14.878 -0.502 1.413 70 HE1 TYR 10 2HE TYR 10 -12.734 0.208 5.849 71 HE2 TYR 10 1HE TYR 10 -14.979 1.735 2.513 72 HH TYR 10 HH TYR 10 -13.403 2.369 5.646 73 H TRP 11 H TRP 11 -10.518 -5.244 2.134 74 HA TRP 11 HA TRP 11 -10.096 -7.199 1.178 75 HB3 TRP 11 2HB TRP 11 -12.662 -7.695 2.102 76 HD1 TRP 11 HD TRP 11 -14.880 -7.630 0.899 77 HE1 TRP 11 1HE TRP 11 -15.884 -8.493 -1.308 78 HE3 TRP 11 3HE TRP 11 -10.651 -9.631 -1.165 79 HZ2 TRP 11 2HZ TRP 11 -14.906 -9.705 -3.747 80 HZ3 TRP 11 3HZ TRP 11 -10.697 -10.561 -3.465 81 HH2 TRP 11 HH TRP 11 -12.808 -10.588 -4.783 82 H ASN 12 H ASN 12 -12.675 -5.493 -0.583 83 HA ASN 12 HA ASN 12 -12.423 -6.357 -3.143 84 HB3 ASN 12 2HB ASN 12 -13.281 -4.053 -3.787 85 HD21 ASN 12 2HD2 ASN 12 -14.844 -3.501 -0.934 86 HD22 ASN 12 1HD2 ASN 12 -16.163 -4.624 -1.153 87 H SER 13 H SER 13 -9.916 -4.533 -1.610 88 HA SER 13 HA SER 13 -7.974 -3.571 -2.334 89 HB3 SER 13 2HB SER 13 -6.973 -5.167 -4.299 90 HG SER 13 HG SER 13 -6.170 -6.347 -2.511 91 H SER 14 H SER 14 -9.552 -1.886 -2.993 92 HA SER 14 HA SER 14 -8.748 -0.795 -5.628 93 HB3 SER 14 2HB SER 14 -11.365 0.086 -5.406 94 HG SER 14 HG SER 14 -11.738 -1.361 -7.116 95 H ASN 15 H ASN 15 -9.670 1.538 -5.726 96 HA ASN 15 HA ASN 15 -8.998 2.965 -3.169 97 HB3 ASN 15 2HB ASN 15 -7.922 4.599 -4.721 98 HD21 ASN 15 2HD2 ASN 15 -6.863 2.881 -2.739 99 HD22 ASN 15 1HD2 ASN 15 -5.421 2.139 -3.400 100 H SER 16 H SER 16 -10.006 5.150 -2.968 101 HA SER 16 HA SER 16 -12.771 5.150 -3.740 102 HB3 SER 16 2HB SER 16 -11.976 6.333 -1.755 103 HG SER 16 HG SER 16 -11.024 8.492 -2.252 104 H LYS 17 H LYS 17 -9.955 6.846 -5.074 105 HA LYS 17 HA LYS 17 -11.355 8.143 -7.254 106 HB3 LYS 17 2HB LYS 17 -8.871 8.229 -8.121 107 HG3 LYS 17 2HG LYS 17 -8.749 9.726 -5.623 108 HD3 LYS 17 2HD LYS 17 -9.151 10.400 -8.559 109 HE3 LYS 17 2HE LYS 17 -9.791 12.096 -6.200 110 HZ1 LYS 17 3HZ LYS 17 -9.083 14.066 -7.497 111 HZ2 LYS 17 1HZ LYS 17 -7.808 13.207 -6.947 112 HZ3 LYS 17 2HZ LYS 17 -8.240 13.115 -8.529 113 H PHE 18 H PHE 18 -9.717 5.033 -7.080 114 HA PHE 18 HA PHE 18 -9.240 3.477 -8.732 115 HB3 PHE 18 2HB PHE 18 -12.222 3.842 -8.607 116 HD1 PHE 18 1HD PHE 18 -9.796 1.031 -9.405 117 HD2 PHE 18 2HD PHE 18 -13.521 2.987 -10.321 118 HE1 PHE 18 1HE PHE 18 -10.257 -0.656 -11.174 119 HE2 PHE 18 2HE PHE 18 -13.982 1.304 -12.077 120 HZ PHE 18 HZ PHE 18 -12.347 -0.513 -12.513 121 H LEU 19 H LEU 19 -7.995 5.139 -9.997 122 HA LEU 19 HA LEU 19 -9.130 5.394 -12.741 123 HB3 LEU 19 2HB LEU 19 -9.237 7.492 -11.121 124 HG LEU 19 HG LEU 19 -6.492 7.489 -11.235 125 HD11 LEU 19 1HD1 LEU 19 -6.436 7.953 -13.696 126 HD12 LEU 19 2HD1 LEU 19 -7.491 9.348 -13.464 127 HD13 LEU 19 3HD1 LEU 19 -5.858 9.335 -12.772 128 HD21 LEU 19 3HD2 LEU 19 -6.658 9.929 -10.687 129 HD22 LEU 19 1HD2 LEU 19 -8.371 9.896 -11.187 130 HD23 LEU 19 2HD2 LEU 19 -7.808 8.948 -9.800 131 HA PRO 20 HA PRO 20 -5.075 4.065 -14.074 132 HB3 PRO 20 2HB PRO 20 -6.044 3.831 -16.142 133 HG3 PRO 20 2HG PRO 20 -7.481 5.508 -17.079 134 HD3 PRO 20 2HD PRO 20 -8.442 4.919 -14.972 135 H GLY 21 H GLY 21 -4.725 5.903 -12.186 136 HA2 GLY 21 2HA GLY 21 -2.964 8.145 -13.141 137 H GLN 22 H GLN 22 -1.813 5.642 -12.654 138 HA GLN 22 HA GLN 22 -0.430 4.398 -11.411 139 HB3 GLN 22 2HB GLN 22 1.471 5.434 -10.406 140 HG3 GLN 22 2HG GLN 22 0.508 7.644 -12.271 141 HE21 GLN 22 2HE2 GLN 22 2.964 6.692 -13.913 142 HE22 GLN 22 1HE2 GLN 22 4.311 7.408 -13.055 143 H GLY 23 H GLY 23 -3.054 4.588 -10.443 144 HA2 GLY 23 2HA GLY 23 -3.937 3.133 -8.859 145 H LEU 24 H LEU 24 -2.772 5.020 -6.214 146 HA LEU 24 HA LEU 24 -4.827 7.126 -6.431 147 HB3 LEU 24 2HB LEU 24 -4.718 5.021 -4.260 148 HG LEU 24 HG LEU 24 -4.835 7.268 -3.152 149 HD11 LEU 24 1HD1 LEU 24 -6.119 8.458 -4.951 150 HD12 LEU 24 2HD1 LEU 24 -7.568 7.547 -4.456 151 HD13 LEU 24 3HD1 LEU 24 -6.780 8.652 -3.321 152 HD21 LEU 24 3HD2 LEU 24 -6.722 6.753 -1.730 153 HD22 LEU 24 1HD2 LEU 24 -7.409 5.676 -2.943 154 HD23 LEU 24 2HD2 LEU 24 -5.869 5.249 -2.148 155 H VAL 25 H VAL 25 -3.988 8.978 -5.919 156 HA VAL 25 HA VAL 25 -1.385 9.280 -4.567 157 HB VAL 25 HB VAL 25 -3.338 11.257 -5.825 158 HG11 VAL 25 1HG1 VAL 25 -2.269 12.481 -4.139 159 HG12 VAL 25 2HG1 VAL 25 -0.685 11.728 -4.435 160 HG13 VAL 25 3HG1 VAL 25 -1.377 12.861 -5.618 161 HG21 VAL 25 3HG2 VAL 25 -1.420 11.447 -7.482 162 HG22 VAL 25 1HG2 VAL 25 -0.676 10.062 -6.651 163 HG23 VAL 25 2HG2 VAL 25 -2.238 9.876 -7.463 164 H LEU 26 H LEU 26 -1.091 9.925 -2.570 165 HA LEU 26 HA LEU 26 -3.396 10.823 -0.933 166 HB3 LEU 26 2HB LEU 26 -1.680 9.579 0.891 167 HG LEU 26 HG LEU 26 -3.299 7.943 1.327 168 HD11 LEU 26 1HD1 LEU 26 -4.010 10.269 1.881 169 HD12 LEU 26 2HD1 LEU 26 -4.914 10.344 0.310 170 HD13 LEU 26 3HD1 LEU 26 -5.343 9.179 1.549 171 HD21 LEU 26 3HD2 LEU 26 -5.102 7.302 -0.102 172 HD22 LEU 26 1HD2 LEU 26 -4.677 8.526 -1.300 173 HD23 LEU 26 2HD2 LEU 26 -3.594 7.142 -1.010 174 H TYR 27 H TYR 27 -2.682 11.791 1.140 175 HA TYR 27 HA TYR 27 -0.460 13.739 0.714 176 HB3 TYR 27 2HB TYR 27 -2.147 15.353 1.834 177 HD1 TYR 27 2HD TYR 27 -3.330 13.538 -1.276 178 HD2 TYR 27 1HD TYR 27 -1.537 17.083 0.423 179 HE1 TYR 27 2HE TYR 27 -3.373 14.630 -3.502 180 HE2 TYR 27 1HE TYR 27 -1.642 18.185 -1.807 181 HH TYR 27 HH TYR 27 -2.899 16.523 -4.704 182 HA PRO 28 HA PRO 28 0.154 12.073 4.930 183 HB3 PRO 28 2HB PRO 28 2.295 11.537 4.316 184 HG3 PRO 28 2HG PRO 28 3.467 12.778 2.717 185 HD3 PRO 28 2HD PRO 28 1.484 12.699 1.496 186 H GLN 29 H GLN 29 -1.563 13.542 5.477 187 HA GLN 29 HA GLN 29 -0.686 15.962 6.986 188 HB3 GLN 29 2HB GLN 29 -3.255 16.581 6.158 189 HG3 GLN 29 2HG GLN 29 -2.172 17.922 4.301 190 HE21 GLN 29 2HE2 GLN 29 -2.380 20.010 5.110 191 HE22 GLN 29 1HE2 GLN 29 -1.878 20.478 6.726 192 H ILE 30 H ILE 30 -1.049 15.731 9.012 193 HA ILE 30 HA ILE 30 -2.610 13.668 10.221 194 HB ILE 30 HB ILE 30 -1.461 16.203 11.428 195 HG13 ILE 30 2HG1 ILE 30 0.346 14.746 12.248 196 HG21 ILE 30 1HG2 ILE 30 -3.218 15.310 12.891 197 HG22 ILE 30 2HG2 ILE 30 -2.493 13.690 12.817 198 HG23 ILE 30 3HG2 ILE 30 -1.634 15.022 13.596 199 HD11 ILE 30 3HD1 ILE 30 0.822 12.578 11.274 200 HD12 ILE 30 1HD1 ILE 30 -0.718 12.470 12.126 201 HD13 ILE 30 2HD1 ILE 30 -0.682 12.582 10.355 202 H GLY 31 H GLY 31 -4.632 13.552 9.790 203 HA2 GLY 31 2HA GLY 31 -6.712 14.846 11.083 204 H ASP 32 H ASP 32 -5.575 13.273 8.092 205 HA ASP 32 HA ASP 32 -8.141 11.945 7.624 206 HB3 ASP 32 2HB ASP 32 -6.556 12.725 5.799 207 H LYS 33 H LYS 33 -7.937 9.501 7.053 208 HA LYS 33 HA LYS 33 -6.220 7.944 8.808 209 HB3 LYS 33 2HB LYS 33 -8.162 8.402 10.303 210 HG3 LYS 33 2HG LYS 33 -9.745 6.864 8.212 211 HD3 LYS 33 2HD LYS 33 -10.120 6.443 10.868 212 HE3 LYS 33 2HE LYS 33 -12.413 7.769 11.158 213 HZ1 LYS 33 3HZ LYS 33 -11.303 9.422 12.502 214 HZ2 LYS 33 1HZ LYS 33 -10.633 7.954 12.764 215 HZ3 LYS 33 2HZ LYS 33 -9.841 9.078 11.843 216 H LEU 34 H LEU 34 -6.219 5.735 8.186 217 HA LEU 34 HA LEU 34 -7.591 5.037 5.709 218 HB3 LEU 34 2HB LEU 34 -5.878 5.794 4.424 219 HG LEU 34 HG LEU 34 -3.872 5.105 6.601 220 HD11 LEU 34 1HD1 LEU 34 -3.053 4.109 4.518 221 HD12 LEU 34 2HD1 LEU 34 -3.311 5.649 3.666 222 HD13 LEU 34 3HD1 LEU 34 -2.092 5.527 4.951 223 HD21 LEU 34 3HD2 LEU 34 -3.011 7.393 6.026 224 HD22 LEU 34 1HD2 LEU 34 -4.341 7.580 4.853 225 HD23 LEU 34 2HD2 LEU 34 -4.665 7.438 6.591 226 H ASP 35 H ASP 35 -8.143 3.013 5.553 227 HA ASP 35 HA ASP 35 -7.126 1.059 7.559 228 HB3 ASP 35 2HB ASP 35 -9.074 1.491 8.558 229 H ILE 36 H ILE 36 -6.097 -0.439 6.620 230 HA ILE 36 HA ILE 36 -6.939 -1.392 3.944 231 HB ILE 36 HB ILE 36 -4.684 -0.453 4.142 232 HG13 ILE 36 2HG1 ILE 36 -5.396 -2.353 2.533 233 HG21 ILE 36 1HG2 ILE 36 -4.193 -1.369 6.508 234 HG22 ILE 36 2HG2 ILE 36 -3.899 -2.933 5.747 235 HG23 ILE 36 3HG2 ILE 36 -2.887 -1.518 5.349 236 HD11 ILE 36 3HD1 ILE 36 -3.076 -2.484 1.614 237 HD12 ILE 36 1HD1 ILE 36 -3.605 -0.836 2.019 238 HD13 ILE 36 2HD1 ILE 36 -2.480 -1.661 3.082 239 H ILE 37 H ILE 37 -8.043 -3.204 3.889 240 HA ILE 37 HA ILE 37 -7.699 -5.265 6.006 241 HB ILE 37 HB ILE 37 -10.369 -4.546 4.728 242 HG13 ILE 37 2HG1 ILE 37 -9.754 -2.632 6.026 243 HG21 ILE 37 1HG2 ILE 37 -10.072 -6.873 5.506 244 HG22 ILE 37 2HG2 ILE 37 -9.671 -6.278 7.132 245 HG23 ILE 37 3HG2 ILE 37 -11.285 -6.021 6.432 246 HD11 ILE 37 3HD1 ILE 37 -11.476 -2.471 7.613 247 HD12 ILE 37 1HD1 ILE 37 -12.121 -3.566 6.366 248 HD13 ILE 37 2HD1 ILE 37 -11.506 -4.217 7.902 249 H CYS 38 H CYS 38 -7.264 -7.193 5.193 250 HA CYS 38 HA CYS 38 -7.997 -7.914 2.395 251 HB3 CYS 38 2HB CYS 38 -5.666 -9.151 2.554 252 HA PRO 39 HA PRO 39 -9.248 -11.604 4.616 253 HB3 PRO 39 2HB PRO 39 -11.037 -11.463 3.069 254 HG3 PRO 39 2HG PRO 39 -10.680 -10.983 0.790 255 HD3 PRO 39 2HD PRO 39 -9.481 -9.183 1.619 256 H LYS 40 H LYS 40 -8.772 -13.907 4.558 257 HA LYS 40 HA LYS 40 -6.055 -14.578 3.547 258 HB3 LYS 40 2HB LYS 40 -6.462 -14.959 5.887 259 HG3 LYS 40 2HG LYS 40 -8.150 -17.249 5.942 260 HD3 LYS 40 2HD LYS 40 -8.535 -14.395 6.920 261 HE3 LYS 40 2HE LYS 40 -10.199 -15.611 8.534 262 HZ1 LYS 40 3HZ LYS 40 -12.037 -15.048 7.113 263 HZ2 LYS 40 1HZ LYS 40 -10.916 -13.876 7.001 264 HZ3 LYS 40 2HZ LYS 40 -11.111 -14.971 5.780 265 H VAL 41 H VAL 41 -9.201 -14.998 2.481 266 HA VAL 41 HA VAL 41 -8.499 -16.809 0.380 267 HB VAL 41 HB VAL 41 -10.616 -18.332 1.262 268 HG11 VAL 41 1HG1 VAL 41 -8.517 -19.067 0.193 269 HG12 VAL 41 2HG1 VAL 41 -7.699 -19.006 1.764 270 HG13 VAL 41 3HG1 VAL 41 -9.060 -20.108 1.535 271 HG21 VAL 41 3HG2 VAL 41 -10.269 -19.136 3.440 272 HG22 VAL 41 1HG2 VAL 41 -8.854 -18.097 3.693 273 HG23 VAL 41 2HG2 VAL 41 -10.486 -17.373 3.566 274 H ASP 42 H ASP 42 -9.794 -16.397 -1.311 275 HA ASP 42 HA ASP 42 -12.646 -15.957 -1.104 276 HB3 ASP 42 2HB ASP 42 -11.972 -13.698 -2.647 277 H SER 43 H SER 43 -10.151 -14.992 -3.553 278 HA SER 43 HA SER 43 -11.613 -16.068 -5.741 279 HB3 SER 43 2HB SER 43 -8.695 -15.844 -6.132 280 HG SER 43 HG SER 43 -9.552 -14.352 -7.749 281 H LYS 44 H LYS 44 -8.872 -17.463 -3.908 282 HA LYS 44 HA LYS 44 -9.018 -20.020 -5.416 283 HB3 LYS 44 2HB LYS 44 -7.002 -20.637 -4.326 284 HG3 LYS 44 2HG LYS 44 -5.404 -18.865 -4.667 285 HD3 LYS 44 2HD LYS 44 -7.619 -18.579 -6.741 286 HE3 LYS 44 2HE LYS 44 -5.462 -16.933 -6.408 287 HZ1 LYS 44 3HZ LYS 44 -3.939 -17.539 -8.193 288 HZ2 LYS 44 1HZ LYS 44 -3.908 -18.738 -7.081 289 HZ3 LYS 44 2HZ LYS 44 -4.729 -18.935 -8.486 290 H THR 45 H THR 45 -9.965 -18.792 -2.339 291 HA THR 45 HA THR 45 -10.727 -19.673 -0.392 292 HB THR 45 HB THR 45 -12.606 -19.236 -1.823 293 HG1 THR 45 1HG THR 45 -14.081 -20.262 -0.491 294 HG21 THR 45 3HG2 THR 45 -14.024 -21.035 -2.641 295 HG22 THR 45 1HG2 THR 45 -12.520 -20.855 -3.554 296 HG23 THR 45 2HG2 THR 45 -12.704 -22.205 -2.403 297 H VAL 46 H VAL 46 -8.519 -21.224 -1.240 298 HA VAL 46 HA VAL 46 -9.186 -24.024 -0.762 299 HB VAL 46 HB VAL 46 -7.545 -22.823 -2.538 300 HG11 VAL 46 1HG1 VAL 46 -5.842 -22.155 -0.777 301 HG12 VAL 46 2HG1 VAL 46 -5.593 -23.884 -0.438 302 HG13 VAL 46 3HG1 VAL 46 -5.156 -23.219 -2.010 303 HG21 VAL 46 3HG2 VAL 46 -6.563 -25.030 -3.002 304 HG22 VAL 46 1HG2 VAL 46 -7.196 -25.627 -1.447 305 HG23 VAL 46 2HG2 VAL 46 -8.307 -25.111 -2.740 306 H GLY 47 H GLY 47 -7.811 -21.488 1.151 307 HA2 GLY 47 2HA GLY 47 -7.602 -21.502 3.445 308 H GLN 48 H GLN 48 -5.392 -21.321 1.519 309 HA GLN 48 HA GLN 48 -3.146 -21.445 3.363 310 HB3 GLN 48 2HB GLN 48 -3.299 -23.814 2.511 311 HG3 GLN 48 2HG GLN 48 -1.809 -22.899 0.055 312 HE21 GLN 48 2HE2 GLN 48 -2.262 -24.389 -1.857 313 HE22 GLN 48 1HE2 GLN 48 -2.658 -26.058 -1.493 314 H TYR 49 H TYR 49 -4.511 -20.471 0.377 315 HA TYR 49 HA TYR 49 -2.172 -18.779 -0.366 316 HB3 TYR 49 2HB TYR 49 -3.951 -19.891 -2.503 317 HD1 TYR 49 1HD TYR 49 -0.384 -20.100 -1.290 318 HD2 TYR 49 2HD TYR 49 -3.020 -19.012 -4.528 319 HE1 TYR 49 1HE TYR 49 1.581 -19.461 -2.685 320 HE2 TYR 49 2HE TYR 49 -1.047 -18.396 -5.917 321 HH TYR 49 HH TYR 49 1.237 -18.253 -6.029 322 H GLU 50 H GLU 50 -3.729 -17.591 -2.613 323 HA GLU 50 HA GLU 50 -4.964 -15.703 -2.942 324 HB3 GLU 50 2HB GLU 50 -6.833 -16.883 -0.886 325 HG3 GLU 50 2HG GLU 50 -7.767 -14.736 -1.271 326 H TYR 51 H TYR 51 -2.983 -14.866 -1.915 327 HA TYR 51 HA TYR 51 -3.703 -12.867 0.169 328 HB3 TYR 51 2HB TYR 51 -2.355 -14.607 1.258 329 HD1 TYR 51 2HD TYR 51 0.314 -12.764 -0.610 330 HD2 TYR 51 1HD TYR 51 -1.419 -16.600 0.332 331 HE1 TYR 51 2HE TYR 51 2.246 -13.898 -1.694 332 HE2 TYR 51 1HE TYR 51 0.551 -17.731 -0.713 333 HH TYR 51 HH TYR 51 3.209 -15.909 -2.257 334 H TYR 52 H TYR 52 -2.328 -11.026 0.147 335 HA TYR 52 HA TYR 52 -1.151 -10.300 -2.507 336 HB3 TYR 52 2HB TYR 52 -2.042 -7.935 -1.921 337 HD1 TYR 52 1HD TYR 52 -4.528 -10.790 -2.112 338 HD2 TYR 52 2HD TYR 52 -2.793 -7.320 -4.006 339 HE1 TYR 52 1HE TYR 52 -5.978 -11.141 -4.100 340 HE2 TYR 52 2HE TYR 52 -4.304 -7.652 -5.967 341 HH TYR 52 HH TYR 52 -5.834 -9.038 -6.977 342 H LYS 53 H LYS 53 0.372 -8.471 -2.259 343 HA LYS 53 HA LYS 53 1.395 -7.896 0.426 344 HB3 LYS 53 2HB LYS 53 2.558 -10.022 -0.302 345 HG3 LYS 53 2HG LYS 53 4.055 -8.208 -2.237 346 HD3 LYS 53 2HD LYS 53 4.099 -11.243 -2.020 347 HE3 LYS 53 2HE LYS 53 6.568 -10.165 -2.913 348 HZ1 LYS 53 3HZ LYS 53 5.893 -11.153 -5.037 349 HZ2 LYS 53 1HZ LYS 53 5.535 -12.170 -3.810 350 HZ3 LYS 53 2HZ LYS 53 4.348 -11.301 -4.539 351 H VAL 54 H VAL 54 2.475 -5.956 0.533 352 HA VAL 54 HA VAL 54 2.765 -4.424 -2.007 353 HB VAL 54 HB VAL 54 1.487 -2.981 0.290 354 HG11 VAL 54 1HG1 VAL 54 2.390 -1.926 -1.793 355 HG12 VAL 54 2HG1 VAL 54 1.152 -2.764 -2.708 356 HG13 VAL 54 3HG1 VAL 54 0.671 -1.574 -1.475 357 HG21 VAL 54 3HG2 VAL 54 -0.770 -3.381 -0.552 358 HG22 VAL 54 1HG2 VAL 54 -0.151 -4.532 -1.765 359 HG23 VAL 54 2HG2 VAL 54 -0.075 -4.918 -0.039 360 H TYR 55 H TYR 55 4.451 -3.151 -2.077 361 HA TYR 55 HA TYR 55 6.229 -2.919 0.333 362 HB3 TYR 55 2HB TYR 55 8.053 -3.300 -1.479 363 HD1 TYR 55 2HD TYR 55 5.414 -5.983 -1.486 364 HD2 TYR 55 1HD TYR 55 9.227 -4.654 0.031 365 HE1 TYR 55 2HE TYR 55 5.766 -8.181 -0.381 366 HE2 TYR 55 1HE TYR 55 9.594 -6.895 1.063 367 HH TYR 55 HH TYR 55 7.164 -9.500 0.866 368 H MET 56 H MET 56 7.306 -1.053 0.555 369 HA MET 56 HA MET 56 6.697 1.256 -1.069 370 HB3 MET 56 2HB MET 56 7.326 1.341 1.322 371 HG3 MET 56 2HG MET 56 9.435 -0.307 0.824 372 HE1 MET 56 3HE MET 56 12.131 3.139 1.970 373 HE2 MET 56 1HE MET 56 10.409 3.103 2.420 374 HE3 MET 56 2HE MET 56 11.490 1.784 2.929 375 H VAL 57 H VAL 57 8.171 2.381 -2.507 376 HA VAL 57 HA VAL 57 10.761 1.396 -3.141 377 HB VAL 57 HB VAL 57 8.986 -0.183 -4.437 378 HG11 VAL 57 1HG1 VAL 57 7.861 1.595 -5.680 379 HG12 VAL 57 2HG1 VAL 57 9.380 1.998 -6.477 380 HG13 VAL 57 3HG1 VAL 57 8.676 0.418 -6.749 381 HG21 VAL 57 3HG2 VAL 57 10.766 -0.644 -6.091 382 HG22 VAL 57 1HG2 VAL 57 11.630 0.802 -5.523 383 HG23 VAL 57 2HG2 VAL 57 11.342 -0.540 -4.427 384 H ASP 58 H ASP 58 11.740 2.784 -5.120 385 HA ASP 58 HA ASP 58 11.072 5.573 -4.575 386 HB3 ASP 58 2HB ASP 58 12.781 6.080 -6.253 387 H LYS 59 H LYS 59 10.447 7.208 -6.329 388 HA LYS 59 HA LYS 59 8.172 6.607 -7.895 389 HB3 LYS 59 2HB LYS 59 10.295 8.774 -8.158 390 HG3 LYS 59 2HG LYS 59 8.155 9.941 -9.275 391 HD3 LYS 59 2HD LYS 59 10.623 9.007 -10.331 392 HE3 LYS 59 2HE LYS 59 8.965 7.397 -11.648 393 HZ1 LYS 59 3HZ LYS 59 8.297 8.440 -13.720 394 HZ2 LYS 59 1HZ LYS 59 7.545 9.206 -12.504 395 HZ3 LYS 59 2HZ LYS 59 8.833 9.905 -13.240 396 H ASP 60 H ASP 60 11.565 6.641 -9.034 397 HA ASP 60 HA ASP 60 11.045 5.903 -11.747 398 HB3 ASP 60 2HB ASP 60 13.436 5.591 -9.901 399 H GLN 61 H GLN 61 11.841 3.857 -8.919 400 HA GLN 61 HA GLN 61 11.787 1.351 -10.274 401 HB3 GLN 61 2HB GLN 61 11.594 0.448 -7.910 402 HG3 GLN 61 2HG GLN 61 13.535 1.820 -6.847 403 HE21 GLN 61 2HE2 GLN 61 15.638 1.904 -9.147 404 HE22 GLN 61 1HE2 GLN 61 15.956 0.199 -9.418 405 H ALA 62 H ALA 62 9.247 3.224 -8.613 406 HA ALA 62 HA ALA 62 7.124 1.329 -8.750 407 HB1 ALA 62 3HB ALA 62 5.706 3.365 -8.380 408 HB2 ALA 62 1HB ALA 62 7.074 3.281 -7.270 409 HB3 ALA 62 2HB ALA 62 7.110 4.380 -8.661 410 H ASP 63 H ASP 63 7.993 4.060 -10.980 411 HA ASP 63 HA ASP 63 5.984 3.426 -12.930 412 HB3 ASP 63 2HB ASP 63 8.443 4.811 -13.887 413 H ARG 64 H ARG 64 9.337 2.359 -12.556 414 HA ARG 64 HA ARG 64 9.613 0.716 -14.894 415 HB3 ARG 64 2HB ARG 64 11.197 -0.575 -13.180 416 HG3 ARG 64 2HG ARG 64 12.922 1.144 -13.227 417 HD3 ARG 64 2HD ARG 64 11.714 1.401 -15.969 418 HE ARG 64 HE ARG 64 14.312 1.356 -14.991 419 HH11 ARG 64 1HH2 ARG 64 12.583 -0.568 -17.352 420 HH12 ARG 64 2HH2 ARG 64 14.035 -1.066 -18.166 421 HH21 ARG 64 1HH1 ARG 64 16.151 0.662 -16.066 422 HH22 ARG 64 2HH1 ARG 64 16.007 -0.372 -17.456 423 H CYS 65 H CYS 65 7.529 0.281 -12.233 424 HA CYS 65 HA CYS 65 6.374 -1.397 -11.359 425 HB3 CYS 65 2HB CYS 65 5.550 -3.187 -12.896 426 H THR 66 H THR 66 8.920 -1.445 -10.480 427 HA THR 66 HA THR 66 9.306 -4.372 -10.005 428 HB THR 66 HB THR 66 11.734 -4.098 -10.053 429 HG1 THR 66 1HG THR 66 12.548 -2.221 -11.096 430 HG21 THR 66 3HG2 THR 66 12.039 -4.126 -12.408 431 HG22 THR 66 1HG2 THR 66 10.444 -4.860 -12.112 432 HG23 THR 66 2HG2 THR 66 10.547 -3.193 -12.702 433 H ILE 67 H ILE 67 10.277 -4.962 -8.065 434 HA ILE 67 HA ILE 67 10.081 -2.936 -5.860 435 HB ILE 67 HB ILE 67 9.934 -5.894 -5.348 436 HG13 ILE 67 2HG1 ILE 67 7.599 -6.081 -5.417 437 HG21 ILE 67 1HG2 ILE 67 10.274 -4.507 -3.481 438 HG22 ILE 67 2HG2 ILE 67 8.878 -3.467 -3.905 439 HG23 ILE 67 3HG2 ILE 67 8.644 -5.165 -3.405 440 HD11 ILE 67 3HD1 ILE 67 6.109 -4.410 -6.466 441 HD12 ILE 67 1HD1 ILE 67 6.812 -3.787 -4.983 442 HD13 ILE 67 2HD1 ILE 67 7.456 -3.271 -6.572 443 H LYS 68 H LYS 68 11.942 -2.631 -4.709 444 HA LYS 68 HA LYS 68 14.443 -3.932 -5.452 445 HB3 LYS 68 2HB LYS 68 14.086 -2.254 -2.952 446 HG3 LYS 68 2HG LYS 68 16.350 -3.059 -3.855 447 HD3 LYS 68 2HD LYS 68 15.780 -0.755 -5.802 448 HE3 LYS 68 2HE LYS 68 18.249 -2.472 -5.320 449 HZ1 LYS 68 3HZ LYS 68 19.231 -1.061 -7.019 450 HZ2 LYS 68 1HZ LYS 68 17.964 -1.864 -7.668 451 HZ3 LYS 68 2HZ LYS 68 17.823 -0.274 -7.277 452 H LYS 69 H LYS 69 15.359 -5.742 -4.475 453 HA LYS 69 HA LYS 69 14.046 -7.152 -2.297 454 HB3 LYS 69 2HB LYS 69 16.236 -8.444 -2.191 455 HG3 LYS 69 2HG LYS 69 14.962 -8.381 -4.951 456 HD3 LYS 69 2HD LYS 69 15.252 -10.968 -3.626 457 HE3 LYS 69 2HE LYS 69 16.759 -9.892 -6.046 458 HZ1 LYS 69 3HZ LYS 69 16.666 -12.205 -6.716 459 HZ2 LYS 69 1HZ LYS 69 17.361 -12.143 -5.237 460 HZ3 LYS 69 2HZ LYS 69 15.806 -12.635 -5.398 461 H GLU 70 H GLU 70 16.245 -4.495 -2.245 462 HA GLU 70 HA GLU 70 17.043 -4.806 0.525 463 HB3 GLU 70 2HB GLU 70 17.834 -2.519 0.358 464 HG3 GLU 70 2HG GLU 70 18.532 -3.765 -2.313 465 H ASN 71 H ASN 71 14.003 -4.022 -0.785 466 HA ASN 71 HA ASN 71 13.029 -2.292 1.369 467 HB3 ASN 71 2HB ASN 71 10.838 -2.809 0.394 468 HD21 ASN 71 2HD2 ASN 71 10.810 -2.956 -2.469 469 HD22 ASN 71 1HD2 ASN 71 11.140 -1.282 -2.801 470 H THR 72 H THR 72 10.912 -3.229 2.409 471 HA THR 72 HA THR 72 11.462 -5.854 3.708 472 HB THR 72 HB THR 72 11.066 -4.981 5.868 473 HG1 THR 72 1HG THR 72 10.580 -2.810 6.212 474 HG21 THR 72 3HG2 THR 72 12.887 -3.466 6.240 475 HG22 THR 72 1HG2 THR 72 13.382 -4.556 4.922 476 HG23 THR 72 2HG2 THR 72 12.852 -2.896 4.556 477 HA PRO 73 HA PRO 73 7.112 -6.510 3.018 478 HB3 PRO 73 2HB PRO 73 7.386 -8.702 3.611 479 HG3 PRO 73 2HG PRO 73 8.898 -9.333 5.287 480 HD3 PRO 73 2HD PRO 73 10.273 -7.825 4.159 481 H LEU 74 H LEU 74 6.680 -4.221 3.435 482 HA LEU 74 HA LEU 74 5.844 -3.252 5.999 483 HB3 LEU 74 2HB LEU 74 4.970 -2.229 3.264 484 HG LEU 74 HG LEU 74 5.151 -0.013 4.208 485 HD11 LEU 74 1HD1 LEU 74 2.920 -1.159 4.345 486 HD12 LEU 74 2HD1 LEU 74 3.279 -1.501 6.064 487 HD13 LEU 74 3HD1 LEU 74 3.205 0.169 5.492 488 HD21 LEU 74 3HD2 LEU 74 5.430 0.437 6.578 489 HD22 LEU 74 1HD2 LEU 74 5.554 -1.291 6.955 490 HD23 LEU 74 2HD2 LEU 74 6.818 -0.495 5.981 491 H LEU 75 H LEU 75 3.904 -4.333 3.152 492 HA LEU 75 HA LEU 75 1.616 -4.739 5.008 493 HB3 LEU 75 2HB LEU 75 1.354 -4.114 2.093 494 HG LEU 75 HG LEU 75 -0.677 -2.889 2.828 495 HD11 LEU 75 1HD1 LEU 75 -0.905 -5.197 1.975 496 HD12 LEU 75 2HD1 LEU 75 -0.911 -5.808 3.647 497 HD13 LEU 75 3HD1 LEU 75 -2.177 -4.709 3.100 498 HD21 LEU 75 3HD2 LEU 75 -1.709 -3.319 4.996 499 HD22 LEU 75 1HD2 LEU 75 -0.372 -4.305 5.517 500 HD23 LEU 75 2HD2 LEU 75 -0.125 -2.557 5.219 501 H ASN 76 H ASN 76 0.957 -6.634 5.286 502 HA ASN 76 HA ASN 76 1.672 -8.896 3.473 503 HB3 ASN 76 2HB ASN 76 1.666 -9.983 5.956 504 HD21 ASN 76 2HD2 ASN 76 3.843 -10.135 7.074 505 HD22 ASN 76 1HD2 ASN 76 5.221 -10.039 5.995 506 H CYS 77 H CYS 77 -0.522 -8.125 2.599 507 HA CYS 77 HA CYS 77 -3.016 -8.623 3.854 508 HB3 CYS 77 2HB CYS 77 -3.616 -8.999 1.283 509 H ALA 78 H ALA 78 -2.500 -10.539 5.070 510 HA ALA 78 HA ALA 78 -2.668 -12.635 5.676 511 HB1 ALA 78 3HB ALA 78 -4.025 -14.249 4.469 512 HB2 ALA 78 1HB ALA 78 -4.819 -12.665 4.474 513 HB3 ALA 78 2HB ALA 78 -3.990 -13.241 3.009 514 H LYS 79 H LYS 79 -0.228 -11.753 4.729 515 HA LYS 79 HA LYS 79 1.187 -13.599 3.156 516 HB3 LYS 79 2HB LYS 79 2.330 -12.269 5.649 517 HG3 LYS 79 2HG LYS 79 3.719 -13.880 4.053 518 HD3 LYS 79 2HD LYS 79 4.589 -11.427 2.667 519 HE3 LYS 79 2HE LYS 79 3.686 -14.123 1.550 520 HZ1 LYS 79 3HZ LYS 79 5.233 -13.548 -0.201 521 HZ2 LYS 79 1HZ LYS 79 4.156 -12.323 -0.045 522 HZ3 LYS 79 2HZ LYS 79 5.687 -12.169 0.545 523 HA PRO 80 HA PRO 80 1.960 -16.594 6.739 524 HB3 PRO 80 2HB PRO 80 2.058 -15.572 8.765 525 HG3 PRO 80 2HG PRO 80 0.682 -13.810 9.348 526 HD3 PRO 80 2HD PRO 80 1.110 -12.969 7.232 527 H ASP 81 H ASP 81 -1.386 -16.310 7.937 528 HA ASP 81 HA ASP 81 -2.621 -17.707 5.727 529 HB3 ASP 81 2HB ASP 81 -2.645 -19.352 8.265 530 H GLN 82 H GLN 82 -3.108 -15.277 7.285 531 HA GLN 82 HA GLN 82 -5.834 -15.736 8.328 532 HB3 GLN 82 2HB GLN 82 -4.267 -14.062 10.184 533 HG3 GLN 82 2HG GLN 82 -5.840 -16.637 10.600 534 HE21 GLN 82 2HE2 GLN 82 -6.538 -13.831 12.521 535 HE22 GLN 82 1HE2 GLN 82 -5.650 -14.348 13.946 536 H ASP 83 H ASP 83 -7.094 -13.776 8.650 537 HA ASP 83 HA ASP 83 -6.721 -11.856 6.566 538 HB3 ASP 83 2HB ASP 83 -8.945 -12.228 7.309 539 H ILE 84 H ILE 84 -5.854 -9.852 6.535 540 HA ILE 84 HA ILE 84 -4.534 -8.893 9.029 541 HB ILE 84 HB ILE 84 -3.202 -9.494 6.649 542 HG13 ILE 84 2HG1 ILE 84 -2.353 -7.686 8.952 543 HG21 ILE 84 1HG2 ILE 84 -4.023 -7.422 5.562 544 HG22 ILE 84 2HG2 ILE 84 -3.315 -6.455 6.880 545 HG23 ILE 84 3HG2 ILE 84 -2.275 -7.424 5.830 546 HD11 ILE 84 3HD1 ILE 84 -1.099 -9.700 9.714 547 HD12 ILE 84 1HD1 ILE 84 -2.843 -9.923 9.806 548 HD13 ILE 84 2HD1 ILE 84 -1.929 -10.670 8.476 549 H LYS 85 H LYS 85 -4.960 -6.987 9.717 550 HA LYS 85 HA LYS 85 -6.414 -5.001 8.089 551 HB3 LYS 85 2HB LYS 85 -7.464 -6.157 10.709 552 HG3 LYS 85 2HG LYS 85 -9.383 -4.417 9.882 553 HD3 LYS 85 2HD LYS 85 -8.041 -2.599 11.351 554 HE3 LYS 85 2HE LYS 85 -10.193 -4.061 11.847 555 HZ1 LYS 85 3HZ LYS 85 -9.842 -5.440 13.796 556 HZ2 LYS 85 1HZ LYS 85 -8.957 -6.068 12.577 557 HZ3 LYS 85 2HZ LYS 85 -8.230 -5.204 13.774 558 H PHE 86 H PHE 86 -5.554 -3.141 8.297 559 HA PHE 86 HA PHE 86 -4.096 -2.344 10.777 560 HB3 PHE 86 2HB PHE 86 -2.637 -1.130 8.793 561 HD1 PHE 86 1HD PHE 86 -2.070 -4.777 9.023 562 HD2 PHE 86 2HD PHE 86 -1.223 -0.933 10.770 563 HE1 PHE 86 1HE PHE 86 -0.204 -5.779 10.326 564 HE2 PHE 86 2HE PHE 86 0.641 -1.932 12.069 565 HZ PHE 86 HZ PHE 86 1.134 -4.358 11.862 566 H THR 87 H THR 87 -5.154 -0.629 11.542 567 HA THR 87 HA THR 87 -6.259 1.367 9.603 568 HB THR 87 HB THR 87 -8.054 0.304 10.817 569 HG1 THR 87 1HG THR 87 -8.962 2.264 11.457 570 HG21 THR 87 3HG2 THR 87 -8.469 0.596 13.139 571 HG22 THR 87 1HG2 THR 87 -6.907 -0.221 12.983 572 HG23 THR 87 2HG2 THR 87 -6.972 1.510 13.387 573 H ILE 88 H ILE 88 -5.158 3.102 9.474 574 HA ILE 88 HA ILE 88 -3.532 4.076 11.787 575 HB ILE 88 HB ILE 88 -2.922 3.813 8.970 576 HG13 ILE 88 2HG1 ILE 88 -1.537 3.560 11.200 577 HG21 ILE 88 1HG2 ILE 88 -3.824 6.108 8.596 578 HG22 ILE 88 2HG2 ILE 88 -2.788 6.723 9.890 579 HG23 ILE 88 3HG2 ILE 88 -2.084 6.046 8.400 580 HD11 ILE 88 3HD1 ILE 88 0.598 4.007 9.970 581 HD12 ILE 88 1HD1 ILE 88 -0.550 2.945 9.139 582 HD13 ILE 88 2HD1 ILE 88 -0.365 4.623 8.613 583 H LYS 89 H LYS 89 -4.322 5.695 12.820 584 HA LYS 89 HA LYS 89 -6.414 7.487 11.641 585 HB3 LYS 89 2HB LYS 89 -5.822 7.025 14.600 586 HG3 LYS 89 2HG LYS 89 -8.576 7.683 13.818 587 HD3 LYS 89 2HD LYS 89 -8.242 9.633 15.315 588 HE3 LYS 89 2HE LYS 89 -7.257 7.112 16.708 589 HZ1 LYS 89 3HZ LYS 89 -8.800 7.915 18.399 590 HZ2 LYS 89 1HZ LYS 89 -7.720 9.100 18.073 591 HZ3 LYS 89 2HZ LYS 89 -9.243 9.189 17.480 592 H PHE 90 H PHE 90 -6.060 9.741 11.906 593 HA PHE 90 HA PHE 90 -3.516 10.820 11.717 594 HB3 PHE 90 2HB PHE 90 -5.478 12.088 11.135 595 HD1 PHE 90 2HD PHE 90 -7.699 11.029 11.847 596 HD2 PHE 90 1HD PHE 90 -5.463 13.666 14.403 597 HE1 PHE 90 2HE PHE 90 -9.692 11.304 13.317 598 HE2 PHE 90 1HE PHE 90 -7.452 13.950 15.861 599 HZ PHE 90 HZ PHE 90 -9.556 12.735 15.332 600 H GLN 91 H GLN 91 -1.866 10.352 13.001 601 HA GLN 91 HA GLN 91 -2.045 11.096 15.878 602 HB3 GLN 91 2HB GLN 91 -0.360 8.728 15.407 603 HG3 GLN 91 2HG GLN 91 -1.214 9.636 17.626 604 HE21 GLN 91 2HE2 GLN 91 -2.998 9.980 19.048 605 HE22 GLN 91 1HE2 GLN 91 -4.640 9.539 18.621 606 H GLU 92 H GLU 92 -0.603 12.633 16.238 607 HA GLU 92 HA GLU 92 1.639 13.213 14.522 608 HB3 GLU 92 2HB GLU 92 2.136 14.492 16.964 609 HG3 GLU 92 2HG GLU 92 0.254 15.517 14.821 610 H PHE 93 H PHE 93 1.351 11.357 17.515 611 HA PHE 93 HA PHE 93 4.146 10.361 17.224 612 HB3 PHE 93 2HB PHE 93 4.026 10.422 19.877 613 HD1 PHE 93 2HD PHE 93 3.897 13.773 18.211 614 HD2 PHE 93 1HD PHE 93 6.380 10.616 19.755 615 HE1 PHE 93 2HE PHE 93 5.905 15.195 17.881 616 HE2 PHE 93 1HE PHE 93 8.386 12.049 19.457 617 HZ PHE 93 HZ PHE 93 8.152 14.328 18.496 618 H SER 94 H SER 94 4.099 8.206 17.193 619 HA SER 94 HA SER 94 1.701 6.714 18.072 620 HB3 SER 94 2HB SER 94 4.255 5.699 16.778 621 HG SER 94 HG SER 94 3.039 3.862 16.574 622 HA PRO 95 HA PRO 95 3.970 5.707 21.900 623 HB3 PRO 95 2HB PRO 95 1.942 5.781 22.967 624 HG3 PRO 95 2HG PRO 95 -0.053 5.041 21.948 625 HD3 PRO 95 2HD PRO 95 0.777 6.467 20.242 626 H ASN 96 H ASN 96 3.161 3.504 19.349 627 HA ASN 96 HA ASN 96 5.415 1.748 20.089 628 HB3 ASN 96 2HB ASN 96 2.998 0.239 19.221 629 HD21 ASN 96 2HD2 ASN 96 3.864 -1.843 19.306 630 HD22 ASN 96 1HD2 ASN 96 4.906 -2.406 20.601 631 H LEU 97 H LEU 97 6.624 1.559 18.334 632 HA LEU 97 HA LEU 97 7.436 1.567 16.245 633 HB3 LEU 97 2HB LEU 97 5.188 1.103 14.525 634 HG LEU 97 HG LEU 97 6.056 -1.117 14.184 635 HD11 LEU 97 1HD1 LEU 97 7.247 0.731 13.051 636 HD12 LEU 97 2HD1 LEU 97 8.413 0.811 14.394 637 HD13 LEU 97 3HD1 LEU 97 8.297 -0.642 13.394 638 HD21 LEU 97 3HD2 LEU 97 7.917 -2.051 15.438 639 HD22 LEU 97 1HD2 LEU 97 8.011 -0.614 16.469 640 HD23 LEU 97 2HD2 LEU 97 6.582 -1.667 16.534 641 H TRP 98 H TRP 98 8.185 3.434 15.525 642 HA TRP 98 HA TRP 98 6.558 5.719 14.810 643 HB3 TRP 98 2HB TRP 98 8.751 6.543 13.812 644 HD1 TRP 98 HD TRP 98 7.648 8.131 15.688 645 HE1 TRP 98 1HE TRP 98 8.488 8.734 18.024 646 HE3 TRP 98 3HE TRP 98 10.801 4.178 16.387 647 HZ2 TRP 98 2HZ TRP 98 10.317 7.606 19.978 648 HZ3 TRP 98 3HZ TRP 98 12.104 3.975 18.497 649 HH2 TRP 98 HH TRP 98 11.877 5.677 20.297 650 H GLY 99 H GLY 99 6.576 2.854 13.221 651 HA2 GLY 99 2HA GLY 99 6.667 3.565 10.440 652 H LEU 100 H LEU 100 4.238 4.225 12.937 653 HA LEU 100 HA LEU 100 2.248 5.170 10.924 654 HB3 LEU 100 2HB LEU 100 0.657 5.145 12.542 655 HG LEU 100 HG LEU 100 2.530 3.290 14.076 656 HD11 LEU 100 1HD1 LEU 100 0.480 4.142 15.204 657 HD12 LEU 100 2HD1 LEU 100 -0.504 3.439 13.895 658 HD13 LEU 100 3HD1 LEU 100 0.465 2.385 14.958 659 HD21 LEU 100 3HD2 LEU 100 1.460 1.421 12.975 660 HD22 LEU 100 1HD2 LEU 100 0.572 2.511 11.881 661 HD23 LEU 100 2HD2 LEU 100 2.356 2.441 11.836 662 H GLU 101 H GLU 101 4.918 6.462 12.433 663 HA GLU 101 HA GLU 101 3.917 9.282 12.497 664 HB3 GLU 101 2HB GLU 101 6.669 9.299 12.910 665 HG3 GLU 101 2HG GLU 101 5.339 8.806 15.464 666 H PHE 102 H PHE 102 4.628 10.770 11.025 667 HA PHE 102 HA PHE 102 6.263 9.865 8.716 668 HB3 PHE 102 2HB PHE 102 4.734 10.714 7.116 669 HD1 PHE 102 1HD PHE 102 4.814 7.970 7.511 670 HD2 PHE 102 2HD PHE 102 1.712 10.618 8.917 671 HE1 PHE 102 1HE PHE 102 3.244 6.050 7.690 672 HE2 PHE 102 2HE PHE 102 0.149 8.693 9.074 673 HZ PHE 102 HZ PHE 102 0.920 6.420 8.471 674 H GLN 103 H GLN 103 7.195 11.638 7.512 675 HA GLN 103 HA GLN 103 7.510 14.157 9.112 676 HB3 GLN 103 2HB GLN 103 9.747 14.329 8.243 677 HG3 GLN 103 2HG GLN 103 9.310 12.934 10.336 678 HE21 GLN 103 2HE2 GLN 103 9.520 10.801 11.382 679 HE22 GLN 103 1HE2 GLN 103 9.364 9.343 10.417 680 H LYS 104 H LYS 104 7.271 16.039 8.109 681 HA LYS 104 HA LYS 104 6.250 16.295 5.372 682 HB3 LYS 104 2HB LYS 104 5.460 17.795 7.175 683 HG3 LYS 104 2HG LYS 104 7.440 19.761 7.314 684 HD3 LYS 104 2HD LYS 104 6.864 17.648 9.449 685 HE3 LYS 104 2HE LYS 104 8.275 20.302 9.346 686 HZ1 LYS 104 3HZ LYS 104 7.714 20.711 11.662 687 HZ2 LYS 104 1HZ LYS 104 6.367 20.779 10.750 688 HZ3 LYS 104 2HZ LYS 104 6.651 19.471 11.694 689 H ASN 105 H ASN 105 7.264 18.080 3.986 690 HA ASN 105 HA ASN 105 8.815 18.374 2.373 691 HB3 ASN 105 2HB ASN 105 11.276 18.731 3.222 692 HD21 ASN 105 2HD2 ASN 105 10.959 20.623 2.078 693 HD22 ASN 105 1HD2 ASN 105 10.067 21.984 2.747 694 H LYS 106 H LYS 106 7.958 15.714 2.851 695 HA LYS 106 HA LYS 106 10.099 14.157 1.557 696 HB3 LYS 106 2HB LYS 106 8.953 12.865 4.014 697 HG3 LYS 106 2HG LYS 106 11.471 12.444 4.341 698 HD3 LYS 106 2HD LYS 106 10.867 11.106 1.732 699 HE3 LYS 106 2HE LYS 106 11.908 10.486 4.459 700 HZ1 LYS 106 3HZ LYS 106 11.370 8.161 4.268 701 HZ2 LYS 106 1HZ LYS 106 9.994 9.028 4.383 702 HZ3 LYS 106 2HZ LYS 106 10.455 8.403 2.931 703 H ASP 107 H ASP 107 9.355 12.532 0.394 704 HA ASP 107 HA ASP 107 6.413 12.158 0.040 705 HB3 ASP 107 2HB ASP 107 8.664 12.997 -1.725 706 H TYR 108 H TYR 108 5.807 10.083 -0.742 707 HA TYR 108 HA TYR 108 7.698 7.837 -0.214 708 HB3 TYR 108 2HB TYR 108 4.995 7.264 0.754 709 HD1 TYR 108 1HD TYR 108 6.342 5.032 0.669 710 HD2 TYR 108 2HD TYR 108 7.221 8.305 3.345 711 HE1 TYR 108 1HE TYR 108 7.579 3.487 2.190 712 HE2 TYR 108 2HE TYR 108 8.456 6.738 4.847 713 HH TYR 108 HH TYR 108 9.172 4.574 5.176 714 H TYR 109 H TYR 109 7.305 6.024 -1.409 715 HA TYR 109 HA TYR 109 4.975 5.971 -3.230 716 HB3 TYR 109 2HB TYR 109 6.785 4.899 -4.897 717 HD1 TYR 109 1HD TYR 109 7.713 8.386 -4.080 718 HD2 TYR 109 2HD TYR 109 5.172 5.837 -6.455 719 HE1 TYR 109 1HE TYR 109 7.242 10.283 -5.622 720 HE2 TYR 109 2HE TYR 109 4.720 7.740 -8.004 721 HH TYR 109 HH TYR 109 5.137 9.953 -8.473 722 H ILE 110 H ILE 110 4.159 4.029 -3.634 723 HA ILE 110 HA ILE 110 5.334 1.573 -2.454 724 HB ILE 110 HB ILE 110 2.527 2.606 -1.917 725 HG13 ILE 110 2HG1 ILE 110 4.031 3.707 -0.426 726 HG21 ILE 110 1HG2 ILE 110 2.411 0.225 -2.277 727 HG22 ILE 110 2HG2 ILE 110 3.738 -0.058 -1.111 728 HG23 ILE 110 3HG2 ILE 110 2.153 0.548 -0.603 729 HD11 ILE 110 3HD1 ILE 110 3.373 3.117 1.708 730 HD12 ILE 110 1HD1 ILE 110 1.986 2.714 0.663 731 HD13 ILE 110 2HD1 ILE 110 3.066 1.425 1.289 732 H ILE 111 H ILE 111 4.552 -0.328 -3.484 733 HA ILE 111 HA ILE 111 2.895 -0.105 -5.918 734 HB ILE 111 HB ILE 111 5.070 0.425 -6.785 735 HG13 ILE 111 2HG1 ILE 111 3.718 -1.374 -7.956 736 HG21 ILE 111 1HG2 ILE 111 6.524 -0.072 -4.961 737 HG22 ILE 111 2HG2 ILE 111 6.128 -1.771 -4.981 738 HG23 ILE 111 3HG2 ILE 111 7.086 -1.067 -6.300 739 HD11 ILE 111 3HD1 ILE 111 5.535 -2.136 -9.507 740 HD12 ILE 111 1HD1 ILE 111 5.649 -0.404 -9.199 741 HD13 ILE 111 2HD1 ILE 111 6.749 -1.524 -8.399 742 H SER 112 H SER 112 2.021 -2.044 -6.613 743 HA SER 112 HA SER 112 2.384 -4.453 -4.877 744 HB3 SER 112 2HB SER 112 -0.203 -3.650 -6.215 745 HG SER 112 HG SER 112 -0.935 -5.029 -4.414 746 H THR 113 H THR 113 2.594 -6.365 -5.877 747 HA THR 113 HA THR 113 2.322 -6.514 -8.830 748 HB THR 113 HB THR 113 4.586 -7.700 -8.917 749 HG1 THR 113 1HG THR 113 5.964 -7.105 -7.174 750 HG21 THR 113 3HG2 THR 113 5.874 -5.670 -8.965 751 HG22 THR 113 1HG2 THR 113 4.286 -5.389 -9.705 752 HG23 THR 113 2HG2 THR 113 4.600 -4.799 -8.069 753 H SER 114 H SER 114 0.678 -7.644 -6.718 754 HA SER 114 HA SER 114 1.011 -10.410 -6.366 755 HB3 SER 114 2HB SER 114 -0.502 -9.100 -4.983 756 HG SER 114 HG SER 114 -2.364 -8.146 -5.963 757 H ASN 115 H ASN 115 -0.426 -8.778 -9.192 758 HA ASN 115 HA ASN 115 -1.671 -11.061 -10.352 759 HB3 ASN 115 2HB ASN 115 -0.408 -8.616 -11.702 760 HD21 ASN 115 2HD2 ASN 115 -3.579 -9.976 -12.419 761 HD22 ASN 115 1HD2 ASN 115 -3.162 -10.457 -14.060 762 H GLY 116 H GLY 116 1.724 -10.268 -10.046 763 HA2 GLY 116 2HA GLY 116 3.670 -11.323 -10.674 764 H SER 117 H SER 117 2.691 -10.067 -12.931 765 HA SER 117 HA SER 117 1.928 -11.363 -15.222 766 HB3 SER 117 2HB SER 117 2.830 -9.518 -16.443 767 HG SER 117 HG SER 117 2.244 -7.771 -15.102 768 H LEU 118 H LEU 118 2.964 -12.288 -17.050 769 HA LEU 118 HA LEU 118 5.054 -14.092 -16.529 770 HB3 LEU 118 2HB LEU 118 4.478 -13.092 -19.323 771 HG LEU 118 HG LEU 118 4.420 -15.378 -19.972 772 HD11 LEU 118 1HD1 LEU 118 6.697 -14.347 -19.732 773 HD12 LEU 118 2HD1 LEU 118 6.876 -15.264 -18.209 774 HD13 LEU 118 3HD1 LEU 118 6.622 -16.123 -19.733 775 HD21 LEU 118 3HD2 LEU 118 4.778 -17.270 -18.475 776 HD22 LEU 118 1HD2 LEU 118 4.917 -16.199 -17.075 777 HD23 LEU 118 2HD2 LEU 118 3.373 -16.334 -17.940 778 H GLU 119 H GLU 119 5.303 -10.827 -18.034 779 HA GLU 119 HA GLU 119 8.104 -10.878 -18.543 780 HB3 GLU 119 2HB GLU 119 7.948 -8.364 -18.396 781 HG3 GLU 119 2HG GLU 119 5.507 -9.172 -19.913 782 H GLY 120 H GLY 120 6.534 -10.837 -15.537 783 HA2 GLY 120 2HA GLY 120 9.061 -10.264 -14.047 784 H LEU 121 H LEU 121 7.874 -12.829 -14.962 785 HA LEU 121 HA LEU 121 6.740 -14.272 -12.852 786 HB3 LEU 121 2HB LEU 121 7.065 -15.093 -15.236 787 HG LEU 121 HG LEU 121 9.789 -15.866 -14.087 788 HD11 LEU 121 1HD1 LEU 121 8.655 -17.905 -14.779 789 HD12 LEU 121 2HD1 LEU 121 8.294 -17.179 -16.363 790 HD13 LEU 121 3HD1 LEU 121 9.981 -17.500 -15.884 791 HD21 LEU 121 3HD2 LEU 121 10.692 -15.182 -16.203 792 HD22 LEU 121 1HD2 LEU 121 9.070 -14.875 -16.861 793 HD23 LEU 121 2HD2 LEU 121 9.731 -13.834 -15.580 794 H ASP 122 H ASP 122 9.962 -13.128 -13.076 795 HA ASP 122 HA ASP 122 11.389 -14.661 -11.144 796 HB3 ASP 122 2HB ASP 122 12.832 -12.643 -11.044 797 H ASN 123 H ASN 123 8.622 -12.834 -10.691 798 HA ASN 123 HA ASN 123 7.469 -11.944 -9.032 799 HB3 ASN 123 2HB ASN 123 7.790 -12.428 -6.744 800 HD21 ASN 123 2HD2 ASN 123 10.229 -14.761 -7.285 801 HD22 ASN 123 1HD2 ASN 123 9.174 -16.149 -7.523 802 H GLN 124 H GLN 124 7.616 -10.086 -7.363 803 HA GLN 124 HA GLN 124 8.157 -7.906 -6.969 804 HB3 GLN 124 2HB GLN 124 10.570 -7.395 -6.642 805 HG3 GLN 124 2HG GLN 124 8.979 -9.112 -5.095 806 HE21 GLN 124 2HE2 GLN 124 9.135 -11.244 -4.271 807 HE22 GLN 124 1HE2 GLN 124 10.569 -12.233 -4.469 808 H GLU 125 H GLU 125 7.806 -8.741 -9.930 809 HA GLU 125 HA GLU 125 8.749 -6.204 -11.111 810 HB3 GLU 125 2HB GLU 125 9.670 -7.407 -13.089 811 HG3 GLU 125 2HG GLU 125 11.105 -8.323 -10.553 812 H GLY 126 H GLY 126 7.617 -5.669 -13.035 813 HA2 GLY 126 2HA GLY 126 5.891 -5.435 -14.479 814 H GLY 127 H GLY 127 4.531 -8.063 -12.533 815 HA2 GLY 127 2HA GLY 127 2.455 -8.329 -11.558 816 H VAL 128 H VAL 128 0.821 -6.403 -10.234 817 HA VAL 128 HA VAL 128 -1.025 -5.785 -12.353 818 HB VAL 128 HB VAL 128 -2.548 -5.272 -10.846 819 HG11 VAL 128 1HG1 VAL 128 -1.415 -7.340 -9.744 820 HG12 VAL 128 2HG1 VAL 128 -0.522 -6.188 -8.742 821 HG13 VAL 128 3HG1 VAL 128 -2.297 -6.304 -8.649 822 HG21 VAL 128 3HG2 VAL 128 -2.261 -3.981 -8.808 823 HG22 VAL 128 1HG2 VAL 128 -0.521 -3.787 -9.172 824 HG23 VAL 128 2HG2 VAL 128 -1.774 -3.099 -10.252 825 H CYS 129 H CYS 129 1.556 -3.892 -10.832 826 HA CYS 129 HA CYS 129 1.042 -1.322 -11.635 827 HB3 CYS 129 2HB CYS 129 3.626 -2.888 -11.593 828 H GLN 130 H GLN 130 2.203 -3.921 -13.781 829 HA GLN 130 HA GLN 130 2.936 -2.568 -16.065 830 HB3 GLN 130 2HB GLN 130 1.362 -5.162 -15.967 831 HG3 GLN 130 2HG GLN 130 3.669 -4.241 -17.749 832 HE21 GLN 130 2HE2 GLN 130 4.589 -5.893 -19.107 833 HE22 GLN 130 1HE2 GLN 130 4.065 -7.550 -19.001 834 H THR 131 H THR 131 -0.396 -2.994 -14.958 835 HA THR 131 HA THR 131 -1.382 -1.241 -17.139 836 HB THR 131 HB THR 131 -1.555 -3.262 -18.313 837 HG1 THR 131 1HG THR 131 -3.812 -3.476 -18.544 838 HG21 THR 131 3HG2 THR 131 -2.762 -5.247 -17.587 839 HG22 THR 131 1HG2 THR 131 -1.339 -4.931 -16.591 840 HG23 THR 131 2HG2 THR 131 -2.970 -4.565 -15.960 841 H ARG 132 H ARG 132 -2.466 -3.233 -14.351 842 HA ARG 132 HA ARG 132 -4.736 -1.572 -13.569 843 HB3 ARG 132 2HB ARG 132 -4.034 -2.653 -11.245 844 HG3 ARG 132 2HG ARG 132 -4.633 -5.028 -12.154 845 HD3 ARG 132 2HD ARG 132 -7.018 -3.371 -12.702 846 HE ARG 132 HE ARG 132 -6.943 -4.750 -10.183 847 HH11 ARG 132 1HH2 ARG 132 -7.042 -5.530 -13.602 848 HH12 ARG 132 2HH2 ARG 132 -7.607 -7.148 -13.311 849 HH21 ARG 132 1HH1 ARG 132 -7.666 -6.828 -9.883 850 HH22 ARG 132 2HH1 ARG 132 -7.967 -7.854 -11.252 851 H ALA 133 H ALA 133 -1.295 -1.232 -13.198 852 HA ALA 133 HA ALA 133 0.047 0.347 -12.298 853 HB1 ALA 133 3HB ALA 133 -0.612 2.652 -12.754 854 HB2 ALA 133 1HB ALA 133 -1.126 1.592 -14.064 855 HB3 ALA 133 2HB ALA 133 -2.312 2.180 -12.876 856 H MET 134 H MET 134 -1.120 -1.209 -10.198 857 HA MET 134 HA MET 134 -2.149 0.617 -8.159 858 HB3 MET 134 2HB MET 134 -1.076 -2.186 -7.784 859 HG3 MET 134 2HG MET 134 -2.510 -0.265 -6.021 860 HE1 MET 134 3HE MET 134 -5.827 -2.110 -6.083 861 HE2 MET 134 1HE MET 134 -4.997 -0.555 -5.819 862 HE3 MET 134 2HE MET 134 -4.817 -1.413 -7.369 863 H LYS 135 H LYS 135 -0.690 2.252 -8.007 864 HA LYS 135 HA LYS 135 1.440 1.633 -6.041 865 HB3 LYS 135 2HB LYS 135 2.796 3.539 -6.942 866 HG3 LYS 135 2HG LYS 135 2.749 0.960 -7.907 867 HD3 LYS 135 2HD LYS 135 1.426 2.044 -9.956 868 HE3 LYS 135 2HE LYS 135 4.369 2.707 -10.465 869 HZ1 LYS 135 3HZ LYS 135 3.607 3.419 -12.651 870 HZ2 LYS 135 1HZ LYS 135 3.371 1.811 -12.456 871 HZ3 LYS 135 2HZ LYS 135 2.095 2.853 -12.371 872 H ILE 136 H ILE 136 2.035 3.700 -4.897 873 HA ILE 136 HA ILE 136 -0.206 5.562 -4.675 874 HB ILE 136 HB ILE 136 -0.588 5.506 -2.450 875 HG13 ILE 136 2HG1 ILE 136 2.289 4.850 -1.950 876 HG21 ILE 136 1HG2 ILE 136 -1.225 3.300 -3.230 877 HG22 ILE 136 2HG2 ILE 136 0.353 2.648 -2.748 878 HG23 ILE 136 3HG2 ILE 136 -0.763 3.265 -1.530 879 HD11 ILE 136 3HD1 ILE 136 2.127 6.394 -0.138 880 HD12 ILE 136 1HD1 ILE 136 1.620 7.022 -1.708 881 HD13 ILE 136 2HD1 ILE 136 0.392 6.652 -0.456 882 H LEU 137 H LEU 137 0.374 7.651 -4.230 883 HA LEU 137 HA LEU 137 3.270 8.325 -4.115 884 HB3 LEU 137 2HB LEU 137 1.329 8.909 -6.258 885 HG LEU 137 HG LEU 137 1.199 11.171 -5.302 886 HD11 LEU 137 1HD1 LEU 137 3.469 11.354 -4.192 887 HD12 LEU 137 2HD1 LEU 137 4.203 11.348 -5.795 888 HD13 LEU 137 3HD1 LEU 137 3.125 12.677 -5.321 889 HD21 LEU 137 3HD2 LEU 137 1.746 12.340 -7.326 890 HD22 LEU 137 1HD2 LEU 137 2.902 11.088 -7.813 891 HD23 LEU 137 2HD2 LEU 137 1.171 10.731 -7.755 892 H MET 138 H MET 138 3.627 9.343 -2.264 893 HA MET 138 HA MET 138 1.411 10.760 -0.837 894 HB3 MET 138 2HB MET 138 3.874 10.893 0.596 895 HG3 MET 138 2HG MET 138 1.689 8.834 0.968 896 HE1 MET 138 3HE MET 138 2.575 7.505 4.341 897 HE2 MET 138 1HE MET 138 1.129 8.157 3.533 898 HE3 MET 138 2HE MET 138 2.230 7.068 2.653 899 H LYS 139 H LYS 139 1.214 12.895 -1.216 900 HA LYS 139 HA LYS 139 3.038 14.550 -2.576 901 HB3 LYS 139 2HB LYS 139 1.418 15.870 -0.398 902 HG3 LYS 139 2HG LYS 139 2.585 16.996 -2.408 903 HD3 LYS 139 2HD LYS 139 0.098 16.467 -4.009 904 HE3 LYS 139 2HE LYS 139 1.700 16.374 -5.913 905 HZ1 LYS 139 3HZ LYS 139 2.470 18.640 -5.793 906 HZ2 LYS 139 1HZ LYS 139 0.963 18.572 -5.173 907 HZ3 LYS 139 2HZ LYS 139 2.254 18.716 -4.181 908 H VAL 140 H VAL 140 4.652 16.071 -1.929 909 HA VAL 140 HA VAL 140 6.470 15.338 0.120 910 HB VAL 140 HB VAL 140 6.083 17.911 -1.429 911 HG11 VAL 140 1HG1 VAL 140 7.397 18.499 0.587 912 HG12 VAL 140 2HG1 VAL 140 8.474 17.110 0.282 913 HG13 VAL 140 3HG1 VAL 140 8.429 18.483 -0.841 914 HG21 VAL 140 3HG2 VAL 140 8.029 17.078 -2.716 915 HG22 VAL 140 1HG2 VAL 140 8.085 15.629 -1.686 916 HG23 VAL 140 2HG2 VAL 140 6.708 15.906 -2.776 917 H GLY 141 H GLY 141 3.745 17.521 0.294 918 HA2 GLY 141 2HA GLY 141 2.672 17.209 2.619 919 H GLN 142 H GLN 142 4.725 19.990 1.645 920 HA GLN 142 HA GLN 142 2.434 21.701 0.997 921 HB3 GLN 142 2HB GLN 142 4.301 22.900 3.050 922 HG3 GLN 142 2HG GLN 142 2.044 23.810 3.845 923 HE21 GLN 142 2HE2 GLN 142 0.567 25.170 1.659 924 HE22 GLN 142 1HE2 GLN 142 1.707 26.346 1.026 Start of MODEL 9 1 H1 SER 1 H SER 1 -15.065 14.817 17.508 2 HA SER 1 HA SER 1 -15.961 14.959 14.814 3 HB3 SER 1 2HB SER 1 -15.104 17.216 14.178 4 HG SER 1 HG SER 1 -17.060 18.170 14.769 5 H LYS 2 H LYS 2 -14.440 13.926 13.737 6 HA LYS 2 HA LYS 2 -11.574 13.957 14.519 7 HB3 LYS 2 2HB LYS 2 -12.299 12.608 11.999 8 HG3 LYS 2 2HG LYS 2 -10.257 12.250 13.622 9 HD3 LYS 2 2HD LYS 2 -11.409 9.884 14.761 10 HE3 LYS 2 2HE LYS 2 -10.664 12.333 16.395 11 HZ1 LYS 2 3HZ LYS 2 -9.770 10.616 17.845 12 HZ2 LYS 2 1HZ LYS 2 -11.323 10.235 17.524 13 HZ3 LYS 2 2HZ LYS 2 -10.114 9.433 16.778 14 H SER 3 H SER 3 -10.188 13.943 12.236 15 HA SER 3 HA SER 3 -10.294 16.712 11.332 16 HB3 SER 3 2HB SER 3 -8.448 14.702 10.069 17 HG SER 3 HG SER 3 -7.055 16.577 10.558 18 H ILE 4 H ILE 4 -10.338 13.648 9.411 19 HA ILE 4 HA ILE 4 -12.272 14.807 7.487 20 HB ILE 4 HB ILE 4 -10.147 13.591 5.957 21 HG13 ILE 4 2HG1 ILE 4 -8.308 14.832 6.091 22 HG21 ILE 4 1HG2 ILE 4 -11.931 14.959 5.059 23 HG22 ILE 4 2HG2 ILE 4 -11.333 16.377 5.933 24 HG23 ILE 4 3HG2 ILE 4 -10.356 15.648 4.644 25 HD11 ILE 4 3HD1 ILE 4 -7.789 16.711 7.504 26 HD12 ILE 4 1HD1 ILE 4 -8.953 17.112 6.229 27 HD13 ILE 4 2HD1 ILE 4 -9.504 16.908 7.908 28 H VAL 5 H VAL 5 -10.159 11.959 8.094 29 HA VAL 5 HA VAL 5 -10.499 9.732 8.078 30 HB VAL 5 HB VAL 5 -13.348 10.533 8.682 31 HG11 VAL 5 1HG1 VAL 5 -13.605 8.323 7.836 32 HG12 VAL 5 2HG1 VAL 5 -12.124 7.750 8.614 33 HG13 VAL 5 3HG1 VAL 5 -13.557 8.176 9.588 34 HG21 VAL 5 3HG2 VAL 5 -12.680 9.904 10.964 35 HG22 VAL 5 1HG2 VAL 5 -11.057 9.469 10.398 36 HG23 VAL 5 2HG2 VAL 5 -11.604 11.148 10.331 37 H LEU 6 H LEU 6 -9.730 9.288 6.105 38 HA LEU 6 HA LEU 6 -11.275 9.031 3.698 39 HB3 LEU 6 2HB LEU 6 -9.161 7.063 3.808 40 HG LEU 6 HG LEU 6 -9.998 8.560 1.879 41 HD11 LEU 6 1HD1 LEU 6 -9.743 10.748 3.117 42 HD12 LEU 6 2HD1 LEU 6 -7.992 10.486 3.120 43 HD13 LEU 6 3HD1 LEU 6 -8.850 10.710 1.584 44 HD21 LEU 6 3HD2 LEU 6 -7.758 8.636 0.832 45 HD22 LEU 6 1HD2 LEU 6 -7.023 8.328 2.422 46 HD23 LEU 6 2HD2 LEU 6 -8.053 7.098 1.661 47 H GLU 7 H GLU 7 -11.589 6.925 2.570 48 HA GLU 7 HA GLU 7 -13.408 5.302 4.177 49 HB3 GLU 7 2HB GLU 7 -13.888 4.200 1.983 50 HG3 GLU 7 2HG GLU 7 -14.889 6.505 2.862 51 HA PRO 8 HA PRO 8 -10.531 1.913 4.750 52 HB3 PRO 8 2HB PRO 8 -11.890 1.181 6.464 53 HG3 PRO 8 2HG PRO 8 -14.226 1.398 6.355 54 HD3 PRO 8 2HD PRO 8 -13.665 3.571 5.708 55 H ILE 9 H ILE 9 -9.711 0.225 3.616 56 HA ILE 9 HA ILE 9 -10.431 0.013 0.790 57 HB ILE 9 HB ILE 9 -8.448 -1.691 2.275 58 HG13 ILE 9 2HG1 ILE 9 -6.646 -0.078 1.819 59 HG21 ILE 9 1HG2 ILE 9 -8.875 -2.477 0.065 60 HG22 ILE 9 2HG2 ILE 9 -8.552 -0.875 -0.633 61 HG23 ILE 9 3HG2 ILE 9 -7.249 -1.796 0.126 62 HD11 ILE 9 3HD1 ILE 9 -7.190 2.292 1.290 63 HD12 ILE 9 1HD1 ILE 9 -7.398 1.153 -0.040 64 HD13 ILE 9 2HD1 ILE 9 -8.828 1.779 0.819 65 H TYR 10 H TYR 10 -12.033 -1.275 0.109 66 HA TYR 10 HA TYR 10 -12.968 -3.502 1.795 67 HB3 TYR 10 2HB TYR 10 -14.333 -2.602 -0.736 68 HD1 TYR 10 1HD TYR 10 -15.324 -5.052 -0.357 69 HD2 TYR 10 2HD TYR 10 -15.749 -1.837 2.496 70 HE1 TYR 10 1HE TYR 10 -17.219 -6.251 0.721 71 HE2 TYR 10 2HE TYR 10 -17.660 -3.028 3.549 72 HH TYR 10 HH TYR 10 -18.994 -4.913 3.530 73 H TRP 11 H TRP 11 -10.689 -4.415 1.070 74 HA TRP 11 HA TRP 11 -9.331 -5.838 -0.034 75 HB3 TRP 11 2HB TRP 11 -11.883 -6.859 -1.327 76 HD1 TRP 11 HD TRP 11 -8.191 -7.541 -1.482 77 HE1 TRP 11 1HE TRP 11 -7.793 -9.792 -2.645 78 HE3 TRP 11 3HE TRP 11 -13.027 -9.214 -1.678 79 HZ2 TRP 11 2HZ TRP 11 -9.389 -12.049 -3.563 80 HZ3 TRP 11 3HZ TRP 11 -13.569 -11.398 -2.731 81 HH2 TRP 11 HH TRP 11 -11.760 -12.831 -3.646 82 H ASN 12 H ASN 12 -11.703 -5.100 -2.532 83 HA ASN 12 HA ASN 12 -10.416 -3.216 -4.130 84 HB3 ASN 12 2HB ASN 12 -10.049 -5.131 -6.093 85 HD21 ASN 12 2HD2 ASN 12 -7.377 -6.180 -5.208 86 HD22 ASN 12 1HD2 ASN 12 -6.355 -4.762 -5.343 87 H SER 13 H SER 13 -11.453 -3.268 -6.420 88 HA SER 13 HA SER 13 -13.236 -3.286 -7.803 89 HB3 SER 13 2HB SER 13 -14.946 -4.991 -5.998 90 HG SER 13 HG SER 13 -15.439 -5.828 -8.150 91 H SER 14 H SER 14 -14.583 -1.660 -8.067 92 HA SER 14 HA SER 14 -15.445 0.384 -7.653 93 HB3 SER 14 2HB SER 14 -17.367 -1.067 -7.760 94 HG SER 14 HG SER 14 -18.507 -1.519 -5.800 95 H ASN 15 H ASN 15 -13.306 -0.088 -5.766 96 HA ASN 15 HA ASN 15 -14.128 1.336 -3.283 97 HB3 ASN 15 2HB ASN 15 -11.636 -0.292 -3.973 98 HD21 ASN 15 2HD2 ASN 15 -10.037 -0.145 -2.467 99 HD22 ASN 15 1HD2 ASN 15 -10.270 0.658 -0.910 100 H SER 16 H SER 16 -12.638 3.037 -2.389 101 HA SER 16 HA SER 16 -11.918 5.031 -4.336 102 HB3 SER 16 2HB SER 16 -10.950 6.237 -2.368 103 HG SER 16 HG SER 16 -13.080 6.432 -1.452 104 H LYS 17 H LYS 17 -9.930 2.618 -2.673 105 HA LYS 17 HA LYS 17 -7.393 3.549 -3.877 106 HB3 LYS 17 2HB LYS 17 -8.244 1.225 -2.152 107 HG3 LYS 17 2HG LYS 17 -5.726 1.147 -1.571 108 HD3 LYS 17 2HD LYS 17 -6.334 -0.419 -4.070 109 HE3 LYS 17 2HE LYS 17 -5.472 -1.749 -1.576 110 HZ1 LYS 17 3HZ LYS 17 -3.774 -2.593 -3.081 111 HZ2 LYS 17 1HZ LYS 17 -5.229 -2.675 -3.835 112 HZ3 LYS 17 2HZ LYS 17 -4.162 -1.484 -4.221 113 H PHE 18 H PHE 18 -9.991 1.743 -5.087 114 HA PHE 18 HA PHE 18 -8.670 -0.368 -6.535 115 HB3 PHE 18 2HB PHE 18 -11.321 1.002 -7.095 116 HD1 PHE 18 2HD PHE 18 -9.606 -2.366 -7.282 117 HD2 PHE 18 1HD PHE 18 -12.224 0.510 -9.172 118 HE1 PHE 18 2HE PHE 18 -10.004 -3.950 -9.154 119 HE2 PHE 18 1HE PHE 18 -12.605 -1.079 -11.045 120 HZ PHE 18 HZ PHE 18 -11.516 -3.317 -11.025 121 H LEU 19 H LEU 19 -6.978 0.339 -7.584 122 HA LEU 19 HA LEU 19 -6.148 2.564 -8.519 123 HB3 LEU 19 2HB LEU 19 -4.724 0.732 -8.434 124 HG LEU 19 HG LEU 19 -6.578 -0.651 -10.297 125 HD11 LEU 19 1HD1 LEU 19 -4.740 -0.194 -11.832 126 HD12 LEU 19 2HD1 LEU 19 -3.547 -0.727 -10.629 127 HD13 LEU 19 3HD1 LEU 19 -4.675 -1.904 -11.336 128 HD21 LEU 19 3HD2 LEU 19 -5.562 -2.621 -9.212 129 HD22 LEU 19 1HD2 LEU 19 -4.335 -1.592 -8.457 130 HD23 LEU 19 2HD2 LEU 19 -6.034 -1.453 -7.969 131 HA PRO 20 HA PRO 20 -9.213 3.427 -11.727 132 HB3 PRO 20 2HB PRO 20 -10.120 4.999 -10.315 133 HG3 PRO 20 2HG PRO 20 -8.813 6.180 -8.797 134 HD3 PRO 20 2HD PRO 20 -7.838 4.149 -8.349 135 H GLY 21 H GLY 21 -5.975 3.831 -11.865 136 HA2 GLY 21 2HA GLY 21 -5.173 3.873 -14.312 137 H GLN 22 H GLN 22 -4.762 5.448 -11.315 138 HA GLN 22 HA GLN 22 -1.786 5.553 -11.609 139 HB3 GLN 22 2HB GLN 22 -3.759 7.652 -10.755 140 HG3 GLN 22 2HG GLN 22 -0.930 7.570 -9.642 141 HE21 GLN 22 2HE2 GLN 22 -4.049 9.395 -9.247 142 HE22 GLN 22 1HE2 GLN 22 -3.272 10.969 -9.214 143 H GLY 23 H GLY 23 -4.421 4.321 -9.720 144 HA2 GLY 23 2HA GLY 23 -3.925 2.583 -8.077 145 H LEU 24 H LEU 24 -2.621 4.599 -5.781 146 HA LEU 24 HA LEU 24 -5.249 5.742 -4.940 147 HB3 LEU 24 2HB LEU 24 -3.395 3.999 -3.290 148 HG LEU 24 HG LEU 24 -4.083 6.008 -1.966 149 HD11 LEU 24 1HD1 LEU 24 -6.381 6.323 -2.985 150 HD12 LEU 24 2HD1 LEU 24 -6.906 4.881 -2.096 151 HD13 LEU 24 3HD1 LEU 24 -6.331 6.305 -1.216 152 HD21 LEU 24 3HD2 LEU 24 -4.913 4.703 -0.033 153 HD22 LEU 24 1HD2 LEU 24 -5.217 3.333 -1.096 154 HD23 LEU 24 2HD2 LEU 24 -3.565 3.903 -0.850 155 H VAL 25 H VAL 25 -5.117 7.693 -3.890 156 HA VAL 25 HA VAL 25 -2.445 9.061 -3.735 157 HB VAL 25 HB VAL 25 -5.130 10.172 -4.651 158 HG11 VAL 25 1HG1 VAL 25 -4.076 11.866 -3.233 159 HG12 VAL 25 2HG1 VAL 25 -2.511 11.619 -4.046 160 HG13 VAL 25 3HG1 VAL 25 -3.887 12.331 -4.921 161 HG21 VAL 25 3HG2 VAL 25 -3.832 10.747 -6.690 162 HG22 VAL 25 1HG2 VAL 25 -2.397 9.953 -6.002 163 HG23 VAL 25 2HG2 VAL 25 -3.836 9.000 -6.414 164 H LEU 26 H LEU 26 -1.962 9.640 -1.768 165 HA LEU 26 HA LEU 26 -4.143 10.043 0.237 166 HB3 LEU 26 2HB LEU 26 -2.038 9.983 1.802 167 HG LEU 26 HG LEU 26 -2.191 7.684 2.302 168 HD11 LEU 26 1HD1 LEU 26 -4.291 9.032 2.733 169 HD12 LEU 26 2HD1 LEU 26 -4.953 8.397 1.214 170 HD13 LEU 26 3HD1 LEU 26 -4.560 7.289 2.513 171 HD21 LEU 26 3HD2 LEU 26 -3.152 6.008 0.890 172 HD22 LEU 26 1HD2 LEU 26 -3.675 7.231 -0.291 173 HD23 LEU 26 2HD2 LEU 26 -1.958 6.885 -0.083 174 H TYR 27 H TYR 27 -4.150 11.744 1.498 175 HA TYR 27 HA TYR 27 -3.049 14.224 0.343 176 HB3 TYR 27 2HB TYR 27 -4.850 15.228 1.888 177 HD1 TYR 27 1HD TYR 27 -4.762 16.118 -0.516 178 HD2 TYR 27 2HD TYR 27 -6.822 12.485 0.587 179 HE1 TYR 27 1HE TYR 27 -6.157 16.279 -2.577 180 HE2 TYR 27 2HE TYR 27 -8.216 12.653 -1.470 181 HH TYR 27 HH TYR 27 -8.679 13.866 -3.375 182 HA PRO 28 HA PRO 28 -0.375 14.639 3.995 183 HB3 PRO 28 2HB PRO 28 1.019 15.769 2.550 184 HG3 PRO 28 2HG PRO 28 0.210 17.204 0.879 185 HD3 PRO 28 2HD PRO 28 -1.111 15.326 0.430 186 H GLN 29 H GLN 29 -2.723 14.515 4.969 187 HA GLN 29 HA GLN 29 -3.475 17.074 6.315 188 HB3 GLN 29 2HB GLN 29 -4.943 16.455 4.452 189 HG3 GLN 29 2HG GLN 29 -5.932 14.179 6.149 190 HE21 GLN 29 2HE2 GLN 29 -6.851 12.357 4.377 191 HE22 GLN 29 1HE2 GLN 29 -7.977 13.126 3.273 192 H ILE 30 H ILE 30 -2.568 16.909 8.251 193 HA ILE 30 HA ILE 30 -2.287 14.498 9.750 194 HB ILE 30 HB ILE 30 -1.965 17.415 10.468 195 HG13 ILE 30 2HG1 ILE 30 0.408 16.911 10.400 196 HG21 ILE 30 1HG2 ILE 30 -2.499 16.326 12.560 197 HG22 ILE 30 2HG2 ILE 30 -1.393 14.989 12.187 198 HG23 ILE 30 3HG2 ILE 30 -0.751 16.609 12.510 199 HD11 ILE 30 3HD1 ILE 30 1.369 14.893 9.486 200 HD12 ILE 30 1HD1 ILE 30 0.535 14.511 10.993 201 HD13 ILE 30 2HD1 ILE 30 -0.190 14.080 9.426 202 H GLY 31 H GLY 31 -3.617 13.382 10.883 203 HA2 GLY 31 2HA GLY 31 -5.240 13.167 12.642 204 H ASP 32 H ASP 32 -5.525 13.104 9.242 205 HA ASP 32 HA ASP 32 -7.992 11.543 9.001 206 HB3 ASP 32 2HB ASP 32 -5.638 12.129 7.182 207 H LYS 33 H LYS 33 -7.951 9.294 8.207 208 HA LYS 33 HA LYS 33 -5.713 7.606 8.892 209 HB3 LYS 33 2HB LYS 33 -6.464 7.674 11.103 210 HG3 LYS 33 2HG LYS 33 -8.714 8.560 10.924 211 HD3 LYS 33 2HD LYS 33 -9.326 5.892 9.640 212 HE3 LYS 33 2HE LYS 33 -11.776 6.307 10.314 213 HZ1 LYS 33 3HZ LYS 33 -11.479 4.989 12.329 214 HZ2 LYS 33 1HZ LYS 33 -10.500 4.431 11.150 215 HZ3 LYS 33 2HZ LYS 33 -9.880 5.319 12.374 216 H LEU 34 H LEU 34 -5.872 5.496 8.191 217 HA LEU 34 HA LEU 34 -8.063 4.852 6.300 218 HB3 LEU 34 2HB LEU 34 -6.911 5.277 4.479 219 HG LEU 34 HG LEU 34 -4.589 5.756 4.146 220 HD11 LEU 34 1HD1 LEU 34 -6.201 7.609 4.572 221 HD12 LEU 34 2HD1 LEU 34 -5.591 7.714 6.237 222 HD13 LEU 34 3HD1 LEU 34 -4.503 7.976 4.895 223 HD21 LEU 34 3HD2 LEU 34 -2.999 6.293 5.826 224 HD22 LEU 34 1HD2 LEU 34 -4.091 5.852 7.129 225 HD23 LEU 34 2HD2 LEU 34 -3.505 4.611 6.006 226 H ASP 35 H ASP 35 -8.568 2.838 6.298 227 HA ASP 35 HA ASP 35 -7.080 0.840 7.938 228 HB3 ASP 35 2HB ASP 35 -9.943 0.290 7.673 229 H ILE 36 H ILE 36 -6.065 -0.481 6.471 230 HA ILE 36 HA ILE 36 -7.511 -1.223 4.001 231 HB ILE 36 HB ILE 36 -5.196 -0.564 3.734 232 HG13 ILE 36 2HG1 ILE 36 -6.403 -2.391 2.290 233 HG21 ILE 36 1HG2 ILE 36 -4.460 -1.536 5.951 234 HG22 ILE 36 2HG2 ILE 36 -4.378 -3.113 5.172 235 HG23 ILE 36 3HG2 ILE 36 -3.347 -1.760 4.617 236 HD11 ILE 36 3HD1 ILE 36 -4.360 -2.774 0.975 237 HD12 ILE 36 1HD1 ILE 36 -4.573 -1.071 1.452 238 HD13 ILE 36 2HD1 ILE 36 -3.407 -2.074 2.311 239 H ILE 37 H ILE 37 -8.648 -2.998 3.837 240 HA ILE 37 HA ILE 37 -8.260 -5.267 5.734 241 HB ILE 37 HB ILE 37 -10.764 -3.715 5.011 242 HG13 ILE 37 2HG1 ILE 37 -9.234 -3.455 7.180 243 HG21 ILE 37 1HG2 ILE 37 -11.401 -6.001 4.487 244 HG22 ILE 37 2HG2 ILE 37 -10.646 -6.606 5.984 245 HG23 ILE 37 3HG2 ILE 37 -12.098 -5.586 6.049 246 HD11 ILE 37 3HD1 ILE 37 -11.145 -2.921 8.577 247 HD12 ILE 37 1HD1 ILE 37 -11.349 -2.268 6.942 248 HD13 ILE 37 2HD1 ILE 37 -12.252 -3.718 7.441 249 H CYS 38 H CYS 38 -8.036 -7.143 4.657 250 HA CYS 38 HA CYS 38 -9.568 -7.484 2.193 251 HB3 CYS 38 2HB CYS 38 -7.091 -6.756 1.680 252 HA PRO 39 HA PRO 39 -10.134 -11.452 4.336 253 HB3 PRO 39 2HB PRO 39 -12.326 -11.413 3.618 254 HG3 PRO 39 2HG PRO 39 -12.948 -10.338 1.666 255 HD3 PRO 39 2HD PRO 39 -11.508 -8.635 2.250 256 H LYS 40 H LYS 40 -9.292 -13.529 4.051 257 HA LYS 40 HA LYS 40 -7.026 -13.869 2.272 258 HB3 LYS 40 2HB LYS 40 -7.165 -14.973 4.493 259 HG3 LYS 40 2HG LYS 40 -9.328 -16.649 3.140 260 HD3 LYS 40 2HD LYS 40 -7.813 -17.277 5.702 261 HE3 LYS 40 2HE LYS 40 -8.967 -19.525 5.311 262 HZ1 LYS 40 3HZ LYS 40 -11.074 -18.801 6.264 263 HZ2 LYS 40 1HZ LYS 40 -9.847 -18.019 6.993 264 HZ3 LYS 40 2HZ LYS 40 -10.782 -17.239 5.896 265 H VAL 41 H VAL 41 -6.829 -15.843 0.979 266 HA VAL 41 HA VAL 41 -9.141 -16.306 -0.850 267 HB VAL 41 HB VAL 41 -7.678 -15.193 -2.211 268 HG11 VAL 41 1HG1 VAL 41 -5.734 -14.929 -0.859 269 HG12 VAL 41 2HG1 VAL 41 -5.340 -16.667 -0.954 270 HG13 VAL 41 3HG1 VAL 41 -5.226 -15.628 -2.390 271 HG21 VAL 41 3HG2 VAL 41 -6.830 -16.738 -3.837 272 HG22 VAL 41 1HG2 VAL 41 -6.713 -18.036 -2.637 273 HG23 VAL 41 2HG2 VAL 41 -8.306 -17.444 -3.155 274 H ASP 42 H ASP 42 -10.047 -18.066 -0.298 275 HA ASP 42 HA ASP 42 -9.049 -20.619 -0.845 276 HB3 ASP 42 2HB ASP 42 -9.536 -21.463 1.681 277 H SER 43 H SER 43 -11.220 -19.867 1.884 278 HA SER 43 HA SER 43 -13.428 -21.344 0.757 279 HB3 SER 43 2HB SER 43 -13.139 -19.527 3.175 280 HG SER 43 HG SER 43 -15.113 -20.430 3.842 281 H LYS 44 H LYS 44 -12.905 -17.810 1.251 282 HA LYS 44 HA LYS 44 -15.401 -16.934 0.151 283 HB3 LYS 44 2HB LYS 44 -12.689 -15.578 0.500 284 HG3 LYS 44 2HG LYS 44 -13.859 -14.344 -1.283 285 HD3 LYS 44 2HD LYS 44 -15.993 -13.625 0.745 286 HE3 LYS 44 2HE LYS 44 -15.261 -12.480 -1.627 287 HZ1 LYS 44 3HZ LYS 44 -16.937 -13.085 -3.245 288 HZ2 LYS 44 1HZ LYS 44 -16.102 -14.446 -2.887 289 HZ3 LYS 44 2HZ LYS 44 -17.594 -14.208 -2.269 290 H THR 45 H THR 45 -12.178 -17.083 -1.380 291 HA THR 45 HA THR 45 -13.127 -16.224 -3.949 292 HB THR 45 HB THR 45 -10.539 -17.704 -3.365 293 HG1 THR 45 1HG THR 45 -9.840 -15.378 -3.162 294 HG21 THR 45 3HG2 THR 45 -9.576 -16.281 -5.115 295 HG22 THR 45 1HG2 THR 45 -10.915 -17.225 -5.760 296 HG23 THR 45 2HG2 THR 45 -11.154 -15.504 -5.388 297 H VAL 46 H VAL 46 -12.485 -19.430 -2.588 298 HA VAL 46 HA VAL 46 -12.665 -21.509 -3.242 299 HB VAL 46 HB VAL 46 -15.068 -20.351 -3.706 300 HG11 VAL 46 1HG1 VAL 46 -14.776 -20.300 -6.166 301 HG12 VAL 46 2HG1 VAL 46 -14.744 -22.086 -6.161 302 HG13 VAL 46 3HG1 VAL 46 -16.171 -21.208 -5.558 303 HG21 VAL 46 3HG2 VAL 46 -15.981 -22.626 -3.530 304 HG22 VAL 46 1HG2 VAL 46 -14.411 -23.312 -3.950 305 HG23 VAL 46 2HG2 VAL 46 -14.616 -22.419 -2.439 306 H GLY 47 H GLY 47 -11.373 -19.475 -5.463 307 HA2 GLY 47 2HA GLY 47 -10.740 -21.548 -7.514 308 H GLN 48 H GLN 48 -9.098 -19.726 -4.957 309 HA GLN 48 HA GLN 48 -6.891 -19.325 -4.442 310 HB3 GLN 48 2HB GLN 48 -5.503 -21.490 -4.577 311 HG3 GLN 48 2HG GLN 48 -8.036 -20.976 -3.053 312 HE21 GLN 48 2HE2 GLN 48 -9.418 -22.789 -3.094 313 HE22 GLN 48 1HE2 GLN 48 -8.861 -24.403 -2.674 314 H TYR 49 H TYR 49 -6.922 -17.716 -6.252 315 HA TYR 49 HA TYR 49 -5.344 -18.232 -8.612 316 HB3 TYR 49 2HB TYR 49 -5.987 -15.525 -7.364 317 HD1 TYR 49 2HD TYR 49 -3.762 -14.805 -8.529 318 HD2 TYR 49 1HD TYR 49 -7.138 -16.465 -10.652 319 HE1 TYR 49 2HE TYR 49 -2.832 -13.953 -10.671 320 HE2 TYR 49 1HE TYR 49 -6.228 -15.564 -12.789 321 HH TYR 49 HH TYR 49 -3.116 -13.808 -12.952 322 H GLU 50 H GLU 50 -4.539 -15.948 -5.986 323 HA GLU 50 HA GLU 50 -2.046 -16.893 -5.136 324 HB3 GLU 50 2HB GLU 50 -1.356 -14.463 -6.704 325 HG3 GLU 50 2HG GLU 50 0.121 -16.350 -5.414 326 H TYR 51 H TYR 51 -0.772 -14.684 -4.308 327 HA TYR 51 HA TYR 51 -2.757 -12.977 -2.856 328 HB3 TYR 51 2HB TYR 51 -1.583 -14.191 -1.267 329 HD1 TYR 51 1HD TYR 51 1.366 -12.583 -3.040 330 HD2 TYR 51 2HD TYR 51 -0.300 -16.129 -1.224 331 HE1 TYR 51 1HE TYR 51 3.519 -13.783 -3.393 332 HE2 TYR 51 2HE TYR 51 1.861 -17.312 -1.556 333 HH TYR 51 HH TYR 51 4.030 -17.159 -2.311 334 H TYR 52 H TYR 52 -1.694 -10.756 -2.211 335 HA TYR 52 HA TYR 52 0.291 -9.803 -4.164 336 HB3 TYR 52 2HB TYR 52 -2.011 -9.148 -5.062 337 HD1 TYR 52 2HD TYR 52 -0.875 -6.214 -3.041 338 HD2 TYR 52 1HD TYR 52 -4.142 -8.906 -3.892 339 HE1 TYR 52 2HE TYR 52 -2.410 -4.782 -1.705 340 HE2 TYR 52 1HE TYR 52 -5.685 -7.409 -2.618 341 HH TYR 52 HH TYR 52 -4.532 -4.529 -0.847 342 H LYS 53 H LYS 53 1.678 -8.238 -3.374 343 HA LYS 53 HA LYS 53 1.201 -7.212 -0.621 344 HB3 LYS 53 2HB LYS 53 3.537 -7.583 -0.027 345 HG3 LYS 53 2HG LYS 53 1.697 -9.626 0.107 346 HD3 LYS 53 2HD LYS 53 4.137 -10.601 -1.434 347 HE3 LYS 53 2HE LYS 53 2.301 -12.693 -0.528 348 HZ1 LYS 53 3HZ LYS 53 4.391 -13.640 0.273 349 HZ2 LYS 53 1HZ LYS 53 4.650 -13.036 -1.215 350 HZ3 LYS 53 2HZ LYS 53 5.176 -12.221 0.098 351 H VAL 54 H VAL 54 1.591 -5.166 -0.424 352 HA VAL 54 HA VAL 54 2.562 -3.582 -2.764 353 HB VAL 54 HB VAL 54 1.299 -2.369 -0.292 354 HG11 VAL 54 1HG1 VAL 54 2.464 -0.978 -1.945 355 HG12 VAL 54 2HG1 VAL 54 1.385 -1.550 -3.219 356 HG13 VAL 54 3HG1 VAL 54 0.740 -0.586 -1.873 357 HG21 VAL 54 3HG2 VAL 54 -0.886 -2.345 -1.420 358 HG22 VAL 54 1HG2 VAL 54 -0.239 -3.362 -2.730 359 HG23 VAL 54 2HG2 VAL 54 -0.377 -3.999 -1.081 360 H TYR 55 H TYR 55 4.428 -2.428 -2.600 361 HA TYR 55 HA TYR 55 5.955 -2.317 -0.012 362 HB3 TYR 55 2HB TYR 55 7.980 -2.704 -1.571 363 HD1 TYR 55 1HD TYR 55 5.565 -5.440 -2.325 364 HD2 TYR 55 2HD TYR 55 8.786 -4.053 0.183 365 HE1 TYR 55 1HE TYR 55 6.008 -7.781 -1.576 366 HE2 TYR 55 2HE TYR 55 9.216 -6.386 0.932 367 HH TYR 55 HH TYR 55 8.573 -8.611 0.759 368 H MET 56 H MET 56 6.939 -0.451 0.384 369 HA MET 56 HA MET 56 6.687 1.881 -1.270 370 HB3 MET 56 2HB MET 56 6.962 1.851 1.206 371 HG3 MET 56 2HG MET 56 9.937 1.648 0.707 372 HE1 MET 56 3HE MET 56 11.090 1.107 4.351 373 HE2 MET 56 1HE MET 56 10.944 0.034 2.941 374 HE3 MET 56 2HE MET 56 11.580 1.684 2.743 375 H VAL 57 H VAL 57 8.237 2.846 -2.665 376 HA VAL 57 HA VAL 57 10.898 1.708 -3.121 377 HB VAL 57 HB VAL 57 10.373 1.792 -5.696 378 HG11 VAL 57 1HG1 VAL 57 11.225 -0.195 -4.712 379 HG12 VAL 57 2HG1 VAL 57 9.620 -0.585 -4.036 380 HG13 VAL 57 3HG1 VAL 57 9.886 -0.618 -5.788 381 HG21 VAL 57 3HG2 VAL 57 8.291 1.020 -6.466 382 HG22 VAL 57 1HG2 VAL 57 7.648 0.862 -4.814 383 HG23 VAL 57 2HG2 VAL 57 7.974 2.469 -5.509 384 H ASP 58 H ASP 58 12.236 3.222 -4.401 385 HA ASP 58 HA ASP 58 11.451 5.997 -4.241 386 HB3 ASP 58 2HB ASP 58 13.513 6.384 -5.559 387 H LYS 59 H LYS 59 11.304 7.506 -6.147 388 HA LYS 59 HA LYS 59 9.513 6.904 -8.240 389 HB3 LYS 59 2HB LYS 59 11.815 8.885 -8.234 390 HG3 LYS 59 2HG LYS 59 9.233 9.518 -9.630 391 HD3 LYS 59 2HD LYS 59 12.201 9.932 -10.221 392 HE3 LYS 59 2HE LYS 59 10.494 11.545 -11.896 393 HZ1 LYS 59 3HZ LYS 59 11.728 10.448 -13.653 394 HZ2 LYS 59 1HZ LYS 59 12.777 10.793 -12.452 395 HZ3 LYS 59 2HZ LYS 59 12.230 9.259 -12.675 396 H ASP 60 H ASP 60 13.076 6.624 -8.302 397 HA ASP 60 HA ASP 60 13.470 5.825 -10.990 398 HB3 ASP 60 2HB ASP 60 14.925 5.222 -8.393 399 H GLN 61 H GLN 61 12.626 3.756 -8.179 400 HA GLN 61 HA GLN 61 12.694 1.297 -9.797 401 HB3 GLN 61 2HB GLN 61 11.642 0.403 -7.576 402 HG3 GLN 61 2HG GLN 61 13.787 0.548 -6.328 403 HE21 GLN 61 2HE2 GLN 61 16.220 0.134 -7.741 404 HE22 GLN 61 1HE2 GLN 61 15.944 -1.226 -8.826 405 H ALA 62 H ALA 62 10.191 3.518 -8.527 406 HA ALA 62 HA ALA 62 7.893 2.117 -9.543 407 HB1 ALA 62 3HB ALA 62 6.734 4.226 -9.192 408 HB2 ALA 62 1HB ALA 62 7.786 3.896 -7.809 409 HB3 ALA 62 2HB ALA 62 8.282 5.085 -9.038 410 H ASP 63 H ASP 63 10.285 4.205 -11.157 411 HA ASP 63 HA ASP 63 8.905 4.562 -13.618 412 HB3 ASP 63 2HB ASP 63 11.836 4.334 -13.890 413 H ARG 64 H ARG 64 10.662 1.794 -12.375 414 HA ARG 64 HA ARG 64 10.681 0.395 -15.005 415 HB3 ARG 64 2HB ARG 64 11.658 -1.510 -13.633 416 HG3 ARG 64 2HG ARG 64 13.394 0.984 -13.623 417 HD3 ARG 64 2HD ARG 64 13.835 -1.965 -14.255 418 HE ARG 64 HE ARG 64 15.596 0.374 -14.590 419 HH11 ARG 64 1HH2 ARG 64 15.517 -3.143 -14.458 420 HH12 ARG 64 2HH2 ARG 64 17.060 -3.278 -15.258 421 HH21 ARG 64 1HH1 ARG 64 17.554 0.093 -15.588 422 HH22 ARG 64 2HH1 ARG 64 18.169 -1.509 -15.861 423 H CYS 65 H CYS 65 9.748 -0.789 -11.844 424 HA CYS 65 HA CYS 65 7.299 -1.605 -11.578 425 HB3 CYS 65 2HB CYS 65 7.421 -3.970 -12.960 426 H THR 66 H THR 66 10.510 -3.006 -11.896 427 HA THR 66 HA THR 66 10.090 -5.179 -10.035 428 HB THR 66 HB THR 66 12.596 -5.152 -9.869 429 HG1 THR 66 1HG THR 66 13.705 -3.809 -11.246 430 HG21 THR 66 3HG2 THR 66 12.986 -5.857 -12.195 431 HG22 THR 66 1HG2 THR 66 11.414 -6.448 -11.650 432 HG23 THR 66 2HG2 THR 66 11.501 -5.040 -12.723 433 H ILE 67 H ILE 67 10.624 -5.280 -7.853 434 HA ILE 67 HA ILE 67 10.497 -2.669 -6.385 435 HB ILE 67 HB ILE 67 9.715 -5.366 -5.207 436 HG13 ILE 67 2HG1 ILE 67 8.142 -5.211 -6.884 437 HG21 ILE 67 1HG2 ILE 67 10.397 -3.513 -3.651 438 HG22 ILE 67 2HG2 ILE 67 8.943 -2.646 -4.217 439 HG23 ILE 67 3HG2 ILE 67 8.830 -4.230 -3.429 440 HD11 ILE 67 3HD1 ILE 67 6.024 -4.485 -5.993 441 HD12 ILE 67 1HD1 ILE 67 6.926 -5.198 -4.642 442 HD13 ILE 67 2HD1 ILE 67 6.782 -3.426 -4.851 443 H LYS 68 H LYS 68 12.068 -2.303 -4.675 444 HA LYS 68 HA LYS 68 14.620 -3.754 -5.010 445 HB3 LYS 68 2HB LYS 68 14.202 -1.884 -2.706 446 HG3 LYS 68 2HG LYS 68 16.454 -2.980 -3.636 447 HD3 LYS 68 2HD LYS 68 16.060 -0.356 -5.152 448 HE3 LYS 68 2HE LYS 68 18.329 -1.055 -3.747 449 HZ1 LYS 68 3HZ LYS 68 19.948 -1.509 -5.467 450 HZ2 LYS 68 1HZ LYS 68 18.884 -2.745 -5.450 451 HZ3 LYS 68 2HZ LYS 68 18.811 -1.610 -6.629 452 H LYS 69 H LYS 69 15.158 -5.542 -3.871 453 HA LYS 69 HA LYS 69 13.618 -6.759 -1.775 454 HB3 LYS 69 2HB LYS 69 15.208 -7.935 -3.292 455 HG3 LYS 69 2HG LYS 69 17.389 -6.898 -1.431 456 HD3 LYS 69 2HD LYS 69 17.498 -8.438 -4.065 457 HE3 LYS 69 2HE LYS 69 19.577 -7.237 -2.199 458 HZ1 LYS 69 3HZ LYS 69 21.208 -8.487 -3.495 459 HZ2 LYS 69 1HZ LYS 69 20.246 -9.512 -2.669 460 HZ3 LYS 69 2HZ LYS 69 20.034 -9.309 -4.277 461 H GLU 70 H GLU 70 15.976 -4.207 -1.586 462 HA GLU 70 HA GLU 70 16.521 -4.419 1.259 463 HB3 GLU 70 2HB GLU 70 17.438 -2.160 1.033 464 HG3 GLU 70 2HG GLU 70 18.411 -3.551 -1.457 465 H ASN 71 H ASN 71 13.709 -3.353 -0.408 466 HA ASN 71 HA ASN 71 12.747 -1.529 1.686 467 HB3 ASN 71 2HB ASN 71 10.611 -1.697 0.448 468 HD21 ASN 71 2HD2 ASN 71 11.310 -1.957 -2.506 469 HD22 ASN 71 1HD2 ASN 71 12.100 -0.409 -2.809 470 H THR 72 H THR 72 10.447 -2.177 2.522 471 HA THR 72 HA THR 72 10.667 -4.818 3.894 472 HB THR 72 HB THR 72 9.891 -2.093 4.949 473 HG1 THR 72 1HG THR 72 11.597 -2.653 6.417 474 HG21 THR 72 3HG2 THR 72 9.475 -3.079 7.124 475 HG22 THR 72 1HG2 THR 72 8.319 -3.699 5.943 476 HG23 THR 72 2HG2 THR 72 9.683 -4.724 6.476 477 HA PRO 73 HA PRO 73 6.520 -5.371 2.198 478 HB3 PRO 73 2HB PRO 73 6.549 -7.626 2.399 479 HG3 PRO 73 2HG PRO 73 8.213 -8.555 3.686 480 HD3 PRO 73 2HD PRO 73 9.620 -6.790 3.311 481 H LEU 74 H LEU 74 5.796 -3.289 2.877 482 HA LEU 74 HA LEU 74 4.828 -2.753 5.528 483 HB3 LEU 74 2HB LEU 74 3.976 -1.316 2.970 484 HG LEU 74 HG LEU 74 4.304 0.719 4.384 485 HD11 LEU 74 1HD1 LEU 74 2.014 -0.133 3.983 486 HD12 LEU 74 2HD1 LEU 74 2.083 -0.989 5.538 487 HD13 LEU 74 3HD1 LEU 74 2.199 0.766 5.498 488 HD21 LEU 74 3HD2 LEU 74 4.341 0.660 6.778 489 HD22 LEU 74 1HD2 LEU 74 4.221 -1.105 6.815 490 HD23 LEU 74 2HD2 LEU 74 5.686 -0.322 6.174 491 H LEU 75 H LEU 75 3.229 -3.947 2.556 492 HA LEU 75 HA LEU 75 0.863 -4.676 4.222 493 HB3 LEU 75 2HB LEU 75 0.757 -3.552 1.406 494 HG LEU 75 HG LEU 75 -1.480 -2.841 2.043 495 HD11 LEU 75 1HD1 LEU 75 -1.245 -4.969 0.718 496 HD12 LEU 75 2HD1 LEU 75 -1.453 -5.859 2.236 497 HD13 LEU 75 3HD1 LEU 75 -2.736 -4.817 1.650 498 HD21 LEU 75 3HD2 LEU 75 -2.694 -3.873 3.889 499 HD22 LEU 75 1HD2 LEU 75 -1.268 -4.740 4.430 500 HD23 LEU 75 2HD2 LEU 75 -1.290 -2.962 4.500 501 H ASN 76 H ASN 76 0.388 -6.752 4.119 502 HA ASN 76 HA ASN 76 1.166 -8.364 1.734 503 HB3 ASN 76 2HB ASN 76 1.542 -10.209 3.459 504 HD21 ASN 76 2HD2 ASN 76 3.738 -10.497 4.529 505 HD22 ASN 76 1HD2 ASN 76 5.030 -9.565 3.790 506 H CYS 77 H CYS 77 -1.060 -7.889 0.976 507 HA CYS 77 HA CYS 77 -3.341 -8.978 2.430 508 HB3 CYS 77 2HB CYS 77 -3.028 -7.928 -0.389 509 H ALA 78 H ALA 78 -3.578 -11.016 2.671 510 HA ALA 78 HA ALA 78 -3.444 -13.220 2.568 511 HB1 ALA 78 3HB ALA 78 -3.824 -14.454 0.500 512 HB2 ALA 78 1HB ALA 78 -4.940 -13.075 0.610 513 HB3 ALA 78 2HB ALA 78 -3.541 -13.003 -0.472 514 H LYS 79 H LYS 79 -2.029 -14.983 2.244 515 HA LYS 79 HA LYS 79 0.310 -15.734 1.532 516 HB3 LYS 79 2HB LYS 79 0.941 -13.085 2.825 517 HG3 LYS 79 2HG LYS 79 3.415 -13.969 2.427 518 HD3 LYS 79 2HD LYS 79 1.896 -13.305 4.735 519 HE3 LYS 79 2HE LYS 79 2.759 -16.034 4.971 520 HZ1 LYS 79 3HZ LYS 79 4.207 -15.761 6.907 521 HZ2 LYS 79 1HZ LYS 79 4.934 -15.124 5.595 522 HZ3 LYS 79 2HZ LYS 79 4.258 -14.145 6.716 523 HA PRO 80 HA PRO 80 0.387 -16.863 6.075 524 HB3 PRO 80 2HB PRO 80 0.356 -15.010 7.410 525 HG3 PRO 80 2HG PRO 80 -0.934 -13.166 6.954 526 HD3 PRO 80 2HD PRO 80 -0.399 -13.353 4.714 527 H ASP 81 H ASP 81 -2.811 -16.400 7.197 528 HA ASP 81 HA ASP 81 -4.180 -18.269 5.441 529 HB3 ASP 81 2HB ASP 81 -3.989 -19.323 8.262 530 H GLN 82 H GLN 82 -4.580 -15.549 6.452 531 HA GLN 82 HA GLN 82 -7.301 -15.670 7.520 532 HB3 GLN 82 2HB GLN 82 -5.822 -13.866 9.261 533 HG3 GLN 82 2HG GLN 82 -7.142 -16.510 9.998 534 HE21 GLN 82 2HE2 GLN 82 -8.973 -15.388 11.838 535 HE22 GLN 82 1HE2 GLN 82 -8.059 -14.642 13.144 536 H ASP 83 H ASP 83 -8.234 -13.480 7.851 537 HA ASP 83 HA ASP 83 -7.810 -11.649 5.691 538 HB3 ASP 83 2HB ASP 83 -9.935 -11.670 6.784 539 H ILE 84 H ILE 84 -6.718 -9.739 5.578 540 HA ILE 84 HA ILE 84 -4.750 -9.128 7.737 541 HB ILE 84 HB ILE 84 -4.150 -9.578 5.050 542 HG13 ILE 84 2HG1 ILE 84 -2.639 -8.051 7.211 543 HG21 ILE 84 1HG2 ILE 84 -5.083 -7.403 4.317 544 HG22 ILE 84 2HG2 ILE 84 -4.001 -6.553 5.446 545 HG23 ILE 84 3HG2 ILE 84 -3.333 -7.485 4.107 546 HD11 ILE 84 3HD1 ILE 84 -1.331 -10.166 7.362 547 HD12 ILE 84 1HD1 ILE 84 -3.023 -10.439 7.798 548 HD13 ILE 84 2HD1 ILE 84 -2.427 -10.932 6.196 549 H LYS 85 H LYS 85 -4.786 -7.239 8.677 550 HA LYS 85 HA LYS 85 -6.643 -5.093 7.823 551 HB3 LYS 85 2HB LYS 85 -7.675 -4.944 10.004 552 HG3 LYS 85 2HG LYS 85 -7.801 -7.859 9.131 553 HD3 LYS 85 2HD LYS 85 -9.010 -7.465 11.231 554 HE3 LYS 85 2HE LYS 85 -11.312 -6.077 10.331 555 HZ1 LYS 85 3HZ LYS 85 -10.693 -4.476 12.039 556 HZ2 LYS 85 1HZ LYS 85 -10.428 -5.984 12.589 557 HZ3 LYS 85 2HZ LYS 85 -9.170 -5.054 12.121 558 H PHE 86 H PHE 86 -5.577 -3.242 7.885 559 HA PHE 86 HA PHE 86 -3.433 -2.766 9.915 560 HB3 PHE 86 2HB PHE 86 -2.804 -1.685 7.252 561 HD1 PHE 86 2HD PHE 86 -1.606 -4.351 9.654 562 HD2 PHE 86 1HD PHE 86 -0.685 -0.849 7.296 563 HE1 PHE 86 2HE PHE 86 0.758 -4.447 10.417 564 HE2 PHE 86 1HE PHE 86 1.674 -0.964 8.051 565 HZ PHE 86 HZ PHE 86 2.396 -2.751 9.624 566 H THR 87 H THR 87 -4.145 -1.090 11.075 567 HA THR 87 HA THR 87 -5.490 1.181 9.670 568 HB THR 87 HB THR 87 -6.730 0.145 11.541 569 HG1 THR 87 1HG THR 87 -7.603 1.959 11.602 570 HG21 THR 87 3HG2 THR 87 -6.249 0.549 13.840 571 HG22 THR 87 1HG2 THR 87 -4.838 -0.243 13.138 572 HG23 THR 87 2HG2 THR 87 -4.800 1.499 13.478 573 H ILE 88 H ILE 88 -4.400 2.888 9.271 574 HA ILE 88 HA ILE 88 -2.109 3.695 10.991 575 HB ILE 88 HB ILE 88 -2.108 3.330 7.998 576 HG13 ILE 88 2HG1 ILE 88 -0.979 1.750 9.548 577 HG21 ILE 88 1HG2 ILE 88 -1.752 5.768 8.194 578 HG22 ILE 88 2HG2 ILE 88 -0.413 5.487 9.335 579 HG23 ILE 88 3HG2 ILE 88 -0.318 4.946 7.646 580 HD11 ILE 88 3HD1 ILE 88 1.251 1.657 8.633 581 HD12 ILE 88 1HD1 ILE 88 0.130 2.089 7.325 582 HD13 ILE 88 2HD1 ILE 88 1.169 3.327 8.078 583 H LYS 89 H LYS 89 -1.931 5.817 11.340 584 HA LYS 89 HA LYS 89 -4.102 7.665 10.447 585 HB3 LYS 89 2HB LYS 89 -3.130 7.193 13.309 586 HG3 LYS 89 2HG LYS 89 -4.838 9.353 12.084 587 HD3 LYS 89 2HD LYS 89 -5.607 7.783 14.505 588 HE3 LYS 89 2HE LYS 89 -6.748 10.179 15.094 589 HZ1 LYS 89 3HZ LYS 89 -5.049 10.349 16.854 590 HZ2 LYS 89 1HZ LYS 89 -5.588 8.819 16.699 591 HZ3 LYS 89 2HZ LYS 89 -4.120 9.226 16.110 592 H PHE 90 H PHE 90 -3.521 9.620 9.957 593 HA PHE 90 HA PHE 90 -0.727 10.368 9.649 594 HB3 PHE 90 2HB PHE 90 -1.890 12.537 8.823 595 HD1 PHE 90 1HD PHE 90 0.070 11.458 7.563 596 HD2 PHE 90 2HD PHE 90 -4.107 10.515 7.014 597 HE1 PHE 90 1HE PHE 90 0.532 10.792 5.214 598 HE2 PHE 90 2HE PHE 90 -3.675 10.053 4.621 599 HZ PHE 90 HZ PHE 90 -1.318 10.004 3.772 600 H GLN 91 H GLN 91 -0.830 9.946 12.265 601 HA GLN 91 HA GLN 91 0.126 12.377 13.257 602 HB3 GLN 91 2HB GLN 91 -2.232 11.618 14.998 603 HG3 GLN 91 2HG GLN 91 -1.239 14.411 14.322 604 HE21 GLN 91 2HE2 GLN 91 -0.856 15.595 16.620 605 HE22 GLN 91 1HE2 GLN 91 -2.179 15.345 17.752 606 H GLU 92 H GLU 92 -0.332 11.713 16.131 607 HA GLU 92 HA GLU 92 0.680 10.639 17.797 608 HB3 GLU 92 2HB GLU 92 0.129 8.035 16.346 609 HG3 GLU 92 2HG GLU 92 -1.076 8.018 18.833 610 H PHE 93 H PHE 93 2.470 11.787 16.324 611 HA PHE 93 HA PHE 93 4.682 10.331 15.385 612 HB3 PHE 93 2HB PHE 93 4.455 12.728 15.026 613 HD1 PHE 93 1HD PHE 93 6.390 13.018 18.187 614 HD2 PHE 93 2HD PHE 93 2.736 14.092 16.143 615 HE1 PHE 93 1HE PHE 93 5.887 14.690 19.954 616 HE2 PHE 93 2HE PHE 93 2.248 15.767 17.914 617 HZ PHE 93 HZ PHE 93 3.815 16.064 19.825 618 H SER 94 H SER 94 6.269 9.195 16.315 619 HA SER 94 HA SER 94 6.365 8.977 19.293 620 HB3 SER 94 2HB SER 94 6.662 6.754 17.249 621 HG SER 94 HG SER 94 6.538 5.659 19.495 622 HA PRO 95 HA PRO 95 10.625 10.165 18.516 623 HB3 PRO 95 2HB PRO 95 10.601 11.197 20.563 624 HG3 PRO 95 2HG PRO 95 9.386 10.328 22.384 625 HD3 PRO 95 2HD PRO 95 7.740 10.260 20.699 626 H ASN 96 H ASN 96 9.657 7.013 19.724 627 HA ASN 96 HA ASN 96 12.304 5.814 19.169 628 HB3 ASN 96 2HB ASN 96 9.946 4.117 19.940 629 HD21 ASN 96 2HD2 ASN 96 10.675 3.154 22.285 630 HD22 ASN 96 1HD2 ASN 96 12.325 2.541 22.268 631 H LEU 97 H LEU 97 8.914 5.506 18.023 632 HA LEU 97 HA LEU 97 9.815 3.961 15.639 633 HB3 LEU 97 2HB LEU 97 7.110 3.762 15.552 634 HG LEU 97 HG LEU 97 7.196 1.647 16.732 635 HD11 LEU 97 1HD1 LEU 97 7.902 1.780 14.363 636 HD12 LEU 97 2HD1 LEU 97 9.596 1.947 14.877 637 HD13 LEU 97 3HD1 LEU 97 8.695 0.472 15.248 638 HD21 LEU 97 3HD2 LEU 97 9.222 0.725 17.670 639 HD22 LEU 97 1HD2 LEU 97 10.123 2.216 17.340 640 HD23 LEU 97 2HD2 LEU 97 8.797 2.215 18.530 641 H TRP 98 H TRP 98 10.672 5.665 14.477 642 HA TRP 98 HA TRP 98 9.113 7.889 13.573 643 HB3 TRP 98 2HB TRP 98 11.493 7.974 13.555 644 HD1 TRP 98 HD TRP 98 10.741 5.360 10.748 645 HE1 TRP 98 1HE TRP 98 12.834 3.958 10.348 646 HE3 TRP 98 3HE TRP 98 13.929 7.718 13.998 647 HZ2 TRP 98 2HZ TRP 98 15.572 3.895 11.249 648 HZ3 TRP 98 3HZ TRP 98 16.301 6.996 14.162 649 HH2 TRP 98 HH TRP 98 17.129 5.090 12.798 650 H GLY 99 H GLY 99 8.434 4.699 12.900 651 HA2 GLY 99 2HA GLY 99 7.883 4.719 10.073 652 H LEU 100 H LEU 100 5.821 5.367 12.942 653 HA LEU 100 HA LEU 100 3.506 6.206 11.279 654 HB3 LEU 100 2HB LEU 100 2.478 6.674 13.555 655 HG LEU 100 HG LEU 100 3.495 3.868 12.944 656 HD11 LEU 100 1HD1 LEU 100 3.139 4.084 15.364 657 HD12 LEU 100 2HD1 LEU 100 1.519 4.758 15.083 658 HD13 LEU 100 3HD1 LEU 100 1.884 3.078 14.626 659 HD21 LEU 100 3HD2 LEU 100 1.127 3.463 12.361 660 HD22 LEU 100 1HD2 LEU 100 0.729 5.152 12.726 661 HD23 LEU 100 2HD2 LEU 100 1.792 4.758 11.360 662 H GLU 101 H GLU 101 6.322 7.722 12.603 663 HA GLU 101 HA GLU 101 5.260 10.425 12.826 664 HB3 GLU 101 2HB GLU 101 7.607 11.148 12.318 665 HG3 GLU 101 2HG GLU 101 7.603 9.152 14.593 666 H PHE 102 H PHE 102 4.969 11.941 11.332 667 HA PHE 102 HA PHE 102 5.206 11.323 8.450 668 HB3 PHE 102 2HB PHE 102 3.175 12.469 9.567 669 HD1 PHE 102 2HD PHE 102 4.118 13.647 11.828 670 HD2 PHE 102 1HD PHE 102 4.184 15.404 7.884 671 HE1 PHE 102 2HE PHE 102 4.417 15.898 12.826 672 HE2 PHE 102 1HE PHE 102 4.491 17.647 8.887 673 HZ PHE 102 HZ PHE 102 4.585 17.905 11.362 674 H GLN 103 H GLN 103 6.252 13.056 7.106 675 HA GLN 103 HA GLN 103 8.593 14.430 8.366 676 HB3 GLN 103 2HB GLN 103 9.835 14.054 6.251 677 HG3 GLN 103 2HG GLN 103 9.771 12.301 8.319 678 HE21 GLN 103 2HE2 GLN 103 8.289 10.542 8.736 679 HE22 GLN 103 1HE2 GLN 103 7.968 9.301 7.549 680 H LYS 104 H LYS 104 9.362 16.201 6.619 681 HA LYS 104 HA LYS 104 6.898 17.663 5.760 682 HB3 LYS 104 2HB LYS 104 9.277 19.212 6.772 683 HG3 LYS 104 2HG LYS 104 6.243 19.387 6.928 684 HD3 LYS 104 2HD LYS 104 8.032 20.327 8.968 685 HE3 LYS 104 2HE LYS 104 6.780 22.445 7.198 686 HZ1 LYS 104 3HZ LYS 104 7.009 23.933 9.123 687 HZ2 LYS 104 1HZ LYS 104 5.868 22.803 9.398 688 HZ3 LYS 104 2HZ LYS 104 7.334 22.673 10.110 689 H ASN 105 H ASN 105 6.844 18.649 3.865 690 HA ASN 105 HA ASN 105 7.155 18.645 1.644 691 HB3 ASN 105 2HB ASN 105 9.417 19.555 0.833 692 HD21 ASN 105 2HD2 ASN 105 9.312 21.602 3.543 693 HD22 ASN 105 1HD2 ASN 105 8.136 22.727 2.876 694 H LYS 106 H LYS 106 7.190 16.113 2.684 695 HA LYS 106 HA LYS 106 9.259 14.669 1.061 696 HB3 LYS 106 2HB LYS 106 8.223 12.901 3.022 697 HG3 LYS 106 2HG LYS 106 10.535 12.964 2.089 698 HD3 LYS 106 2HD LYS 106 11.212 15.020 4.231 699 HE3 LYS 106 2HE LYS 106 12.552 13.724 1.854 700 HZ1 LYS 106 3HZ LYS 106 14.176 15.513 1.829 701 HZ2 LYS 106 1HZ LYS 106 12.711 16.096 1.418 702 HZ3 LYS 106 2HZ LYS 106 13.316 16.390 2.907 703 H ASP 107 H ASP 107 8.735 13.062 -0.142 704 HA ASP 107 HA ASP 107 5.870 12.444 -0.753 705 HB3 ASP 107 2HB ASP 107 6.866 12.224 -3.169 706 H TYR 108 H TYR 108 5.746 10.450 0.094 707 HA TYR 108 HA TYR 108 7.771 8.365 -0.377 708 HB3 TYR 108 2HB TYR 108 5.378 7.099 0.275 709 HD1 TYR 108 1HD TYR 108 7.639 5.801 0.556 710 HD2 TYR 108 2HD TYR 108 6.192 8.874 3.227 711 HE1 TYR 108 1HE TYR 108 9.078 4.898 2.383 712 HE2 TYR 108 2HE TYR 108 7.617 7.961 5.050 713 HH TYR 108 HH TYR 108 9.143 6.350 5.653 714 H TYR 109 H TYR 109 7.704 6.822 -1.874 715 HA TYR 109 HA TYR 109 5.531 6.729 -3.911 716 HB3 TYR 109 2HB TYR 109 7.489 5.710 -5.324 717 HD1 TYR 109 2HD TYR 109 8.192 9.131 -3.953 718 HD2 TYR 109 1HD TYR 109 6.736 6.770 -7.261 719 HE1 TYR 109 2HE TYR 109 8.161 11.163 -5.384 720 HE2 TYR 109 1HE TYR 109 6.708 8.809 -8.697 721 HH TYR 109 HH TYR 109 7.699 12.021 -7.468 722 H ILE 110 H ILE 110 4.840 4.720 -4.403 723 HA ILE 110 HA ILE 110 5.879 2.286 -3.047 724 HB ILE 110 HB ILE 110 2.982 3.248 -2.943 725 HG13 ILE 110 2HG1 ILE 110 3.910 4.726 -1.415 726 HG21 ILE 110 1HG2 ILE 110 3.335 0.775 -2.919 727 HG22 ILE 110 2HG2 ILE 110 4.245 0.951 -1.402 728 HG23 ILE 110 3HG2 ILE 110 2.528 1.367 -1.503 729 HD11 ILE 110 3HD1 ILE 110 3.335 4.176 0.808 730 HD12 ILE 110 1HD1 ILE 110 2.181 3.241 -0.156 731 HD13 ILE 110 2HD1 ILE 110 3.596 2.445 0.545 732 H ILE 111 H ILE 111 5.193 0.353 -4.184 733 HA ILE 111 HA ILE 111 3.561 0.678 -6.639 734 HB ILE 111 HB ILE 111 6.148 0.891 -6.966 735 HG13 ILE 111 2HG1 ILE 111 4.654 1.029 -8.765 736 HG21 ILE 111 1HG2 ILE 111 6.625 -1.237 -5.688 737 HG22 ILE 111 2HG2 ILE 111 5.939 -2.141 -7.065 738 HG23 ILE 111 3HG2 ILE 111 7.388 -1.147 -7.271 739 HD11 ILE 111 3HD1 ILE 111 6.064 0.283 -10.476 740 HD12 ILE 111 1HD1 ILE 111 7.189 0.222 -9.113 741 HD13 ILE 111 2HD1 ILE 111 6.379 -1.258 -9.636 742 H SER 112 H SER 112 2.839 -1.424 -7.484 743 HA SER 112 HA SER 112 3.241 -3.791 -5.752 744 HB3 SER 112 2HB SER 112 0.438 -3.210 -6.632 745 HG SER 112 HG SER 112 0.089 -4.437 -4.698 746 H THR 113 H THR 113 2.237 -5.690 -6.739 747 HA THR 113 HA THR 113 2.682 -5.737 -9.687 748 HB THR 113 HB THR 113 4.113 -7.633 -9.470 749 HG1 THR 113 1HG THR 113 4.710 -8.500 -7.609 750 HG21 THR 113 3HG2 THR 113 6.044 -6.597 -8.554 751 HG22 THR 113 1HG2 THR 113 5.033 -5.256 -9.142 752 HG23 THR 113 2HG2 THR 113 5.085 -5.639 -7.421 753 H SER 114 H SER 114 0.119 -5.671 -8.891 754 HA SER 114 HA SER 114 -1.221 -8.026 -8.213 755 HB3 SER 114 2HB SER 114 -2.269 -5.875 -10.083 756 HG SER 114 HG SER 114 -4.217 -6.397 -8.934 757 H ASN 115 H ASN 115 0.347 -7.488 -11.276 758 HA ASN 115 HA ASN 115 -1.053 -9.446 -12.867 759 HB3 ASN 115 2HB ASN 115 1.655 -9.564 -13.640 760 HD21 ASN 115 2HD2 ASN 115 2.127 -8.461 -15.715 761 HD22 ASN 115 1HD2 ASN 115 0.751 -7.978 -16.692 762 H GLY 116 H GLY 116 1.293 -9.736 -10.289 763 HA2 GLY 116 2HA GLY 116 2.536 -11.432 -9.436 764 H SER 117 H SER 117 3.231 -11.394 -12.039 765 HA SER 117 HA SER 117 2.758 -13.623 -13.717 766 HB3 SER 117 2HB SER 117 5.247 -11.882 -13.465 767 HG SER 117 HG SER 117 5.446 -12.506 -15.709 768 H LEU 118 H LEU 118 4.211 -15.504 -14.198 769 HA LEU 118 HA LEU 118 5.001 -16.940 -11.872 770 HB3 LEU 118 2HB LEU 118 6.063 -17.446 -14.669 771 HG LEU 118 HG LEU 118 5.617 -19.771 -14.261 772 HD11 LEU 118 1HD1 LEU 118 7.840 -18.828 -13.514 773 HD12 LEU 118 2HD1 LEU 118 7.220 -18.946 -11.837 774 HD13 LEU 118 3HD1 LEU 118 7.350 -20.399 -12.832 775 HD21 LEU 118 3HD2 LEU 118 4.927 -20.686 -12.120 776 HD22 LEU 118 1HD2 LEU 118 4.825 -19.079 -11.400 777 HD23 LEU 118 2HD2 LEU 118 3.711 -19.541 -12.697 778 H GLU 119 H GLU 119 6.964 -14.935 -14.104 779 HA GLU 119 HA GLU 119 9.470 -15.470 -12.780 780 HB3 GLU 119 2HB GLU 119 10.278 -13.428 -13.869 781 HG3 GLU 119 2HG GLU 119 8.689 -14.524 -16.117 782 H GLY 120 H GLY 120 6.833 -13.359 -11.899 783 HA2 GLY 120 2HA GLY 120 8.389 -12.073 -9.681 784 H LEU 121 H LEU 121 6.862 -14.797 -9.743 785 HA LEU 121 HA LEU 121 4.465 -14.531 -8.319 786 HB3 LEU 121 2HB LEU 121 5.794 -16.573 -9.535 787 HG LEU 121 HG LEU 121 6.887 -17.074 -7.103 788 HD11 LEU 121 1HD1 LEU 121 4.624 -17.165 -5.978 789 HD12 LEU 121 2HD1 LEU 121 4.199 -18.527 -7.023 790 HD13 LEU 121 3HD1 LEU 121 5.532 -18.674 -5.856 791 HD21 LEU 121 3HD2 LEU 121 6.950 -19.454 -7.712 792 HD22 LEU 121 1HD2 LEU 121 5.675 -19.190 -8.920 793 HD23 LEU 121 2HD2 LEU 121 7.264 -18.423 -9.111 794 H ASP 122 H ASP 122 7.694 -14.651 -7.170 795 HA ASP 122 HA ASP 122 6.996 -13.796 -4.405 796 HB3 ASP 122 2HB ASP 122 8.946 -16.041 -5.111 797 H ASN 123 H ASN 123 9.410 -13.980 -7.052 798 HA ASN 123 HA ASN 123 11.315 -12.086 -5.997 799 HB3 ASN 123 2HB ASN 123 11.583 -11.621 -8.544 800 HD21 ASN 123 2HD2 ASN 123 13.026 -12.873 -9.839 801 HD22 ASN 123 1HD2 ASN 123 14.010 -14.096 -9.034 802 H GLN 124 H GLN 124 11.579 -10.000 -6.468 803 HA GLN 124 HA GLN 124 9.249 -8.287 -6.378 804 HB3 GLN 124 2HB GLN 124 10.976 -6.560 -6.247 805 HG3 GLN 124 2HG GLN 124 10.171 -7.958 -4.214 806 HE21 GLN 124 2HE2 GLN 124 11.092 -9.045 -2.235 807 HE22 GLN 124 1HE2 GLN 124 12.467 -10.121 -2.453 808 H GLU 125 H GLU 125 8.601 -9.239 -8.666 809 HA GLU 125 HA GLU 125 9.601 -7.323 -10.754 810 HB3 GLU 125 2HB GLU 125 9.201 -9.032 -12.445 811 HG3 GLU 125 2HG GLU 125 11.121 -9.986 -10.279 812 H GLY 126 H GLY 126 8.191 -5.980 -11.526 813 HA2 GLY 126 2HA GLY 126 5.298 -6.444 -11.074 814 H GLY 127 H GLY 127 3.968 -5.245 -12.739 815 HA2 GLY 127 2HA GLY 127 4.595 -5.502 -15.555 816 H VAL 128 H VAL 128 1.991 -5.360 -13.054 817 HA VAL 128 HA VAL 128 0.117 -3.969 -14.798 818 HB VAL 128 HB VAL 128 -1.119 -3.418 -12.733 819 HG11 VAL 128 1HG1 VAL 128 -1.469 -5.529 -13.944 820 HG12 VAL 128 2HG1 VAL 128 -0.234 -6.292 -12.946 821 HG13 VAL 128 3HG1 VAL 128 -1.747 -5.723 -12.211 822 HG21 VAL 128 3HG2 VAL 128 -0.507 -4.266 -10.584 823 HG22 VAL 128 1HG2 VAL 128 1.053 -4.865 -11.193 824 HG23 VAL 128 2HG2 VAL 128 0.709 -3.127 -11.135 825 H CYS 129 H CYS 129 2.669 -2.802 -12.566 826 HA CYS 129 HA CYS 129 2.029 -0.108 -12.604 827 HB3 CYS 129 2HB CYS 129 4.048 -1.510 -11.503 828 H GLN 130 H GLN 130 3.338 -1.957 -15.240 829 HA GLN 130 HA GLN 130 4.483 -0.028 -16.919 830 HB3 GLN 130 2HB GLN 130 2.944 -2.526 -17.712 831 HG3 GLN 130 2HG GLN 130 5.460 -1.234 -18.863 832 HE21 GLN 130 2HE2 GLN 130 5.152 -2.138 -21.483 833 HE22 GLN 130 1HE2 GLN 130 5.261 -3.896 -21.490 834 H THR 131 H THR 131 1.058 -0.862 -16.447 835 HA THR 131 HA THR 131 0.199 1.365 -18.253 836 HB THR 131 HB THR 131 -0.779 -1.507 -18.467 837 HG1 THR 131 1HG THR 131 -0.033 -1.245 -20.624 838 HG21 THR 131 3HG2 THR 131 -2.194 -0.639 -20.362 839 HG22 THR 131 1HG2 THR 131 -2.710 -0.107 -18.768 840 HG23 THR 131 2HG2 THR 131 -1.822 1.019 -19.819 841 H ARG 132 H ARG 132 -1.081 -1.143 -15.962 842 HA ARG 132 HA ARG 132 -3.414 0.378 -15.085 843 HB3 ARG 132 2HB ARG 132 -3.038 -1.093 -13.011 844 HG3 ARG 132 2HG ARG 132 -3.229 -3.364 -14.028 845 HD3 ARG 132 2HD ARG 132 -5.174 -1.713 -13.538 846 HE ARG 132 HE ARG 132 -5.586 -0.408 -15.433 847 HH11 ARG 132 1HH2 ARG 132 -5.554 -3.782 -16.382 848 HH12 ARG 132 2HH2 ARG 132 -6.230 -3.444 -17.950 849 HH21 ARG 132 1HH1 ARG 132 -6.400 -0.043 -17.471 850 HH22 ARG 132 2HH1 ARG 132 -6.690 -1.382 -18.543 851 H ALA 133 H ALA 133 -0.004 0.595 -14.421 852 HA ALA 133 HA ALA 133 1.235 1.879 -13.017 853 HB1 ALA 133 3HB ALA 133 0.611 4.229 -12.876 854 HB2 ALA 133 1HB ALA 133 0.412 3.583 -14.515 855 HB3 ALA 133 2HB ALA 133 -1.007 3.863 -13.486 856 H MET 134 H MET 134 0.080 -0.086 -11.573 857 HA MET 134 HA MET 134 -1.346 0.885 -9.273 858 HB3 MET 134 2HB MET 134 0.267 -1.679 -9.472 859 HG3 MET 134 2HG MET 134 -2.103 -0.703 -7.839 860 HE1 MET 134 3HE MET 134 -3.323 -3.813 -6.007 861 HE2 MET 134 1HE MET 134 -2.023 -2.721 -5.464 862 HE3 MET 134 2HE MET 134 -3.458 -2.061 -6.288 863 H LYS 135 H LYS 135 -0.202 2.676 -8.630 864 HA LYS 135 HA LYS 135 1.904 2.091 -6.634 865 HB3 LYS 135 2HB LYS 135 3.305 2.952 -8.219 866 HG3 LYS 135 2HG LYS 135 2.349 5.507 -9.059 867 HD3 LYS 135 2HD LYS 135 2.167 3.671 -11.272 868 HE3 LYS 135 2HE LYS 135 4.534 4.626 -11.760 869 HZ1 LYS 135 3HZ LYS 135 3.607 6.845 -12.221 870 HZ2 LYS 135 1HZ LYS 135 2.600 5.675 -12.727 871 HZ3 LYS 135 2HZ LYS 135 2.265 6.506 -11.355 872 H ILE 136 H ILE 136 2.153 3.924 -5.082 873 HA ILE 136 HA ILE 136 -0.157 5.683 -4.935 874 HB ILE 136 HB ILE 136 -1.257 4.246 -3.708 875 HG13 ILE 136 2HG1 ILE 136 -1.574 4.956 -1.575 876 HG21 ILE 136 1HG2 ILE 136 0.253 2.361 -3.528 877 HG22 ILE 136 2HG2 ILE 136 1.036 3.110 -2.118 878 HG23 ILE 136 3HG2 ILE 136 -0.663 2.665 -2.051 879 HD11 ILE 136 3HD1 ILE 136 0.128 6.310 -0.277 880 HD12 ILE 136 1HD1 ILE 136 0.373 4.564 -0.306 881 HD13 ILE 136 2HD1 ILE 136 1.377 5.631 -1.309 882 H LEU 137 H LEU 137 0.184 7.572 -4.107 883 HA LEU 137 HA LEU 137 2.976 8.138 -3.210 884 HB3 LEU 137 2HB LEU 137 2.575 10.454 -3.848 885 HG LEU 137 HG LEU 137 1.988 9.079 -6.441 886 HD11 LEU 137 1HD1 LEU 137 2.686 11.464 -6.297 887 HD12 LEU 137 2HD1 LEU 137 4.204 10.966 -5.516 888 HD13 LEU 137 3HD1 LEU 137 3.865 10.486 -7.187 889 HD21 LEU 137 3HD2 LEU 137 4.306 8.267 -6.681 890 HD22 LEU 137 1HD2 LEU 137 4.586 8.547 -4.949 891 HD23 LEU 137 2HD2 LEU 137 3.409 7.329 -5.504 892 H MET 138 H MET 138 3.260 8.926 -1.293 893 HA MET 138 HA MET 138 0.972 9.772 0.466 894 HB3 MET 138 2HB MET 138 2.887 8.976 2.228 895 HG3 MET 138 2HG MET 138 1.530 6.569 1.539 896 HE1 MET 138 3HE MET 138 0.869 5.668 5.029 897 HE2 MET 138 1HE MET 138 0.175 5.389 3.414 898 HE3 MET 138 2HE MET 138 1.941 5.396 3.640 899 H LYS 139 H LYS 139 1.094 11.892 0.251 900 HA LYS 139 HA LYS 139 3.653 13.410 0.411 901 HB3 LYS 139 2HB LYS 139 2.037 15.370 0.187 902 HG3 LYS 139 2HG LYS 139 2.243 13.130 -1.834 903 HD3 LYS 139 2HD LYS 139 0.712 15.679 -2.415 904 HE3 LYS 139 2HE LYS 139 1.147 13.048 -3.923 905 HZ1 LYS 139 3HZ LYS 139 0.121 14.234 -5.752 906 HZ2 LYS 139 1HZ LYS 139 -0.925 14.229 -4.498 907 HZ3 LYS 139 2HZ LYS 139 -0.084 15.583 -4.862 908 H VAL 140 H VAL 140 4.306 14.456 2.175 909 HA VAL 140 HA VAL 140 2.551 14.719 4.557 910 HB VAL 140 HB VAL 140 4.471 13.967 5.998 911 HG11 VAL 140 1HG1 VAL 140 2.435 12.626 5.661 912 HG12 VAL 140 2HG1 VAL 140 3.221 11.793 4.302 913 HG13 VAL 140 3HG1 VAL 140 3.876 11.635 5.937 914 HG21 VAL 140 3HG2 VAL 140 6.061 12.329 5.124 915 HG22 VAL 140 1HG2 VAL 140 5.451 12.555 3.476 916 HG23 VAL 140 2HG2 VAL 140 6.282 13.885 4.308 917 H GLY 141 H GLY 141 2.626 16.666 5.340 918 HA2 GLY 141 2HA GLY 141 3.276 18.782 5.946 919 H GLN 142 H GLN 142 2.087 20.113 4.585 920 HA GLN 142 HA GLN 142 2.875 20.655 1.793 921 HB3 GLN 142 2HB GLN 142 1.038 22.341 1.906 922 HG3 GLN 142 2HG GLN 142 -0.089 19.756 2.976 923 HE21 GLN 142 2HE2 GLN 142 -2.325 19.595 2.350 924 HE22 GLN 142 1HE2 GLN 142 -3.027 20.602 1.092 Start of MODEL 10 1 H1 SER 1 H SER 1 -14.944 17.750 12.126 2 HA SER 1 HA SER 1 -15.303 15.646 14.006 3 HB3 SER 1 2HB SER 1 -15.746 13.736 12.418 4 HG SER 1 HG SER 1 -17.953 14.050 12.529 5 H LYS 2 H LYS 2 -13.282 15.264 14.492 6 HA LYS 2 HA LYS 2 -11.114 15.255 12.493 7 HB3 LYS 2 2HB LYS 2 -10.570 14.187 15.234 8 HG3 LYS 2 2HG LYS 2 -9.502 16.435 13.452 9 HD3 LYS 2 2HD LYS 2 -8.227 15.499 16.046 10 HE3 LYS 2 2HE LYS 2 -7.885 18.067 14.422 11 HZ1 LYS 2 3HZ LYS 2 -5.781 18.147 15.583 12 HZ2 LYS 2 1HZ LYS 2 -6.947 17.999 16.712 13 HZ3 LYS 2 2HZ LYS 2 -6.025 16.710 16.307 14 H SER 3 H SER 3 -9.590 13.305 12.582 15 HA SER 3 HA SER 3 -9.361 11.318 11.475 16 HB3 SER 3 2HB SER 3 -8.877 10.533 13.588 17 HG SER 3 HG SER 3 -10.568 9.684 14.984 18 H ILE 4 H ILE 4 -10.922 12.276 9.899 19 HA ILE 4 HA ILE 4 -13.407 10.860 9.430 20 HB ILE 4 HB ILE 4 -13.204 11.895 7.131 21 HG13 ILE 4 2HG1 ILE 4 -11.636 13.400 6.519 22 HG21 ILE 4 1HG2 ILE 4 -14.645 12.745 8.814 23 HG22 ILE 4 2HG2 ILE 4 -13.321 13.646 9.584 24 HG23 ILE 4 3HG2 ILE 4 -13.870 14.088 7.948 25 HD11 ILE 4 3HD1 ILE 4 -9.958 14.550 8.008 26 HD12 ILE 4 1HD1 ILE 4 -11.623 15.058 8.264 27 HD13 ILE 4 2HD1 ILE 4 -10.838 13.958 9.418 28 H VAL 5 H VAL 5 -12.158 10.564 6.407 29 HA VAL 5 HA VAL 5 -10.519 8.222 6.513 30 HB VAL 5 HB VAL 5 -12.503 6.934 5.153 31 HG11 VAL 5 1HG1 VAL 5 -11.013 5.873 6.709 32 HG12 VAL 5 2HG1 VAL 5 -11.896 6.572 8.086 33 HG13 VAL 5 3HG1 VAL 5 -12.705 5.405 7.018 34 HG21 VAL 5 3HG2 VAL 5 -14.552 6.848 6.412 35 HG22 VAL 5 1HG2 VAL 5 -13.950 7.998 7.602 36 HG23 VAL 5 2HG2 VAL 5 -14.287 8.533 5.941 37 H LEU 6 H LEU 6 -9.251 9.168 4.931 38 HA LEU 6 HA LEU 6 -10.486 10.812 2.913 39 HB3 LEU 6 2HB LEU 6 -7.651 9.686 2.712 40 HG LEU 6 HG LEU 6 -7.015 11.914 2.037 41 HD11 LEU 6 1HD1 LEU 6 -7.751 10.407 0.211 42 HD12 LEU 6 2HD1 LEU 6 -9.373 11.133 0.295 43 HD13 LEU 6 3HD1 LEU 6 -7.985 12.125 -0.158 44 HD21 LEU 6 3HD2 LEU 6 -8.519 13.739 1.630 45 HD22 LEU 6 1HD2 LEU 6 -9.933 12.756 2.053 46 HD23 LEU 6 2HD2 LEU 6 -8.741 13.187 3.290 47 H GLU 7 H GLU 7 -8.689 7.741 2.481 48 HA GLU 7 HA GLU 7 -10.749 6.620 0.768 49 HB3 GLU 7 2HB GLU 7 -8.742 6.076 -0.952 50 HG3 GLU 7 2HG GLU 7 -11.117 7.453 -1.182 51 HA PRO 8 HA PRO 8 -8.453 3.630 3.454 52 HB3 PRO 8 2HB PRO 8 -10.043 3.818 5.078 53 HG3 PRO 8 2HG PRO 8 -12.295 4.377 4.590 54 HD3 PRO 8 2HD PRO 8 -11.118 6.070 3.447 55 H ILE 9 H ILE 9 -7.761 1.592 2.934 56 HA ILE 9 HA ILE 9 -8.394 0.854 0.193 57 HB ILE 9 HB ILE 9 -6.586 -0.829 1.906 58 HG13 ILE 9 2HG1 ILE 9 -4.666 0.582 1.477 59 HG21 ILE 9 1HG2 ILE 9 -7.004 -1.536 -0.384 60 HG22 ILE 9 2HG2 ILE 9 -6.453 0.040 -0.994 61 HG23 ILE 9 3HG2 ILE 9 -5.321 -1.050 -0.160 62 HD11 ILE 9 3HD1 ILE 9 -4.878 2.989 1.044 63 HD12 ILE 9 1HD1 ILE 9 -5.352 2.033 -0.369 64 HD13 ILE 9 2HD1 ILE 9 -6.598 2.787 0.654 65 H TYR 10 H TYR 10 -10.212 -0.281 -0.179 66 HA TYR 10 HA TYR 10 -11.068 -2.429 1.738 67 HB3 TYR 10 2HB TYR 10 -13.303 -1.885 0.321 68 HD1 TYR 10 2HD TYR 10 -11.304 -0.053 2.953 69 HD2 TYR 10 1HD TYR 10 -15.147 -1.546 1.656 70 HE1 TYR 10 2HE TYR 10 -12.270 0.507 5.170 71 HE2 TYR 10 1HE TYR 10 -16.110 -0.981 3.886 72 HH TYR 10 HH TYR 10 -14.146 0.492 6.491 73 H TRP 11 H TRP 11 -9.694 -4.024 0.720 74 HA TRP 11 HA TRP 11 -9.921 -4.579 -2.095 75 HB3 TRP 11 2HB TRP 11 -8.688 -6.731 -0.567 76 HD1 TRP 11 HD TRP 11 -6.011 -4.443 -1.154 77 HE1 TRP 11 1HE TRP 11 -5.018 -4.600 -3.520 78 HE3 TRP 11 3HE TRP 11 -9.654 -7.254 -3.435 79 HZ2 TRP 11 2HZ TRP 11 -5.852 -5.461 -6.108 80 HZ3 TRP 11 3HZ TRP 11 -9.530 -7.716 -5.870 81 HH2 TRP 11 HH TRP 11 -7.658 -6.773 -7.220 82 H ASN 12 H ASN 12 -12.454 -4.563 -1.349 83 HA ASN 12 HA ASN 12 -13.487 -7.242 -1.825 84 HB3 ASN 12 2HB ASN 12 -14.939 -6.142 0.467 85 HD21 ASN 12 2HD2 ASN 12 -13.514 -7.821 2.397 86 HD22 ASN 12 1HD2 ASN 12 -13.951 -9.460 1.945 87 H SER 13 H SER 13 -14.388 -6.498 -3.715 88 HA SER 13 HA SER 13 -15.815 -5.540 -5.170 89 HB3 SER 13 2HB SER 13 -17.742 -5.171 -2.868 90 HG SER 13 HG SER 13 -19.193 -5.886 -4.523 91 H SER 14 H SER 14 -14.517 -3.771 -5.598 92 HA SER 14 HA SER 14 -14.087 -1.651 -6.132 93 HB3 SER 14 2HB SER 14 -16.494 -0.519 -4.710 94 HG SER 14 HG SER 14 -16.362 0.817 -6.608 95 H ASN 15 H ASN 15 -12.238 -1.329 -5.163 96 HA ASN 15 HA ASN 15 -11.964 -0.655 -2.315 97 HB3 ASN 15 2HB ASN 15 -10.329 -2.149 -3.286 98 HD21 ASN 15 2HD2 ASN 15 -7.847 -1.174 -4.380 99 HD22 ASN 15 1HD2 ASN 15 -8.107 -1.120 -6.121 100 H SER 16 H SER 16 -11.311 1.408 -1.507 101 HA SER 16 HA SER 16 -12.072 3.725 -2.931 102 HB3 SER 16 2HB SER 16 -11.006 5.052 -1.317 103 HG SER 16 HG SER 16 -11.668 3.034 0.384 104 H LYS 17 H LYS 17 -8.977 2.022 -2.932 105 HA LYS 17 HA LYS 17 -7.540 3.952 -4.479 106 HB3 LYS 17 2HB LYS 17 -7.201 0.990 -4.037 107 HG3 LYS 17 2HG LYS 17 -5.555 2.788 -5.834 108 HD3 LYS 17 2HD LYS 17 -4.007 1.736 -4.085 109 HE3 LYS 17 2HE LYS 17 -3.320 -0.628 -5.068 110 HZ1 LYS 17 3HZ LYS 17 -4.582 -1.740 -3.334 111 HZ2 LYS 17 1HZ LYS 17 -3.896 -0.381 -2.770 112 HZ3 LYS 17 2HZ LYS 17 -5.499 -0.417 -3.084 113 H PHE 18 H PHE 18 -9.709 1.342 -5.597 114 HA PHE 18 HA PHE 18 -10.112 0.681 -7.822 115 HB3 PHE 18 2HB PHE 18 -11.437 3.345 -7.204 116 HD1 PHE 18 1HD PHE 18 -12.139 0.250 -9.301 117 HD2 PHE 18 2HD PHE 18 -12.285 4.568 -8.972 118 HE1 PHE 18 1HE PHE 18 -12.987 0.410 -11.647 119 HE2 PHE 18 2HE PHE 18 -13.131 4.719 -11.313 120 HZ PHE 18 HZ PHE 18 -13.424 2.645 -12.669 121 H LEU 19 H LEU 19 -7.637 1.093 -8.284 122 HA LEU 19 HA LEU 19 -6.508 3.313 -9.193 123 HB3 LEU 19 2HB LEU 19 -5.269 1.408 -8.738 124 HG LEU 19 HG LEU 19 -6.922 -0.156 -10.400 125 HD11 LEU 19 1HD1 LEU 19 -5.580 0.666 -12.406 126 HD12 LEU 19 2HD1 LEU 19 -4.153 -0.002 -11.646 127 HD13 LEU 19 3HD1 LEU 19 -5.480 -1.066 -12.137 128 HD21 LEU 19 3HD2 LEU 19 -5.447 -1.977 -9.828 129 HD22 LEU 19 1HD2 LEU 19 -4.134 -0.860 -9.392 130 HD23 LEU 19 2HD2 LEU 19 -5.632 -0.919 -8.435 131 HA PRO 20 HA PRO 20 -9.030 3.988 -12.846 132 HB3 PRO 20 2HB PRO 20 -10.053 5.690 -11.774 133 HG3 PRO 20 2HG PRO 20 -8.984 6.923 -10.130 134 HD3 PRO 20 2HD PRO 20 -7.967 5.027 -9.350 135 H GLY 21 H GLY 21 -5.735 4.775 -12.497 136 HA2 GLY 21 2HA GLY 21 -5.377 4.559 -15.457 137 H GLN 22 H GLN 22 -3.113 5.307 -12.768 138 HA GLN 22 HA GLN 22 -1.917 2.603 -13.096 139 HB3 GLN 22 2HB GLN 22 0.355 3.739 -12.905 140 HG3 GLN 22 2HG GLN 22 -0.789 4.762 -15.461 141 HE21 GLN 22 2HE2 GLN 22 0.454 2.433 -16.829 142 HE22 GLN 22 1HE2 GLN 22 2.191 2.664 -16.675 143 H GLY 23 H GLY 23 -3.606 3.869 -10.978 144 HA2 GLY 23 2HA GLY 23 -3.059 2.638 -8.706 145 H LEU 24 H LEU 24 -2.941 4.417 -6.599 146 HA LEU 24 HA LEU 24 -4.723 6.713 -7.299 147 HB3 LEU 24 2HB LEU 24 -5.141 4.954 -4.862 148 HG LEU 24 HG LEU 24 -5.893 7.679 -5.276 149 HD11 LEU 24 1HD1 LEU 24 -7.600 6.872 -6.916 150 HD12 LEU 24 2HD1 LEU 24 -8.349 5.954 -5.610 151 HD13 LEU 24 3HD1 LEU 24 -8.272 7.709 -5.502 152 HD21 LEU 24 3HD2 LEU 24 -7.109 7.457 -3.238 153 HD22 LEU 24 1HD2 LEU 24 -7.263 5.701 -3.421 154 HD23 LEU 24 2HD2 LEU 24 -5.671 6.426 -3.151 155 H VAL 25 H VAL 25 -4.051 8.564 -6.510 156 HA VAL 25 HA VAL 25 -1.626 8.737 -4.885 157 HB VAL 25 HB VAL 25 -3.568 10.759 -6.087 158 HG11 VAL 25 1HG1 VAL 25 -2.633 11.899 -4.174 159 HG12 VAL 25 2HG1 VAL 25 -1.011 11.311 -4.530 160 HG13 VAL 25 3HG1 VAL 25 -1.788 12.476 -5.613 161 HG21 VAL 25 3HG2 VAL 25 -1.648 11.201 -7.598 162 HG22 VAL 25 1HG2 VAL 25 -0.740 9.896 -6.799 163 HG23 VAL 25 2HG2 VAL 25 -2.209 9.533 -7.709 164 H LEU 26 H LEU 26 -1.425 9.191 -2.761 165 HA LEU 26 HA LEU 26 -3.905 9.682 -1.153 166 HB3 LEU 26 2HB LEU 26 -1.903 8.683 0.591 167 HG LEU 26 HG LEU 26 -3.200 6.655 0.838 168 HD11 LEU 26 1HD1 LEU 26 -4.004 8.652 2.034 169 HD12 LEU 26 2HD1 LEU 26 -5.083 9.046 0.669 170 HD13 LEU 26 3HD1 LEU 26 -5.324 7.558 1.593 171 HD21 LEU 26 3HD2 LEU 26 -5.189 6.158 -0.432 172 HD22 LEU 26 1HD2 LEU 26 -4.992 7.634 -1.397 173 HD23 LEU 26 2HD2 LEU 26 -3.809 6.310 -1.536 174 H TYR 27 H TYR 27 -3.651 10.956 0.678 175 HA TYR 27 HA TYR 27 -1.533 13.049 0.404 176 HB3 TYR 27 2HB TYR 27 -3.334 14.544 1.284 177 HD1 TYR 27 2HD TYR 27 -4.645 12.343 -1.501 178 HD2 TYR 27 1HD TYR 27 -2.881 16.123 -0.373 179 HE1 TYR 27 2HE TYR 27 -4.842 13.136 -3.849 180 HE2 TYR 27 1HE TYR 27 -3.122 16.920 -2.728 181 HH TYR 27 HH TYR 27 -4.463 14.844 -5.320 182 HA PRO 28 HA PRO 28 -1.107 11.393 4.646 183 HB3 PRO 28 2HB PRO 28 0.786 10.294 3.908 184 HG3 PRO 28 2HG PRO 28 2.270 11.263 2.332 185 HD3 PRO 28 2HD PRO 28 0.227 11.325 1.183 186 H GLN 29 H GLN 29 -2.409 13.471 4.639 187 HA GLN 29 HA GLN 29 -0.941 15.758 5.858 188 HB3 GLN 29 2HB GLN 29 -2.190 16.574 4.054 189 HG3 GLN 29 2HG GLN 29 -4.563 14.913 5.015 190 HE21 GLN 29 2HE2 GLN 29 -4.966 15.666 1.825 191 HE22 GLN 29 1HE2 GLN 29 -5.991 17.082 2.005 192 H ILE 30 H ILE 30 -1.266 16.320 7.918 193 HA ILE 30 HA ILE 30 -2.495 14.340 9.655 194 HB ILE 30 HB ILE 30 -1.208 16.977 10.426 195 HG13 ILE 30 2HG1 ILE 30 0.850 15.573 10.900 196 HG21 ILE 30 1HG2 ILE 30 -2.538 15.896 12.218 197 HG22 ILE 30 2HG2 ILE 30 -1.581 14.414 12.031 198 HG23 ILE 30 3HG2 ILE 30 -0.814 15.904 12.585 199 HD11 ILE 30 3HD1 ILE 30 1.324 13.620 9.538 200 HD12 ILE 30 1HD1 ILE 30 -0.067 13.271 10.562 201 HD13 ILE 30 2HD1 ILE 30 -0.298 13.624 8.842 202 H GLY 31 H GLY 31 -4.601 14.287 9.561 203 HA2 GLY 31 2HA GLY 31 -6.336 15.951 11.021 204 H ASP 32 H ASP 32 -5.921 13.815 8.249 205 HA ASP 32 HA ASP 32 -8.597 12.584 8.587 206 HB3 ASP 32 2HB ASP 32 -8.260 11.742 6.365 207 H LYS 33 H LYS 33 -8.400 10.104 7.749 208 HA LYS 33 HA LYS 33 -5.970 8.788 8.684 209 HB3 LYS 33 2HB LYS 33 -7.210 8.575 10.725 210 HG3 LYS 33 2HG LYS 33 -9.521 7.885 8.964 211 HD3 LYS 33 2HD LYS 33 -8.889 6.487 11.575 212 HE3 LYS 33 2HE LYS 33 -11.407 7.874 10.892 213 HZ1 LYS 33 3HZ LYS 33 -12.788 6.042 11.650 214 HZ2 LYS 33 1HZ LYS 33 -12.062 5.646 10.245 215 HZ3 LYS 33 2HZ LYS 33 -11.521 5.012 11.652 216 H LEU 34 H LEU 34 -5.941 6.486 8.148 217 HA LEU 34 HA LEU 34 -7.623 5.696 5.862 218 HB3 LEU 34 2HB LEU 34 -6.099 6.607 4.496 219 HG LEU 34 HG LEU 34 -3.672 6.404 4.412 220 HD11 LEU 34 1HD1 LEU 34 -4.788 8.532 5.208 221 HD12 LEU 34 2HD1 LEU 34 -4.391 8.023 6.879 222 HD13 LEU 34 3HD1 LEU 34 -3.100 8.304 5.700 223 HD21 LEU 34 3HD2 LEU 34 -2.333 5.994 6.380 224 HD22 LEU 34 1HD2 LEU 34 -3.772 5.749 7.367 225 HD23 LEU 34 2HD2 LEU 34 -3.366 4.594 6.088 226 H ASP 35 H ASP 35 -8.247 3.731 6.058 227 HA ASP 35 HA ASP 35 -6.703 1.817 7.699 228 HB3 ASP 35 2HB ASP 35 -8.506 1.949 9.014 229 H ILE 36 H ILE 36 -5.637 0.514 6.454 230 HA ILE 36 HA ILE 36 -6.817 -0.505 3.961 231 HB ILE 36 HB ILE 36 -4.576 -0.300 3.746 232 HG13 ILE 36 2HG1 ILE 36 -3.677 -2.366 3.209 233 HG21 ILE 36 1HG2 ILE 36 -3.789 0.145 5.922 234 HG22 ILE 36 2HG2 ILE 36 -4.071 -1.533 6.430 235 HG23 ILE 36 3HG2 ILE 36 -2.807 -1.131 5.236 236 HD11 ILE 36 3HD1 ILE 36 -4.415 -4.532 3.916 237 HD12 ILE 36 1HD1 ILE 36 -3.937 -3.629 5.385 238 HD13 ILE 36 2HD1 ILE 36 -5.606 -3.911 5.007 239 H ILE 37 H ILE 37 -7.894 -2.240 3.678 240 HA ILE 37 HA ILE 37 -7.944 -4.446 5.658 241 HB ILE 37 HB ILE 37 -10.277 -2.989 4.360 242 HG13 ILE 37 2HG1 ILE 37 -9.432 -2.577 6.785 243 HG21 ILE 37 1HG2 ILE 37 -10.648 -5.295 3.653 244 HG22 ILE 37 2HG2 ILE 37 -10.353 -5.898 5.302 245 HG23 ILE 37 3HG2 ILE 37 -11.776 -4.906 4.926 246 HD11 ILE 37 3HD1 ILE 37 -11.651 -2.357 7.723 247 HD12 ILE 37 1HD1 ILE 37 -11.658 -1.837 6.033 248 HD13 ILE 37 2HD1 ILE 37 -12.333 -3.417 6.487 249 H CYS 38 H CYS 38 -7.542 -6.379 4.715 250 HA CYS 38 HA CYS 38 -8.279 -6.778 1.889 251 HB3 CYS 38 2HB CYS 38 -5.531 -7.313 2.994 252 HA PRO 39 HA PRO 39 -9.470 -10.622 3.911 253 HB3 PRO 39 2HB PRO 39 -11.475 -10.290 2.737 254 HG3 PRO 39 2HG PRO 39 -11.448 -9.581 0.436 255 HD3 PRO 39 2HD PRO 39 -10.202 -7.869 1.452 256 H LYS 40 H LYS 40 -9.373 -13.090 3.165 257 HA LYS 40 HA LYS 40 -7.004 -13.713 1.457 258 HB3 LYS 40 2HB LYS 40 -6.293 -13.240 3.842 259 HG3 LYS 40 2HG LYS 40 -8.429 -14.904 4.565 260 HD3 LYS 40 2HD LYS 40 -6.116 -16.386 5.730 261 HE3 LYS 40 2HE LYS 40 -8.894 -17.036 4.709 262 HZ1 LYS 40 3HZ LYS 40 -8.432 -19.305 5.435 263 HZ2 LYS 40 1HZ LYS 40 -7.464 -18.914 4.183 264 HZ3 LYS 40 2HZ LYS 40 -6.862 -18.960 5.705 265 H VAL 41 H VAL 41 -9.701 -14.218 0.920 266 HA VAL 41 HA VAL 41 -11.230 -15.779 0.304 267 HB VAL 41 HB VAL 41 -8.776 -17.350 0.187 268 HG11 VAL 41 1HG1 VAL 41 -9.722 -18.772 1.942 269 HG12 VAL 41 2HG1 VAL 41 -11.194 -19.003 0.977 270 HG13 VAL 41 3HG1 VAL 41 -9.632 -19.589 0.380 271 HG21 VAL 41 3HG2 VAL 41 -9.908 -18.386 -1.695 272 HG22 VAL 41 1HG2 VAL 41 -11.354 -17.394 -1.331 273 HG23 VAL 41 2HG2 VAL 41 -9.813 -16.636 -1.731 274 H ASP 42 H ASP 42 -12.841 -17.117 1.229 275 HA ASP 42 HA ASP 42 -12.858 -18.483 3.596 276 HB3 ASP 42 2HB ASP 42 -14.565 -16.777 4.836 277 H SER 43 H SER 43 -15.460 -16.148 2.832 278 HA SER 43 HA SER 43 -17.439 -18.175 2.472 279 HB3 SER 43 2HB SER 43 -18.785 -16.267 1.436 280 HG SER 43 HG SER 43 -18.940 -15.172 3.380 281 H LYS 44 H LYS 44 -15.433 -16.504 0.068 282 HA LYS 44 HA LYS 44 -16.826 -17.807 -2.192 283 HB3 LYS 44 2HB LYS 44 -15.269 -16.556 -3.595 284 HG3 LYS 44 2HG LYS 44 -15.598 -14.235 -2.877 285 HD3 LYS 44 2HD LYS 44 -17.952 -16.103 -2.576 286 HE3 LYS 44 2HE LYS 44 -18.136 -13.123 -2.025 287 HZ1 LYS 44 3HZ LYS 44 -20.409 -13.800 -1.413 288 HZ2 LYS 44 1HZ LYS 44 -20.113 -14.185 -2.968 289 HZ3 LYS 44 2HZ LYS 44 -20.111 -15.347 -1.824 290 H THR 45 H THR 45 -13.530 -18.004 -0.839 291 HA THR 45 HA THR 45 -11.860 -19.493 -1.052 292 HB THR 45 HB THR 45 -13.525 -20.648 0.386 293 HG1 THR 45 1HG THR 45 -12.106 -22.337 0.656 294 HG21 THR 45 3HG2 THR 45 -14.060 -23.011 -0.280 295 HG22 THR 45 1HG2 THR 45 -15.046 -21.750 -1.086 296 HG23 THR 45 2HG2 THR 45 -13.703 -22.554 -1.986 297 H VAL 46 H VAL 46 -13.440 -18.855 -3.662 298 HA VAL 46 HA VAL 46 -11.521 -20.180 -5.425 299 HB VAL 46 HB VAL 46 -13.512 -20.793 -7.009 300 HG11 VAL 46 1HG1 VAL 46 -11.957 -22.437 -6.149 301 HG12 VAL 46 2HG1 VAL 46 -12.902 -22.587 -4.639 302 HG13 VAL 46 3HG1 VAL 46 -13.619 -23.056 -6.206 303 HG21 VAL 46 3HG2 VAL 46 -15.589 -21.417 -6.029 304 HG22 VAL 46 1HG2 VAL 46 -14.970 -21.270 -4.396 305 HG23 VAL 46 2HG2 VAL 46 -15.265 -19.810 -5.364 306 H GLY 47 H GLY 47 -11.245 -17.629 -4.877 307 HA2 GLY 47 2HA GLY 47 -11.728 -16.345 -7.489 308 H GLN 48 H GLN 48 -11.095 -15.288 -4.111 309 HA GLN 48 HA GLN 48 -8.615 -13.907 -5.025 310 HB3 GLN 48 2HB GLN 48 -10.184 -12.429 -4.027 311 HG3 GLN 48 2HG GLN 48 -9.948 -13.042 -1.243 312 HE21 GLN 48 2HE2 GLN 48 -11.992 -12.842 -0.114 313 HE22 GLN 48 1HE2 GLN 48 -13.393 -12.204 -0.966 314 H TYR 49 H TYR 49 -8.461 -16.655 -4.914 315 HA TYR 49 HA TYR 49 -7.404 -17.683 -2.446 316 HB3 TYR 49 2HB TYR 49 -6.796 -18.664 -5.258 317 HD1 TYR 49 1HD TYR 49 -8.562 -20.218 -2.364 318 HD2 TYR 49 2HD TYR 49 -4.950 -20.173 -4.731 319 HE1 TYR 49 1HE TYR 49 -7.770 -22.274 -1.193 320 HE2 TYR 49 2HE TYR 49 -4.167 -22.235 -3.564 321 HH TYR 49 HH TYR 49 -4.629 -23.818 -2.003 322 H GLU 50 H GLU 50 -5.974 -15.799 -5.010 323 HA GLU 50 HA GLU 50 -3.193 -16.192 -4.306 324 HB3 GLU 50 2HB GLU 50 -3.657 -13.606 -5.506 325 HG3 GLU 50 2HG GLU 50 -1.812 -15.425 -5.924 326 H TYR 51 H TYR 51 -2.032 -13.818 -3.931 327 HA TYR 51 HA TYR 51 -3.192 -12.559 -1.491 328 HB3 TYR 51 2HB TYR 51 -1.595 -14.259 -0.792 329 HD1 TYR 51 2HD TYR 51 0.834 -11.619 -1.782 330 HD2 TYR 51 1HD TYR 51 -0.322 -15.760 -2.211 331 HE1 TYR 51 2HE TYR 51 2.965 -12.107 -2.959 332 HE2 TYR 51 1HE TYR 51 1.847 -16.236 -3.363 333 HH TYR 51 HH TYR 51 4.253 -13.650 -3.995 334 H TYR 52 H TYR 52 -1.975 -10.487 -0.917 335 HA TYR 52 HA TYR 52 -0.732 -9.195 -3.307 336 HB3 TYR 52 2HB TYR 52 -1.742 -7.004 -2.458 337 HD1 TYR 52 1HD TYR 52 -1.638 -7.154 -4.935 338 HD2 TYR 52 2HD TYR 52 -4.766 -9.026 -2.634 339 HE1 TYR 52 1HE TYR 52 -3.029 -7.371 -7.003 340 HE2 TYR 52 2HE TYR 52 -6.142 -9.271 -4.702 341 HH TYR 52 HH TYR 52 -6.222 -8.981 -6.955 342 H LYS 53 H LYS 53 0.832 -7.627 -2.904 343 HA LYS 53 HA LYS 53 1.897 -7.326 -0.183 344 HB3 LYS 53 2HB LYS 53 2.876 -9.402 -0.672 345 HG3 LYS 53 2HG LYS 53 3.716 -8.318 -3.398 346 HD3 LYS 53 2HD LYS 53 4.574 -10.883 -2.005 347 HE3 LYS 53 2HE LYS 53 5.315 -9.646 -4.714 348 HZ1 LYS 53 3HZ LYS 53 6.509 -11.764 -4.969 349 HZ2 LYS 53 1HZ LYS 53 7.105 -10.943 -3.689 350 HZ3 LYS 53 2HZ LYS 53 6.133 -12.225 -3.451 351 H VAL 54 H VAL 54 1.865 -5.206 -0.128 352 HA VAL 54 HA VAL 54 2.860 -3.603 -2.441 353 HB VAL 54 HB VAL 54 0.624 -3.217 -0.776 354 HG11 VAL 54 1HG1 VAL 54 2.134 -2.204 0.993 355 HG12 VAL 54 2HG1 VAL 54 2.506 -0.915 -0.158 356 HG13 VAL 54 3HG1 VAL 54 0.834 -1.182 0.384 357 HG21 VAL 54 3HG2 VAL 54 0.497 -0.994 -2.010 358 HG22 VAL 54 1HG2 VAL 54 2.064 -1.421 -2.744 359 HG23 VAL 54 2HG2 VAL 54 0.644 -2.441 -3.006 360 H TYR 55 H TYR 55 4.523 -2.111 -2.213 361 HA TYR 55 HA TYR 55 5.974 -2.019 0.383 362 HB3 TYR 55 2HB TYR 55 8.082 -2.560 -0.761 363 HD1 TYR 55 2HD TYR 55 7.877 -4.319 1.005 364 HD2 TYR 55 1HD TYR 55 5.918 -4.753 -2.803 365 HE1 TYR 55 2HE TYR 55 7.589 -6.792 1.389 366 HE2 TYR 55 1HE TYR 55 5.748 -7.191 -2.460 367 HH TYR 55 HH TYR 55 6.998 -8.742 0.567 368 H MET 56 H MET 56 7.370 -0.228 0.625 369 HA MET 56 HA MET 56 6.774 2.104 -1.089 370 HB3 MET 56 2HB MET 56 8.625 3.065 0.621 371 HG3 MET 56 2HG MET 56 5.892 2.581 1.796 372 HE1 MET 56 3HE MET 56 7.153 5.176 4.390 373 HE2 MET 56 1HE MET 56 5.808 4.072 4.063 374 HE3 MET 56 2HE MET 56 7.490 3.478 3.984 375 H VAL 57 H VAL 57 8.095 3.035 -2.544 376 HA VAL 57 HA VAL 57 10.911 2.306 -2.849 377 HB VAL 57 HB VAL 57 9.128 1.689 -5.232 378 HG11 VAL 57 1HG1 VAL 57 11.641 1.908 -5.440 379 HG12 VAL 57 2HG1 VAL 57 11.792 0.519 -4.382 380 HG13 VAL 57 3HG1 VAL 57 10.995 0.350 -5.964 381 HG21 VAL 57 3HG2 VAL 57 9.170 -0.710 -4.766 382 HG22 VAL 57 1HG2 VAL 57 9.961 -0.454 -3.216 383 HG23 VAL 57 2HG2 VAL 57 8.295 0.108 -3.500 384 H ASP 58 H ASP 58 11.924 3.671 -4.626 385 HA ASP 58 HA ASP 58 10.930 6.368 -4.771 386 HB3 ASP 58 2HB ASP 58 12.724 6.725 -6.347 387 H LYS 59 H LYS 59 10.089 7.549 -6.566 388 HA LYS 59 HA LYS 59 8.057 6.403 -8.165 389 HB3 LYS 59 2HB LYS 59 9.712 8.912 -8.703 390 HG3 LYS 59 2HG LYS 59 7.037 9.270 -9.549 391 HD3 LYS 59 2HD LYS 59 9.283 10.188 -10.531 392 HE3 LYS 59 2HE LYS 59 8.562 8.072 -12.616 393 HZ1 LYS 59 3HZ LYS 59 10.631 8.846 -13.602 394 HZ2 LYS 59 1HZ LYS 59 9.686 10.150 -13.356 395 HZ3 LYS 59 2HZ LYS 59 10.940 9.843 -12.358 396 H ASP 60 H ASP 60 11.446 7.052 -9.061 397 HA ASP 60 HA ASP 60 11.202 6.259 -11.780 398 HB3 ASP 60 2HB ASP 60 13.760 5.873 -10.203 399 H GLN 61 H GLN 61 12.086 4.364 -8.916 400 HA GLN 61 HA GLN 61 12.536 1.826 -10.257 401 HB3 GLN 61 2HB GLN 61 12.349 0.968 -7.874 402 HG3 GLN 61 2HG GLN 61 14.182 2.355 -6.855 403 HE21 GLN 61 2HE2 GLN 61 15.655 3.084 -9.767 404 HE22 GLN 61 1HE2 GLN 61 16.364 1.502 -10.075 405 H ALA 62 H ALA 62 9.720 3.199 -8.447 406 HA ALA 62 HA ALA 62 7.962 1.010 -8.848 407 HB1 ALA 62 3HB ALA 62 6.234 2.635 -8.242 408 HB2 ALA 62 1HB ALA 62 7.648 2.816 -7.195 409 HB3 ALA 62 2HB ALA 62 7.370 3.979 -8.511 410 H ASP 63 H ASP 63 8.654 3.828 -10.991 411 HA ASP 63 HA ASP 63 6.671 3.122 -12.950 412 HB3 ASP 63 2HB ASP 63 9.237 4.686 -13.443 413 H ARG 64 H ARG 64 10.073 2.170 -12.526 414 HA ARG 64 HA ARG 64 10.246 0.543 -14.929 415 HB3 ARG 64 2HB ARG 64 12.114 -0.622 -13.541 416 HG3 ARG 64 2HG ARG 64 13.585 1.438 -13.399 417 HD3 ARG 64 2HD ARG 64 13.009 1.980 -16.017 418 HE ARG 64 HE ARG 64 14.926 0.444 -14.819 419 HH11 ARG 64 1HH2 ARG 64 12.995 -0.143 -17.666 420 HH12 ARG 64 2HH2 ARG 64 14.271 -0.996 -18.488 421 HH21 ARG 64 1HH1 ARG 64 16.548 -0.626 -15.922 422 HH22 ARG 64 2HH1 ARG 64 16.249 -1.253 -17.510 423 H CYS 65 H CYS 65 8.223 0.206 -12.351 424 HA CYS 65 HA CYS 65 7.059 -1.426 -11.389 425 HB3 CYS 65 2HB CYS 65 6.537 -3.474 -12.679 426 H THR 66 H THR 66 9.884 -1.143 -10.693 427 HA THR 66 HA THR 66 10.360 -3.905 -9.715 428 HB THR 66 HB THR 66 12.754 -3.419 -9.620 429 HG1 THR 66 1HG THR 66 13.526 -1.592 -10.667 430 HG21 THR 66 3HG2 THR 66 13.231 -3.485 -12.039 431 HG22 THR 66 1HG2 THR 66 11.775 -4.450 -11.734 432 HG23 THR 66 2HG2 THR 66 11.627 -2.825 -12.391 433 H ILE 67 H ILE 67 10.991 -4.220 -7.660 434 HA ILE 67 HA ILE 67 10.455 -1.982 -5.758 435 HB ILE 67 HB ILE 67 10.045 -4.961 -5.315 436 HG13 ILE 67 2HG1 ILE 67 8.359 -4.336 -6.799 437 HG21 ILE 67 1HG2 ILE 67 10.670 -3.777 -3.218 438 HG22 ILE 67 2HG2 ILE 67 9.302 -2.675 -3.475 439 HG23 ILE 67 3HG2 ILE 67 9.040 -4.397 -3.192 440 HD11 ILE 67 3HD1 ILE 67 6.260 -4.329 -5.691 441 HD12 ILE 67 1HD1 ILE 67 7.323 -5.246 -4.616 442 HD13 ILE 67 2HD1 ILE 67 6.913 -3.540 -4.275 443 H LYS 68 H LYS 68 11.833 -1.621 -4.095 444 HA LYS 68 HA LYS 68 14.621 -2.480 -4.542 445 HB3 LYS 68 2HB LYS 68 14.983 -0.824 -2.575 446 HG3 LYS 68 2HG LYS 68 14.047 1.172 -4.086 447 HD3 LYS 68 2HD LYS 68 15.936 0.350 -5.889 448 HE3 LYS 68 2HE LYS 68 17.199 1.217 -3.361 449 HZ1 LYS 68 3HZ LYS 68 17.715 3.139 -4.761 450 HZ2 LYS 68 1HZ LYS 68 18.043 1.773 -5.587 451 HZ3 LYS 68 2HZ LYS 68 16.698 2.647 -5.922 452 H LYS 69 H LYS 69 15.544 -4.138 -3.582 453 HA LYS 69 HA LYS 69 14.355 -5.798 -1.622 454 HB3 LYS 69 2HB LYS 69 16.160 -6.570 -3.085 455 HG3 LYS 69 2HG LYS 69 17.714 -4.383 -1.731 456 HD3 LYS 69 2HD LYS 69 19.066 -6.945 -2.634 457 HE3 LYS 69 2HE LYS 69 20.051 -4.431 -1.190 458 HZ1 LYS 69 3HZ LYS 69 22.227 -5.385 -1.638 459 HZ2 LYS 69 1HZ LYS 69 21.362 -6.457 -0.769 460 HZ3 LYS 69 2HZ LYS 69 21.583 -6.688 -2.371 461 H GLU 70 H GLU 70 15.894 -2.777 -1.118 462 HA GLU 70 HA GLU 70 16.511 -3.069 1.706 463 HB3 GLU 70 2HB GLU 70 16.586 -0.599 1.662 464 HG3 GLU 70 2HG GLU 70 17.948 -1.595 -0.859 465 H ASN 71 H ASN 71 13.506 -2.959 0.029 466 HA ASN 71 HA ASN 71 12.081 -2.229 2.538 467 HB3 ASN 71 2HB ASN 71 10.158 -1.790 0.884 468 HD21 ASN 71 2HD2 ASN 71 10.137 0.027 2.317 469 HD22 ASN 71 1HD2 ASN 71 11.146 1.430 2.000 470 H THR 72 H THR 72 10.175 -3.378 2.941 471 HA THR 72 HA THR 72 9.394 -5.911 1.938 472 HB THR 72 HB THR 72 11.685 -6.024 3.778 473 HG1 THR 72 1HG THR 72 11.883 -7.943 2.622 474 HG21 THR 72 3HG2 THR 72 10.944 -8.204 4.747 475 HG22 THR 72 1HG2 THR 72 10.026 -6.850 5.401 476 HG23 THR 72 2HG2 THR 72 9.298 -7.887 4.153 477 HA PRO 73 HA PRO 73 7.043 -4.881 5.909 478 HB3 PRO 73 2HB PRO 73 8.480 -4.542 7.668 479 HG3 PRO 73 2HG PRO 73 10.479 -3.372 7.424 480 HD3 PRO 73 2HD PRO 73 10.823 -4.509 5.475 481 H LEU 74 H LEU 74 5.326 -4.132 4.816 482 HA LEU 74 HA LEU 74 4.662 -1.379 5.179 483 HB3 LEU 74 2HB LEU 74 4.209 -1.934 2.278 484 HG LEU 74 HG LEU 74 5.006 0.282 1.898 485 HD11 LEU 74 1HD1 LEU 74 2.675 0.065 2.691 486 HD12 LEU 74 2HD1 LEU 74 3.225 0.353 4.358 487 HD13 LEU 74 3HD1 LEU 74 3.410 1.616 3.127 488 HD21 LEU 74 3HD2 LEU 74 5.756 1.761 3.746 489 HD22 LEU 74 1HD2 LEU 74 5.768 0.397 4.844 490 HD23 LEU 74 2HD2 LEU 74 6.865 0.408 3.454 491 H LEU 75 H LEU 75 3.607 -3.996 2.897 492 HA LEU 75 HA LEU 75 1.308 -4.617 4.577 493 HB3 LEU 75 2HB LEU 75 0.632 -3.639 1.767 494 HG LEU 75 HG LEU 75 -1.355 -2.679 2.928 495 HD11 LEU 75 1HD1 LEU 75 -1.454 -4.749 1.594 496 HD12 LEU 75 2HD1 LEU 75 -1.164 -5.706 3.071 497 HD13 LEU 75 3HD1 LEU 75 -2.616 -4.716 2.902 498 HD21 LEU 75 3HD2 LEU 75 -1.962 -3.242 5.101 499 HD22 LEU 75 1HD2 LEU 75 -0.814 -4.576 5.225 500 HD23 LEU 75 2HD2 LEU 75 -0.272 -2.881 5.263 501 H ASN 76 H ASN 76 0.758 -6.711 4.328 502 HA ASN 76 HA ASN 76 1.079 -8.113 1.771 503 HB3 ASN 76 2HB ASN 76 2.718 -8.730 4.247 504 HD21 ASN 76 2HD2 ASN 76 3.758 -10.692 4.440 505 HD22 ASN 76 1HD2 ASN 76 3.381 -12.076 3.423 506 H CYS 77 H CYS 77 -0.977 -8.821 1.583 507 HA CYS 77 HA CYS 77 -2.258 -10.195 3.921 508 HB3 CYS 77 2HB CYS 77 -3.685 -8.474 3.343 509 H ALA 78 H ALA 78 -1.582 -12.196 3.808 510 HA ALA 78 HA ALA 78 -2.172 -13.851 1.422 511 HB1 ALA 78 3HB ALA 78 0.091 -14.777 1.465 512 HB2 ALA 78 1HB ALA 78 0.243 -13.017 1.374 513 HB3 ALA 78 2HB ALA 78 0.494 -13.832 2.923 514 H LYS 79 H LYS 79 -1.803 -16.247 2.009 515 HA LYS 79 HA LYS 79 -3.407 -16.976 4.192 516 HB3 LYS 79 2HB LYS 79 -1.392 -19.008 3.262 517 HG3 LYS 79 2HG LYS 79 -4.117 -19.579 2.518 518 HD3 LYS 79 2HD LYS 79 -3.982 -21.231 4.484 519 HE3 LYS 79 2HE LYS 79 -2.419 -21.163 1.994 520 HZ1 LYS 79 3HZ LYS 79 -1.091 -23.126 2.647 521 HZ2 LYS 79 1HZ LYS 79 -0.590 -21.795 3.435 522 HZ3 LYS 79 2HZ LYS 79 -1.488 -22.916 4.211 523 HA PRO 80 HA PRO 80 0.279 -17.666 7.080 524 HB3 PRO 80 2HB PRO 80 2.158 -18.384 5.954 525 HG3 PRO 80 2HG PRO 80 2.779 -17.467 3.870 526 HD3 PRO 80 2HD PRO 80 0.567 -17.929 3.423 527 H ASP 81 H ASP 81 -1.436 -15.488 6.763 528 HA ASP 81 HA ASP 81 -0.456 -13.713 8.770 529 HB3 ASP 81 2HB ASP 81 -1.187 -11.943 6.524 530 H GLN 82 H GLN 82 -2.962 -14.653 6.525 531 HA GLN 82 HA GLN 82 -5.160 -14.747 6.606 532 HB3 GLN 82 2HB GLN 82 -5.301 -13.807 9.469 533 HG3 GLN 82 2HG GLN 82 -6.680 -16.297 8.716 534 HE21 GLN 82 2HE2 GLN 82 -8.773 -16.463 9.720 535 HE22 GLN 82 1HE2 GLN 82 -9.364 -15.202 10.797 536 H ASP 83 H ASP 83 -7.050 -12.901 8.081 537 HA ASP 83 HA ASP 83 -7.243 -10.875 6.083 538 HB3 ASP 83 2HB ASP 83 -8.546 -9.800 8.254 539 H ILE 84 H ILE 84 -6.033 -9.110 5.805 540 HA ILE 84 HA ILE 84 -4.392 -8.139 8.104 541 HB ILE 84 HB ILE 84 -3.552 -8.772 5.529 542 HG13 ILE 84 2HG1 ILE 84 -2.244 -7.045 7.683 543 HG21 ILE 84 1HG2 ILE 84 -4.492 -6.606 4.698 544 HG22 ILE 84 2HG2 ILE 84 -3.384 -5.756 5.801 545 HG23 ILE 84 3HG2 ILE 84 -2.748 -6.757 4.492 546 HD11 ILE 84 3HD1 ILE 84 -0.918 -9.109 8.054 547 HD12 ILE 84 1HD1 ILE 84 -2.629 -9.376 8.409 548 HD13 ILE 84 2HD1 ILE 84 -1.939 -9.967 6.885 549 H LYS 85 H LYS 85 -4.716 -6.323 9.011 550 HA LYS 85 HA LYS 85 -6.373 -4.236 7.794 551 HB3 LYS 85 2HB LYS 85 -8.056 -5.647 8.781 552 HG3 LYS 85 2HG LYS 85 -6.251 -6.207 10.876 553 HD3 LYS 85 2HD LYS 85 -8.728 -4.795 11.946 554 HE3 LYS 85 2HE LYS 85 -7.701 -6.804 13.212 555 HZ1 LYS 85 3HZ LYS 85 -5.778 -6.201 14.555 556 HZ2 LYS 85 1HZ LYS 85 -5.347 -6.046 12.989 557 HZ3 LYS 85 2HZ LYS 85 -5.675 -4.722 13.885 558 H PHE 86 H PHE 86 -5.522 -2.379 8.173 559 HA PHE 86 HA PHE 86 -3.953 -1.820 10.632 560 HB3 PHE 86 2HB PHE 86 -2.452 -0.739 8.446 561 HD1 PHE 86 1HD PHE 86 -1.607 -0.322 10.944 562 HD2 PHE 86 2HD PHE 86 -1.221 -4.038 8.748 563 HE1 PHE 86 1HE PHE 86 0.274 -1.014 12.423 564 HE2 PHE 86 2HE PHE 86 0.668 -4.706 10.230 565 HZ PHE 86 HZ PHE 86 1.424 -3.196 12.065 566 H THR 87 H THR 87 -4.696 0.025 11.419 567 HA THR 87 HA THR 87 -5.606 2.144 9.510 568 HB THR 87 HB THR 87 -7.446 1.182 10.816 569 HG1 THR 87 1HG THR 87 -8.263 3.198 11.147 570 HG21 THR 87 3HG2 THR 87 -7.816 1.715 13.117 571 HG22 THR 87 1HG2 THR 87 -6.286 0.833 13.035 572 HG23 THR 87 2HG2 THR 87 -6.285 2.602 13.239 573 H ILE 88 H ILE 88 -4.645 4.015 9.550 574 HA ILE 88 HA ILE 88 -2.851 4.713 11.854 575 HB ILE 88 HB ILE 88 -2.351 4.801 8.898 576 HG13 ILE 88 2HG1 ILE 88 -1.260 3.157 10.334 577 HG21 ILE 88 1HG2 ILE 88 -2.325 7.224 9.396 578 HG22 ILE 88 2HG2 ILE 88 -1.217 6.942 10.758 579 HG23 ILE 88 3HG2 ILE 88 -0.726 6.641 9.075 580 HD11 ILE 88 3HD1 ILE 88 1.060 3.454 9.818 581 HD12 ILE 88 1HD1 ILE 88 0.145 4.133 8.459 582 HD13 ILE 88 2HD1 ILE 88 0.901 5.200 9.666 583 H LYS 89 H LYS 89 -3.705 6.234 13.003 584 HA LYS 89 HA LYS 89 -5.563 8.213 11.838 585 HB3 LYS 89 2HB LYS 89 -5.386 9.128 14.260 586 HG3 LYS 89 2HG LYS 89 -7.062 7.229 13.076 587 HD3 LYS 89 2HD LYS 89 -5.758 5.557 14.781 588 HE3 LYS 89 2HE LYS 89 -7.448 7.316 16.471 589 HZ1 LYS 89 3HZ LYS 89 -8.358 5.483 17.756 590 HZ2 LYS 89 1HZ LYS 89 -8.956 5.402 16.247 591 HZ3 LYS 89 2HZ LYS 89 -7.777 4.373 16.717 592 H PHE 90 H PHE 90 -5.217 10.414 11.858 593 HA PHE 90 HA PHE 90 -3.007 11.494 10.721 594 HB3 PHE 90 2HB PHE 90 -5.093 12.729 11.007 595 HD1 PHE 90 2HD PHE 90 -6.756 11.695 12.613 596 HD2 PHE 90 1HD PHE 90 -3.620 14.395 13.882 597 HE1 PHE 90 2HE PHE 90 -7.859 11.968 14.842 598 HE2 PHE 90 1HE PHE 90 -4.724 14.635 16.092 599 HZ PHE 90 HZ PHE 90 -6.821 13.378 16.592 600 H GLN 91 H GLN 91 -3.535 11.435 14.247 601 HA GLN 91 HA GLN 91 -0.636 11.954 14.726 602 HB3 GLN 91 2HB GLN 91 -3.007 12.144 16.621 603 HG3 GLN 91 2HG GLN 91 -0.186 13.252 16.961 604 HE21 GLN 91 2HE2 GLN 91 0.217 14.086 19.100 605 HE22 GLN 91 1HE2 GLN 91 -1.116 14.459 20.192 606 H GLU 92 H GLU 92 0.478 10.188 15.003 607 HA GLU 92 HA GLU 92 -0.400 8.178 16.933 608 HB3 GLU 92 2HB GLU 92 0.469 7.177 14.191 609 HG3 GLU 92 2HG GLU 92 0.628 5.596 16.184 610 H PHE 93 H PHE 93 1.268 9.757 17.771 611 HA PHE 93 HA PHE 93 4.019 9.501 17.136 612 HB3 PHE 93 2HB PHE 93 3.005 11.239 18.631 613 HD1 PHE 93 1HD PHE 93 4.543 8.989 21.137 614 HD2 PHE 93 2HD PHE 93 0.878 10.914 19.863 615 HE1 PHE 93 1HE PHE 93 3.465 8.381 23.300 616 HE2 PHE 93 2HE PHE 93 -0.186 10.295 22.031 617 HZ PHE 93 HZ PHE 93 1.091 9.007 23.739 618 H SER 94 H SER 94 5.669 8.184 17.931 619 HA SER 94 HA SER 94 4.884 5.760 19.463 620 HB3 SER 94 2HB SER 94 6.279 4.393 17.953 621 HG SER 94 HG SER 94 4.849 4.396 16.160 622 HA PRO 95 HA PRO 95 8.652 7.040 21.436 623 HB3 PRO 95 2HB PRO 95 7.902 6.126 23.382 624 HG3 PRO 95 2HG PRO 95 6.483 4.255 23.383 625 HD3 PRO 95 2HD PRO 95 5.432 5.369 21.652 626 H ASN 96 H ASN 96 8.485 4.093 19.501 627 HA ASN 96 HA ASN 96 11.191 4.571 18.575 628 HB3 ASN 96 2HB ASN 96 10.900 1.789 19.732 629 HD21 ASN 96 2HD2 ASN 96 13.196 3.008 21.519 630 HD22 ASN 96 1HD2 ASN 96 14.570 2.985 20.419 631 H LEU 97 H LEU 97 9.179 4.818 16.900 632 HA LEU 97 HA LEU 97 9.523 2.643 14.974 633 HB3 LEU 97 2HB LEU 97 6.646 2.927 15.122 634 HG LEU 97 HG LEU 97 8.632 0.703 15.351 635 HD11 LEU 97 1HD1 LEU 97 7.452 0.395 17.483 636 HD12 LEU 97 2HD1 LEU 97 5.883 0.477 16.660 637 HD13 LEU 97 3HD1 LEU 97 6.996 -0.867 16.336 638 HD21 LEU 97 3HD2 LEU 97 6.987 -0.432 13.922 639 HD22 LEU 97 1HD2 LEU 97 5.827 0.884 14.150 640 HD23 LEU 97 2HD2 LEU 97 7.348 1.170 13.276 641 H TRP 98 H TRP 98 10.057 3.776 13.215 642 HA TRP 98 HA TRP 98 8.749 6.282 12.429 643 HB3 TRP 98 2HB TRP 98 11.158 5.834 12.052 644 HD1 TRP 98 HD TRP 98 9.946 4.434 8.707 645 HE1 TRP 98 1HE TRP 98 11.160 2.237 8.182 646 HE3 TRP 98 3HE TRP 98 12.521 3.827 13.116 647 HZ2 TRP 98 2HZ TRP 98 12.956 0.438 9.481 648 HZ3 TRP 98 3HZ TRP 98 13.987 1.844 13.432 649 HH2 TRP 98 HH TRP 98 14.207 0.153 11.626 650 H GLY 99 H GLY 99 7.445 3.339 12.421 651 HA2 GLY 99 2HA GLY 99 6.419 3.153 9.684 652 H LEU 100 H LEU 100 4.907 3.888 12.877 653 HA LEU 100 HA LEU 100 2.483 4.934 11.560 654 HB3 LEU 100 2HB LEU 100 1.530 5.065 13.688 655 HG LEU 100 HG LEU 100 3.413 2.693 14.055 656 HD11 LEU 100 1HD1 LEU 100 2.042 3.462 16.046 657 HD12 LEU 100 2HD1 LEU 100 0.581 3.072 15.102 658 HD13 LEU 100 3HD1 LEU 100 1.746 1.793 15.515 659 HD21 LEU 100 3HD2 LEU 100 1.607 1.321 13.059 660 HD22 LEU 100 1HD2 LEU 100 0.712 2.790 12.648 661 HD23 LEU 100 2HD2 LEU 100 2.274 2.450 11.890 662 H GLU 101 H GLU 101 5.312 6.264 13.323 663 HA GLU 101 HA GLU 101 4.436 9.036 12.968 664 HB3 GLU 101 2HB GLU 101 6.903 9.512 13.413 665 HG3 GLU 101 2HG GLU 101 5.569 7.880 15.598 666 H PHE 102 H PHE 102 4.554 10.222 11.210 667 HA PHE 102 HA PHE 102 6.444 9.533 8.991 668 HB3 PHE 102 2HB PHE 102 3.464 9.849 9.043 669 HD1 PHE 102 1HD PHE 102 3.201 12.281 8.607 670 HD2 PHE 102 2HD PHE 102 5.120 9.622 5.784 671 HE1 PHE 102 1HE PHE 102 2.980 14.009 6.829 672 HE2 PHE 102 2HE PHE 102 4.884 11.357 4.009 673 HZ PHE 102 HZ PHE 102 3.848 13.560 4.538 674 H GLN 103 H GLN 103 7.169 11.320 7.756 675 HA GLN 103 HA GLN 103 6.901 13.966 9.132 676 HB3 GLN 103 2HB GLN 103 9.160 14.477 8.280 677 HG3 GLN 103 2HG GLN 103 10.496 13.067 9.794 678 HE21 GLN 103 2HE2 GLN 103 10.103 15.416 10.481 679 HE22 GLN 103 1HE2 GLN 103 9.108 15.643 11.914 680 H LYS 104 H LYS 104 6.028 15.519 7.921 681 HA LYS 104 HA LYS 104 5.496 15.335 5.078 682 HB3 LYS 104 2HB LYS 104 4.104 16.557 6.707 683 HG3 LYS 104 2HG LYS 104 6.540 17.907 7.446 684 HD3 LYS 104 2HD LYS 104 4.407 19.725 6.216 685 HE3 LYS 104 2HE LYS 104 6.039 21.541 7.063 686 HZ1 LYS 104 3HZ LYS 104 4.979 21.589 9.248 687 HZ2 LYS 104 1HZ LYS 104 3.879 21.230 8.104 688 HZ3 LYS 104 2HZ LYS 104 4.450 20.057 9.091 689 H ASN 105 H ASN 105 6.056 17.525 3.848 690 HA ASN 105 HA ASN 105 7.533 18.385 2.405 691 HB3 ASN 105 2HB ASN 105 9.537 18.490 4.671 692 HD21 ASN 105 2HD2 ASN 105 11.209 20.056 4.324 693 HD22 ASN 105 1HD2 ASN 105 11.500 20.731 2.722 694 H LYS 106 H LYS 106 7.143 15.635 2.502 695 HA LYS 106 HA LYS 106 9.529 14.718 1.043 696 HB3 LYS 106 2HB LYS 106 8.836 12.393 2.394 697 HG3 LYS 106 2HG LYS 106 10.974 14.199 3.538 698 HD3 LYS 106 2HD LYS 106 10.770 11.233 2.831 699 HE3 LYS 106 2HE LYS 106 13.184 12.092 4.268 700 HZ1 LYS 106 3HZ LYS 106 14.217 10.785 2.486 701 HZ2 LYS 106 1HZ LYS 106 12.951 9.962 3.104 702 HZ3 LYS 106 2HZ LYS 106 12.817 10.709 1.654 703 H ASP 107 H ASP 107 9.058 13.747 -0.722 704 HA ASP 107 HA ASP 107 6.330 12.693 -1.250 705 HB3 ASP 107 2HB ASP 107 7.308 14.159 -2.934 706 H TYR 108 H TYR 108 6.003 10.537 -1.835 707 HA TYR 108 HA TYR 108 8.221 8.625 -1.816 708 HB3 TYR 108 2HB TYR 108 6.191 7.318 -0.329 709 HD1 TYR 108 2HD TYR 108 8.948 6.591 -1.009 710 HD2 TYR 108 1HD TYR 108 7.375 8.629 2.468 711 HE1 TYR 108 2HE TYR 108 10.847 5.746 0.344 712 HE2 TYR 108 1HE TYR 108 9.278 7.749 3.828 713 HH TYR 108 HH TYR 108 11.820 5.657 2.392 714 H TYR 109 H TYR 109 7.546 6.550 -2.654 715 HA TYR 109 HA TYR 109 4.975 6.554 -4.105 716 HB3 TYR 109 2HB TYR 109 6.943 5.108 -5.617 717 HD1 TYR 109 2HD TYR 109 6.231 8.779 -5.858 718 HD2 TYR 109 1HD TYR 109 5.394 4.841 -7.413 719 HE1 TYR 109 2HE TYR 109 5.058 9.798 -7.809 720 HE2 TYR 109 1HE TYR 109 4.206 5.864 -9.360 721 HH TYR 109 HH TYR 109 3.962 9.422 -9.765 722 H ILE 110 H ILE 110 4.168 4.546 -4.516 723 HA ILE 110 HA ILE 110 5.309 2.233 -2.970 724 HB ILE 110 HB ILE 110 2.494 3.302 -3.083 725 HG13 ILE 110 2HG1 ILE 110 4.095 2.242 -0.700 726 HG21 ILE 110 1HG2 ILE 110 2.131 1.000 -3.644 727 HG22 ILE 110 2HG2 ILE 110 3.150 0.488 -2.264 728 HG23 ILE 110 3HG2 ILE 110 1.587 1.291 -2.012 729 HD11 ILE 110 3HD1 ILE 110 3.795 4.487 0.331 730 HD12 ILE 110 1HD1 ILE 110 4.884 4.482 -1.053 731 HD13 ILE 110 2HD1 ILE 110 3.273 5.147 -1.221 732 H ILE 111 H ILE 111 4.804 0.188 -3.836 733 HA ILE 111 HA ILE 111 3.509 -0.021 -6.436 734 HB ILE 111 HB ILE 111 5.518 0.460 -7.449 735 HG13 ILE 111 2HG1 ILE 111 4.718 -1.754 -8.204 736 HG21 ILE 111 1HG2 ILE 111 6.904 0.775 -5.510 737 HG22 ILE 111 2HG2 ILE 111 6.970 -0.982 -5.231 738 HG23 ILE 111 3HG2 ILE 111 7.767 -0.223 -6.645 739 HD11 ILE 111 3HD1 ILE 111 6.676 -2.585 -9.297 740 HD12 ILE 111 1HD1 ILE 111 6.686 -0.809 -9.327 741 HD13 ILE 111 2HD1 ILE 111 7.755 -1.704 -8.221 742 H SER 112 H SER 112 2.836 -2.091 -6.901 743 HA SER 112 HA SER 112 3.319 -4.200 -4.818 744 HB3 SER 112 2HB SER 112 0.855 -4.501 -6.371 745 HG SER 112 HG SER 112 0.059 -4.453 -4.101 746 H THR 113 H THR 113 3.669 -6.337 -5.628 747 HA THR 113 HA THR 113 3.737 -6.689 -8.563 748 HB THR 113 HB THR 113 6.021 -7.830 -8.335 749 HG1 THR 113 1HG THR 113 7.218 -6.900 -6.582 750 HG21 THR 113 3HG2 THR 113 7.246 -5.783 -8.632 751 HG22 THR 113 1HG2 THR 113 5.677 -5.592 -9.411 752 HG23 THR 113 2HG2 THR 113 5.973 -4.840 -7.851 753 H SER 114 H SER 114 1.807 -7.726 -6.806 754 HA SER 114 HA SER 114 2.289 -10.437 -6.073 755 HB3 SER 114 2HB SER 114 0.531 -9.090 -5.095 756 HG SER 114 HG SER 114 -1.393 -8.840 -6.515 757 H ASN 115 H ASN 115 1.389 -9.166 -9.251 758 HA ASN 115 HA ASN 115 0.353 -11.592 -10.376 759 HB3 ASN 115 2HB ASN 115 2.002 -9.603 -11.951 760 HD21 ASN 115 2HD2 ASN 115 1.125 -9.100 -14.036 761 HD22 ASN 115 1HD2 ASN 115 0.070 -10.257 -14.831 762 H GLY 116 H GLY 116 3.566 -10.772 -9.417 763 HA2 GLY 116 2HA GLY 116 5.659 -11.635 -9.814 764 H SER 117 H SER 117 5.089 -10.730 -12.259 765 HA SER 117 HA SER 117 4.722 -12.339 -14.435 766 HB3 SER 117 2HB SER 117 5.808 -10.703 -15.749 767 HG SER 117 HG SER 117 5.129 -8.750 -14.828 768 H LEU 118 H LEU 118 5.972 -13.623 -15.847 769 HA LEU 118 HA LEU 118 8.025 -15.145 -14.693 770 HB3 LEU 118 2HB LEU 118 7.674 -14.756 -17.693 771 HG LEU 118 HG LEU 118 7.951 -17.131 -17.918 772 HD11 LEU 118 1HD1 LEU 118 10.067 -15.688 -17.792 773 HD12 LEU 118 2HD1 LEU 118 10.292 -16.364 -16.150 774 HD13 LEU 118 3HD1 LEU 118 10.264 -17.442 -17.558 775 HD21 LEU 118 3HD2 LEU 118 8.517 -18.636 -16.096 776 HD22 LEU 118 1HD2 LEU 118 8.419 -17.323 -14.926 777 HD23 LEU 118 2HD2 LEU 118 6.970 -17.858 -15.784 778 H GLU 119 H GLU 119 8.335 -12.308 -16.853 779 HA GLU 119 HA GLU 119 11.200 -12.246 -16.995 780 HB3 GLU 119 2HB GLU 119 10.958 -9.902 -17.597 781 HG3 GLU 119 2HG GLU 119 8.531 -11.116 -18.907 782 H GLY 120 H GLY 120 9.132 -11.599 -14.313 783 HA2 GLY 120 2HA GLY 120 11.345 -10.362 -12.769 784 H LEU 121 H LEU 121 10.734 -13.334 -13.219 785 HA LEU 121 HA LEU 121 9.651 -14.507 -10.915 786 HB3 LEU 121 2HB LEU 121 10.411 -15.623 -13.087 787 HG LEU 121 HG LEU 121 13.099 -15.695 -11.605 788 HD11 LEU 121 1HD1 LEU 121 12.439 -17.953 -12.210 789 HD12 LEU 121 2HD1 LEU 121 12.160 -17.454 -13.895 790 HD13 LEU 121 3HD1 LEU 121 13.798 -17.405 -13.196 791 HD21 LEU 121 3HD2 LEU 121 14.110 -15.020 -13.704 792 HD22 LEU 121 1HD2 LEU 121 12.543 -15.035 -14.528 793 HD23 LEU 121 2HD2 LEU 121 12.892 -13.830 -13.271 794 H ASP 122 H ASP 122 12.676 -12.806 -11.153 795 HA ASP 122 HA ASP 122 13.925 -13.831 -8.784 796 HB3 ASP 122 2HB ASP 122 14.138 -11.072 -10.079 797 H ASN 123 H ASN 123 11.046 -12.353 -9.050 798 HA ASN 123 HA ASN 123 9.535 -11.297 -7.820 799 HB3 ASN 123 2HB ASN 123 9.633 -11.148 -5.446 800 HD21 ASN 123 2HD2 ASN 123 8.622 -13.216 -6.624 801 HD22 ASN 123 1HD2 ASN 123 9.314 -14.734 -6.082 802 H GLN 124 H GLN 124 9.221 -9.083 -6.609 803 HA GLN 124 HA GLN 124 9.486 -6.807 -6.660 804 HB3 GLN 124 2HB GLN 124 11.743 -6.038 -6.055 805 HG3 GLN 124 2HG GLN 124 11.029 -8.674 -4.718 806 HE21 GLN 124 2HE2 GLN 124 12.150 -9.176 -2.743 807 HE22 GLN 124 1HE2 GLN 124 13.762 -8.530 -2.472 808 H GLU 125 H GLU 125 9.376 -8.086 -9.347 809 HA GLU 125 HA GLU 125 10.249 -5.758 -10.913 810 HB3 GLU 125 2HB GLU 125 11.381 -7.085 -12.602 811 HG3 GLU 125 2HG GLU 125 12.702 -7.615 -9.907 812 H GLY 126 H GLY 126 8.907 -5.395 -12.672 813 HA2 GLY 126 2HA GLY 126 7.064 -5.486 -14.028 814 H GLY 127 H GLY 127 6.176 -8.369 -12.167 815 HA2 GLY 127 2HA GLY 127 4.163 -8.977 -11.193 816 H VAL 128 H VAL 128 2.320 -6.989 -9.822 817 HA VAL 128 HA VAL 128 0.415 -6.743 -11.983 818 HB VAL 128 HB VAL 128 -0.889 -5.288 -10.405 819 HG11 VAL 128 1HG1 VAL 128 -1.345 -7.674 -10.676 820 HG12 VAL 128 2HG1 VAL 128 -0.192 -8.021 -9.360 821 HG13 VAL 128 3HG1 VAL 128 -1.658 -7.096 -9.035 822 HG21 VAL 128 3HG2 VAL 128 -0.412 -5.292 -8.074 823 HG22 VAL 128 1HG2 VAL 128 1.121 -6.139 -8.325 824 HG23 VAL 128 2HG2 VAL 128 0.893 -4.480 -8.955 825 H CYS 129 H CYS 129 2.933 -4.540 -10.783 826 HA CYS 129 HA CYS 129 1.934 -2.185 -12.002 827 HB3 CYS 129 2HB CYS 129 4.752 -3.107 -11.526 828 H GLN 130 H GLN 130 3.438 -5.006 -13.574 829 HA GLN 130 HA GLN 130 3.820 -3.816 -16.127 830 HB3 GLN 130 2HB GLN 130 3.259 -6.759 -15.641 831 HG3 GLN 130 2HG GLN 130 4.523 -5.287 -17.803 832 HE21 GLN 130 2HE2 GLN 130 6.631 -4.487 -17.464 833 HE22 GLN 130 1HE2 GLN 130 7.986 -5.528 -17.041 834 H THR 131 H THR 131 0.979 -5.619 -14.868 835 HA THR 131 HA THR 131 -0.599 -4.866 -17.287 836 HB THR 131 HB THR 131 -0.446 -7.690 -16.212 837 HG1 THR 131 1HG THR 131 0.504 -8.033 -18.323 838 HG21 THR 131 3HG2 THR 131 -1.561 -8.179 -18.498 839 HG22 THR 131 1HG2 THR 131 -2.599 -7.485 -17.263 840 HG23 THR 131 2HG2 THR 131 -1.951 -6.438 -18.551 841 H ARG 132 H ARG 132 -0.655 -3.619 -14.889 842 HA ARG 132 HA ARG 132 -3.463 -3.702 -14.184 843 HB3 ARG 132 2HB ARG 132 -1.976 -3.895 -11.653 844 HG3 ARG 132 2HG ARG 132 -3.509 -5.482 -10.902 845 HD3 ARG 132 2HD ARG 132 -4.424 -3.038 -11.614 846 HE ARG 132 HE ARG 132 -5.753 -3.264 -13.500 847 HH11 ARG 132 1HH2 ARG 132 -6.292 -6.123 -11.546 848 HH12 ARG 132 2HH2 ARG 132 -7.450 -6.791 -12.660 849 HH21 ARG 132 1HH1 ARG 132 -7.217 -4.187 -14.908 850 HH22 ARG 132 2HH1 ARG 132 -7.966 -5.705 -14.513 851 H ALA 133 H ALA 133 -0.241 -2.695 -13.175 852 HA ALA 133 HA ALA 133 0.713 -0.746 -12.573 853 HB1 ALA 133 3HB ALA 133 0.005 1.341 -13.422 854 HB2 ALA 133 1HB ALA 133 0.001 0.094 -14.685 855 HB3 ALA 133 2HB ALA 133 -1.534 0.666 -13.995 856 H MET 134 H MET 134 0.469 -1.491 -10.431 857 HA MET 134 HA MET 134 -1.570 -0.004 -8.835 858 HB3 MET 134 2HB MET 134 -0.294 -2.647 -8.064 859 HG3 MET 134 2HG MET 134 -2.353 -0.799 -6.913 860 HE1 MET 134 3HE MET 134 -3.049 -4.932 -5.148 861 HE2 MET 134 1HE MET 134 -1.500 -4.614 -5.950 862 HE3 MET 134 2HE MET 134 -2.012 -3.623 -4.559 863 H LYS 135 H LYS 135 -0.349 1.800 -8.666 864 HA LYS 135 HA LYS 135 1.832 1.696 -6.626 865 HB3 LYS 135 2HB LYS 135 2.861 3.668 -7.794 866 HG3 LYS 135 2HG LYS 135 3.258 1.040 -8.384 867 HD3 LYS 135 2HD LYS 135 1.642 1.543 -10.477 868 HE3 LYS 135 2HE LYS 135 4.449 2.302 -11.436 869 HZ1 LYS 135 3HZ LYS 135 3.194 2.837 -13.498 870 HZ2 LYS 135 1HZ LYS 135 3.185 1.232 -13.176 871 HZ3 LYS 135 2HZ LYS 135 1.864 2.163 -12.876 872 H ILE 136 H ILE 136 2.139 3.917 -5.622 873 HA ILE 136 HA ILE 136 -0.218 5.628 -5.620 874 HB ILE 136 HB ILE 136 -0.810 5.715 -3.443 875 HG13 ILE 136 2HG1 ILE 136 1.887 5.359 -2.710 876 HG21 ILE 136 1HG2 ILE 136 -1.523 3.555 -4.283 877 HG22 ILE 136 2HG2 ILE 136 -0.047 2.788 -3.647 878 HG23 ILE 136 3HG2 ILE 136 -1.243 3.488 -2.544 879 HD11 ILE 136 3HD1 ILE 136 1.205 6.336 -0.618 880 HD12 ILE 136 1HD1 ILE 136 0.347 7.157 -1.942 881 HD13 ILE 136 2HD1 ILE 136 -0.491 5.926 -0.943 882 H LEU 137 H LEU 137 0.232 7.773 -4.893 883 HA LEU 137 HA LEU 137 3.126 8.448 -4.554 884 HB3 LEU 137 2HB LEU 137 1.342 9.266 -6.677 885 HG LEU 137 HG LEU 137 1.066 11.411 -5.247 886 HD11 LEU 137 1HD1 LEU 137 3.456 11.472 -4.391 887 HD12 LEU 137 2HD1 LEU 137 3.977 11.865 -6.022 888 HD13 LEU 137 3HD1 LEU 137 2.896 12.959 -5.146 889 HD21 LEU 137 3HD2 LEU 137 1.392 12.865 -7.133 890 HD22 LEU 137 1HD2 LEU 137 2.511 11.706 -7.907 891 HD23 LEU 137 2HD2 LEU 137 0.794 11.309 -7.721 892 H MET 138 H MET 138 3.573 9.517 -2.758 893 HA MET 138 HA MET 138 1.348 10.419 -0.999 894 HB3 MET 138 2HB MET 138 3.409 10.895 0.513 895 HG3 MET 138 2HG MET 138 2.990 7.982 -0.232 896 HE1 MET 138 3HE MET 138 3.341 6.514 3.363 897 HE2 MET 138 1HE MET 138 1.903 6.975 2.420 898 HE3 MET 138 2HE MET 138 3.252 6.133 1.634 899 H LYS 139 H LYS 139 0.662 12.502 -1.191 900 HA LYS 139 HA LYS 139 2.050 14.607 -2.459 901 HB3 LYS 139 2HB LYS 139 0.280 15.237 -0.074 902 HG3 LYS 139 2HG LYS 139 -0.780 16.219 -2.490 903 HD3 LYS 139 2HD LYS 139 1.114 17.905 -0.824 904 HE3 LYS 139 2HE LYS 139 -1.526 18.764 -2.023 905 HZ1 LYS 139 3HZ LYS 139 -0.210 20.753 -2.543 906 HZ2 LYS 139 1HZ LYS 139 -0.149 20.476 -0.962 907 HZ3 LYS 139 2HZ LYS 139 1.133 20.106 -1.905 908 H VAL 140 H VAL 140 3.438 16.183 -1.844 909 HA VAL 140 HA VAL 140 5.501 15.636 -0.062 910 HB VAL 140 HB VAL 140 4.592 18.357 -1.113 911 HG11 VAL 140 1HG1 VAL 140 6.152 18.746 0.706 912 HG12 VAL 140 2HG1 VAL 140 7.285 17.528 0.057 913 HG13 VAL 140 3HG1 VAL 140 6.961 19.035 -0.823 914 HG21 VAL 140 3HG2 VAL 140 6.325 17.974 -2.840 915 HG22 VAL 140 1HG2 VAL 140 6.669 16.369 -2.162 916 HG23 VAL 140 2HG2 VAL 140 5.095 16.720 -2.911 917 H GLY 141 H GLY 141 2.600 17.513 0.596 918 HA2 GLY 141 2HA GLY 141 2.143 16.565 3.116 919 H GLN 142 H GLN 142 2.368 20.015 2.251 920 HA GLN 142 HA GLN 142 -0.508 20.219 1.660 921 HB3 GLN 142 2HB GLN 142 -0.477 22.384 3.095 922 HG3 GLN 142 2HG GLN 142 -1.546 19.905 3.647 923 HE21 GLN 142 2HE2 GLN 142 -1.876 20.768 6.669 924 HE22 GLN 142 1HE2 GLN 142 -0.654 19.777 7.464
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