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NMR Restraints Grid |
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Result table
(Save to zip file containing files for each block)
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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653090 |
6xry ![]() ![]() |
30773 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 MET 1 HT1 MET 1 1.332 12.310 -8.279 2 H2 MET 1 HT2 MET 1 1.414 10.613 -8.303 3 H3 MET 1 HT3 MET 1 -0.071 11.392 -8.027 4 HA MET 1 HA MET 1 1.484 11.645 -10.539 5 HB2 MET 1 HB2 MET 1 0.523 9.297 -9.852 6 HB3 MET 1 HB3 MET 1 -1.038 10.024 -10.226 7 HG2 MET 1 HG2 MET 1 -0.239 8.921 -12.226 8 HG3 MET 1 HG3 MET 1 -0.121 10.662 -12.485 9 HE1 MET 1 HE1 MET 1 1.206 10.344 -14.369 10 HE2 MET 1 HE2 MET 1 1.692 8.649 -14.373 11 HE3 MET 1 HE3 MET 1 2.920 9.911 -14.445 12 H SER 2 H SER 2 -0.091 13.527 -8.663 13 HA SER 2 HA SER 2 -2.565 14.183 -9.852 14 HB2 SER 2 HB2 SER 2 -0.621 15.873 -8.271 15 HB3 SER 2 HB3 SER 2 -2.243 16.391 -8.717 16 HG SER 2 HG SER 2 -1.435 14.277 -7.028 17 H ASP 3 H ASP 3 0.723 15.410 -10.436 18 HA ASP 3 HA ASP 3 -0.262 16.635 -12.947 19 HB2 ASP 3 HB2 ASP 3 1.903 17.710 -11.128 20 HB3 ASP 3 HB3 ASP 3 1.385 18.423 -12.654 21 H GLN 4 H GLN 4 2.636 15.450 -11.254 22 HA GLN 4 HA GLN 4 3.433 13.733 -13.367 23 HB2 GLN 4 HB2 GLN 4 3.950 15.938 -14.438 24 HB3 GLN 4 HB3 GLN 4 5.085 16.264 -13.129 25 HG2 GLN 4 HG2 GLN 4 6.353 14.226 -13.726 26 HG3 GLN 4 HG3 GLN 4 5.228 13.919 -15.047 27 HE21 GLN 4 HE21 GLN 4 6.092 14.588 -17.007 28 HE22 GLN 4 HE22 GLN 4 7.084 15.950 -17.224 29 H SER 5 H SER 5 3.502 12.426 -11.460 30 HA SER 5 HA SER 5 5.306 12.958 -9.303 31 HB2 SER 5 HB2 SER 5 3.354 11.517 -8.993 32 HB3 SER 5 HB3 SER 5 3.980 10.379 -10.183 33 HG SER 5 HG SER 5 4.650 9.601 -8.256 34 H GLN 6 H GLN 6 7.342 12.158 -8.924 35 HA GLN 6 HA GLN 6 8.950 11.507 -11.236 36 HB2 GLN 6 HB2 GLN 6 9.629 11.538 -8.280 37 HB3 GLN 6 HB3 GLN 6 10.802 11.275 -9.569 38 HG2 GLN 6 HG2 GLN 6 11.057 13.547 -9.358 39 HG3 GLN 6 HG3 GLN 6 9.701 13.571 -10.480 40 HE21 GLN 6 HE21 GLN 6 10.342 15.641 -8.476 41 HE22 GLN 6 HE22 GLN 6 9.011 15.724 -7.425 42 H GLU 7 H GLU 7 8.023 9.842 -8.273 43 HA GLU 7 HA GLU 7 8.666 7.239 -9.519 44 HB2 GLU 7 HB2 GLU 7 8.374 8.015 -6.607 45 HB3 GLU 7 HB3 GLU 7 8.693 6.376 -7.181 46 HG2 GLU 7 HG2 GLU 7 10.782 7.145 -8.241 47 HG3 GLU 7 HG3 GLU 7 10.463 8.787 -7.689 48 HA PRO 8 HA PRO 8 4.276 6.402 -9.514 49 HB2 PRO 8 HB2 PRO 8 4.214 3.690 -9.615 50 HB3 PRO 8 HB3 PRO 8 4.719 4.683 -10.998 51 HG2 PRO 8 HG2 PRO 8 6.384 3.189 -9.031 52 HG3 PRO 8 HG3 PRO 8 6.588 3.363 -10.783 53 HD2 PRO 8 HD2 PRO 8 8.018 4.824 -8.946 54 HD3 PRO 8 HD3 PRO 8 7.666 5.392 -10.593 55 H THR 9 H THR 9 2.997 6.666 -7.790 56 HA THR 9 HA THR 9 3.636 5.301 -5.264 57 HB THR 9 HB THR 9 1.643 7.520 -5.840 58 HG1 THR 9 HG1 THR 9 3.916 8.012 -6.108 59 HG21 THR 9 HG21 THR 9 2.614 6.190 -3.303 60 HG22 THR 9 HG22 THR 9 0.950 6.433 -3.839 61 HG23 THR 9 HG23 THR 9 1.911 7.809 -3.295 62 H MET 10 H MET 10 2.324 3.807 -4.353 63 HA MET 10 HA MET 10 0.526 2.342 -5.958 64 HB2 MET 10 HB2 MET 10 0.981 2.376 -2.970 65 HB3 MET 10 HB3 MET 10 -0.087 1.226 -3.773 66 HG2 MET 10 HG2 MET 10 2.841 1.598 -4.470 67 HG3 MET 10 HG3 MET 10 2.233 0.341 -3.394 68 HE1 MET 10 HE1 MET 10 3.993 -0.112 -5.878 69 HE2 MET 10 HE2 MET 10 3.247 -1.478 -6.705 70 HE3 MET 10 HE3 MET 10 3.393 -1.493 -4.949 71 H GLU 11 H GLU 11 0.003 4.770 -3.460 72 HA GLU 11 HA GLU 11 -2.810 4.538 -3.253 73 HB2 GLU 11 HB2 GLU 11 -0.980 6.908 -2.834 74 HB3 GLU 11 HB3 GLU 11 -2.706 6.951 -2.482 75 HG2 GLU 11 HG2 GLU 11 -2.492 5.165 -0.866 76 HG3 GLU 11 HG3 GLU 11 -0.815 4.889 -1.321 77 H GLU 12 H GLU 12 -0.880 6.839 -5.166 78 HA GLU 12 HA GLU 12 -2.948 8.085 -6.519 79 HB2 GLU 12 HB2 GLU 12 -0.113 7.530 -7.400 80 HB3 GLU 12 HB3 GLU 12 -1.216 8.569 -8.299 81 HG2 GLU 12 HG2 GLU 12 -0.411 8.969 -5.400 82 HG3 GLU 12 HG3 GLU 12 0.238 9.872 -6.766 83 H ILE 13 H ILE 13 -1.198 5.121 -7.500 84 HA ILE 13 HA ILE 13 -2.389 4.811 -10.017 85 HB ILE 13 HB ILE 13 -1.321 2.751 -8.056 86 HG12 ILE 13 HG12 ILE 13 -0.089 3.820 -10.614 87 HG13 ILE 13 HG13 ILE 13 0.190 4.580 -9.048 88 HG21 ILE 13 HG21 ILE 13 -2.893 1.713 -9.711 89 HG22 ILE 13 HG22 ILE 13 -1.227 1.193 -9.959 90 HG23 ILE 13 HG23 ILE 13 -1.939 2.411 -11.018 91 HD11 ILE 13 HD11 ILE 13 1.247 2.617 -8.178 92 HD12 ILE 13 HD12 ILE 13 1.938 2.867 -9.781 93 HD13 ILE 13 HD13 ILE 13 0.699 1.636 -9.537 94 H LEU 14 H LEU 14 -3.430 3.574 -6.825 95 HA LEU 14 HA LEU 14 -5.715 2.173 -7.677 96 HB2 LEU 14 HB2 LEU 14 -4.765 3.367 -5.103 97 HB3 LEU 14 HB3 LEU 14 -6.474 2.962 -5.212 98 HG LEU 14 HG LEU 14 -5.681 0.651 -6.069 99 HD11 LEU 14 HD11 LEU 14 -3.454 -0.029 -5.568 100 HD12 LEU 14 HD12 LEU 14 -3.131 1.446 -4.659 101 HD13 LEU 14 HD13 LEU 14 -3.301 1.511 -6.413 102 HD21 LEU 14 HD21 LEU 14 -6.577 1.244 -3.745 103 HD22 LEU 14 HD22 LEU 14 -4.894 1.305 -3.220 104 HD23 LEU 14 HD23 LEU 14 -5.572 -0.201 -3.838 105 H ALA 15 H ALA 15 -5.247 5.560 -6.768 106 HA ALA 15 HA ALA 15 -7.949 6.392 -6.890 107 HB1 ALA 15 HB1 ALA 15 -7.135 8.521 -6.597 108 HB2 ALA 15 HB2 ALA 15 -5.782 8.273 -7.701 109 HB3 ALA 15 HB3 ALA 15 -5.724 7.604 -6.073 110 H SER 16 H SER 16 -5.415 6.153 -9.312 111 HA SER 16 HA SER 16 -6.710 7.477 -11.439 112 HB2 SER 16 HB2 SER 16 -4.642 5.273 -11.464 113 HB3 SER 16 HB3 SER 16 -5.153 6.163 -12.896 114 HG SER 16 HG SER 16 -3.345 7.158 -12.020 115 H ILE 17 H ILE 17 -6.797 4.097 -10.378 116 HA ILE 17 HA ILE 17 -8.266 3.092 -12.594 117 HB ILE 17 HB ILE 17 -8.046 2.030 -9.760 118 HG12 ILE 17 HG12 ILE 17 -5.851 2.256 -10.868 119 HG13 ILE 17 HG13 ILE 17 -6.280 0.564 -10.682 120 HG21 ILE 17 HG21 ILE 17 -9.228 0.875 -12.280 121 HG22 ILE 17 HG22 ILE 17 -9.847 0.818 -10.632 122 HG23 ILE 17 HG23 ILE 17 -8.490 -0.201 -11.091 123 HD11 ILE 17 HD11 ILE 17 -7.092 0.590 -13.085 124 HD12 ILE 17 HD12 ILE 17 -5.357 0.851 -12.904 125 HD13 ILE 17 HD13 ILE 17 -6.425 2.218 -13.228 126 H ARG 18 H ARG 18 -9.286 4.254 -9.363 127 HA ARG 18 HA ARG 18 -11.996 4.658 -10.459 128 HB2 ARG 18 HB2 ARG 18 -11.334 3.398 -7.790 129 HB3 ARG 18 HB3 ARG 18 -12.941 3.948 -8.257 130 HG2 ARG 18 HG2 ARG 18 -11.372 1.958 -9.899 131 HG3 ARG 18 HG3 ARG 18 -12.463 1.462 -8.611 132 HD2 ARG 18 HD2 ARG 18 -14.301 2.717 -9.753 133 HD3 ARG 18 HD3 ARG 18 -13.196 3.069 -11.077 134 HE ARG 18 HE ARG 18 -13.381 0.851 -11.783 135 HH11 ARG 18 HH11 ARG 18 -14.892 1.228 -8.642 136 HH12 ARG 18 HH12 ARG 18 -15.645 -0.331 -8.690 137 HH21 ARG 18 HH21 ARG 18 -14.393 -1.162 -11.808 138 HH22 ARG 18 HH22 ARG 18 -15.363 -1.671 -10.469 139 H ARG 19 H ARG 19 -12.990 6.504 -9.869 140 HA ARG 19 HA ARG 19 -11.556 8.286 -7.988 141 HB2 ARG 19 HB2 ARG 19 -13.130 8.947 -10.488 142 HB3 ARG 19 HB3 ARG 19 -12.571 10.154 -9.330 143 HG2 ARG 19 HG2 ARG 19 -10.242 9.414 -9.675 144 HG3 ARG 19 HG3 ARG 19 -10.798 8.208 -10.836 145 HD2 ARG 19 HD2 ARG 19 -11.733 10.008 -12.249 146 HD3 ARG 19 HD3 ARG 19 -11.150 11.207 -11.099 147 HE ARG 19 HE ARG 19 -9.555 9.726 -13.025 148 HH11 ARG 19 HH11 ARG 19 -9.518 11.627 -10.080 149 HH12 ARG 19 HH12 ARG 19 -7.849 12.063 -10.246 150 HH21 ARG 19 HH21 ARG 19 -7.391 10.317 -13.202 151 HH22 ARG 19 HH22 ARG 19 -6.658 11.324 -11.999 152 H ILE 20 H ILE 20 -13.815 6.295 -7.544 153 HA ILE 20 HA ILE 20 -15.793 8.192 -6.421 154 HB ILE 20 HB ILE 20 -17.491 6.410 -6.674 155 HG12 ILE 20 HG12 ILE 20 -15.427 4.933 -8.337 156 HG13 ILE 20 HG13 ILE 20 -15.750 4.528 -6.652 157 HG21 ILE 20 HG21 ILE 20 -16.006 7.144 -9.218 158 HG22 ILE 20 HG22 ILE 20 -17.243 8.117 -8.421 159 HG23 ILE 20 HG23 ILE 20 -17.672 6.566 -9.145 160 HD11 ILE 20 HD11 ILE 20 -18.164 4.202 -7.248 161 HD12 ILE 20 HD12 ILE 20 -17.089 3.073 -8.072 162 HD13 ILE 20 HD13 ILE 20 -17.743 4.464 -8.938 163 H ILE 21 H ILE 21 -16.870 7.488 -4.463 164 HA ILE 21 HA ILE 21 -15.034 6.562 -2.502 165 HB ILE 21 HB ILE 21 -16.831 8.184 -2.011 166 HG12 ILE 21 HG12 ILE 21 -17.736 7.012 0.080 167 HG13 ILE 21 HG13 ILE 21 -16.863 5.581 -0.465 168 HG21 ILE 21 HG21 ILE 21 -19.138 7.592 -1.960 169 HG22 ILE 21 HG22 ILE 21 -18.780 5.875 -2.152 170 HG23 ILE 21 HG23 ILE 21 -18.529 6.985 -3.502 171 HD11 ILE 21 HD11 ILE 21 -14.756 6.657 -0.263 172 HD12 ILE 21 HD12 ILE 21 -15.640 7.138 1.184 173 HD13 ILE 21 HD13 ILE 21 -15.490 8.257 -0.170 174 H SER 22 H SER 22 -14.552 4.578 -1.878 175 HA SER 22 HA SER 22 -16.479 2.415 -1.937 176 HB2 SER 22 HB2 SER 22 -15.215 0.960 -3.407 177 HB3 SER 22 HB3 SER 22 -15.597 2.447 -4.270 178 HG SER 22 HG SER 22 -13.183 1.403 -3.537 179 H GLU 23 H GLU 23 -15.619 0.448 -0.934 180 HA GLU 23 HA GLU 23 -13.911 1.077 1.301 181 HB2 GLU 23 HB2 GLU 23 -15.135 -1.550 0.415 182 HB3 GLU 23 HB3 GLU 23 -14.309 -1.283 1.950 183 HG2 GLU 23 HG2 GLU 23 -16.786 0.208 1.024 184 HG3 GLU 23 HG3 GLU 23 -16.782 -1.120 2.178 185 H ASP 24 H ASP 24 -11.817 0.537 1.619 186 HA ASP 24 HA ASP 24 -10.448 -1.010 -0.504 187 HB2 ASP 24 HB2 ASP 24 -9.390 1.394 0.995 188 HB3 ASP 24 HB3 ASP 24 -8.481 0.419 -0.161 189 H ASP 25 H ASP 25 -9.805 -2.885 0.324 190 HA ASP 25 HA ASP 25 -8.878 -2.958 3.121 191 HB2 ASP 25 HB2 ASP 25 -9.342 -5.360 3.054 192 HB3 ASP 25 HB3 ASP 25 -10.772 -4.444 2.605 193 H ALA 26 H ALA 26 -7.351 -2.204 0.575 194 HA ALA 26 HA ALA 26 -5.480 -4.237 -0.022 195 HB1 ALA 26 HB1 ALA 26 -5.526 -2.526 -1.598 196 HB2 ALA 26 HB2 ALA 26 -4.057 -2.149 -0.699 197 HB3 ALA 26 HB3 ALA 26 -5.542 -1.258 -0.371 198 HA PRO 27 HA PRO 27 -2.890 -4.115 3.604 199 HB2 PRO 27 HB2 PRO 27 -0.482 -4.924 2.630 200 HB3 PRO 27 HB3 PRO 27 -1.863 -6.027 2.811 201 HG2 PRO 27 HG2 PRO 27 -0.872 -4.624 0.369 202 HG3 PRO 27 HG3 PRO 27 -1.403 -6.305 0.566 203 HD2 PRO 27 HD2 PRO 27 -3.023 -4.392 -0.490 204 HD3 PRO 27 HD3 PRO 27 -3.657 -5.751 0.465 205 H ALA 28 H ALA 28 -1.213 -2.944 4.647 206 HA ALA 28 HA ALA 28 0.148 -0.827 3.139 207 HB1 ALA 28 HB1 ALA 28 -1.465 -0.229 5.628 208 HB2 ALA 28 HB2 ALA 28 -2.035 0.097 3.989 209 HB3 ALA 28 HB3 ALA 28 -0.607 0.926 4.610 210 H GLU 29 H GLU 29 1.953 0.090 4.284 211 HA GLU 29 HA GLU 29 2.738 -1.187 6.790 212 HB2 GLU 29 HB2 GLU 29 4.994 -1.765 5.874 213 HB3 GLU 29 HB3 GLU 29 3.693 -2.717 5.162 214 HG2 GLU 29 HG2 GLU 29 3.673 -1.225 3.195 215 HG3 GLU 29 HG3 GLU 29 4.963 -0.261 3.903 216 HA PRO 30 HA PRO 30 3.944 3.326 6.052 217 HB2 PRO 30 HB2 PRO 30 2.334 4.548 7.857 218 HB3 PRO 30 HB3 PRO 30 1.801 4.185 6.204 219 HG2 PRO 30 HG2 PRO 30 1.264 2.695 8.734 220 HG3 PRO 30 HG3 PRO 30 0.154 3.113 7.415 221 HD2 PRO 30 HD2 PRO 30 1.289 0.643 7.644 222 HD3 PRO 30 HD3 PRO 30 0.873 1.365 6.074 223 H ALA 31 H ALA 31 5.245 4.630 7.486 224 HA ALA 31 HA ALA 31 5.744 3.527 10.167 225 HB1 ALA 31 HB1 ALA 31 7.497 2.456 9.073 226 HB2 ALA 31 HB2 ALA 31 8.258 3.961 9.591 227 HB3 ALA 31 HB3 ALA 31 7.718 3.774 7.921 228 H ALA 32 H ALA 32 6.287 5.012 11.674 229 HA ALA 32 HA ALA 32 7.121 7.692 10.951 230 HB1 ALA 32 HB1 ALA 32 4.644 7.537 12.632 231 HB2 ALA 32 HB2 ALA 32 4.495 7.469 10.874 232 HB3 ALA 32 HB3 ALA 32 5.244 8.870 11.643 233 H GLU 33 H GLU 33 7.822 8.926 12.811 234 HA GLU 33 HA GLU 33 7.896 7.532 15.383 235 HB2 GLU 33 HB2 GLU 33 9.920 6.813 14.056 236 HB3 GLU 33 HB3 GLU 33 10.440 8.498 14.061 237 HG2 GLU 33 HG2 GLU 33 10.423 8.499 16.531 238 HG3 GLU 33 HG3 GLU 33 9.908 6.816 16.530 239 H ALA 34 H ALA 34 7.445 8.951 16.929 240 HA ALA 34 HA ALA 34 8.605 11.581 17.011 241 HB1 ALA 34 HB1 ALA 34 5.735 11.211 16.220 242 HB2 ALA 34 HB2 ALA 34 6.926 12.352 15.594 243 HB3 ALA 34 HB3 ALA 34 6.204 12.614 17.181 244 H ALA 35 H ALA 35 8.393 12.569 19.013 245 HA ALA 35 HA ALA 35 6.672 11.511 21.060 246 HB1 ALA 35 HB1 ALA 35 9.002 11.080 22.411 247 HB2 ALA 35 HB2 ALA 35 9.461 10.570 20.785 248 HB3 ALA 35 HB3 ALA 35 8.087 9.814 21.595 249 HA PRO 36 HA PRO 36 8.450 15.881 21.523 250 HB2 PRO 36 HB2 PRO 36 6.189 17.334 21.129 251 HB3 PRO 36 HB3 PRO 36 7.233 16.814 19.791 252 HG2 PRO 36 HG2 PRO 36 4.683 15.614 20.774 253 HG3 PRO 36 HG3 PRO 36 5.223 15.911 19.111 254 HD2 PRO 36 HD2 PRO 36 5.384 13.453 20.287 255 HD3 PRO 36 HD3 PRO 36 6.535 14.003 19.049 256 HA PRO 37 HA PRO 37 7.080 15.853 25.822 257 HB2 PRO 37 HB2 PRO 37 7.608 18.787 25.841 258 HB3 PRO 37 HB3 PRO 37 8.267 17.515 26.888 259 HG2 PRO 37 HG2 PRO 37 9.770 18.637 25.028 260 HG3 PRO 37 HG3 PRO 37 9.870 16.895 25.350 261 HD2 PRO 37 HD2 PRO 37 8.470 18.315 23.095 262 HD3 PRO 37 HD3 PRO 37 9.445 16.826 23.058 263 HA PRO 38 HA PRO 38 2.849 17.349 25.491 264 HB2 PRO 38 HB2 PRO 38 2.054 17.339 28.103 265 HB3 PRO 38 HB3 PRO 38 2.258 15.853 27.152 266 HG2 PRO 38 HG2 PRO 38 4.117 17.110 29.121 267 HG3 PRO 38 HG3 PRO 38 3.675 15.404 28.919 268 HD2 PRO 38 HD2 PRO 38 6.004 16.408 27.947 269 HD3 PRO 38 HD3 PRO 38 5.126 15.093 27.133 270 HA PRO 39 HA PRO 39 3.179 21.749 26.263 271 HB2 PRO 39 HB2 PRO 39 0.575 22.552 26.186 272 HB3 PRO 39 HB3 PRO 39 1.478 22.071 24.735 273 HG2 PRO 39 HG2 PRO 39 -0.459 20.492 26.365 274 HG3 PRO 39 HG3 PRO 39 -0.308 20.617 24.603 275 HD2 PRO 39 HD2 PRO 39 0.686 18.498 25.990 276 HD3 PRO 39 HD3 PRO 39 1.455 19.108 24.506 277 HA PRO 40 HA PRO 40 2.597 22.227 30.687 278 HB2 PRO 40 HB2 PRO 40 2.618 24.961 30.949 279 HB3 PRO 40 HB3 PRO 40 4.077 23.985 30.698 280 HG2 PRO 40 HG2 PRO 40 2.487 25.553 28.722 281 HG3 PRO 40 HG3 PRO 40 4.245 25.404 28.892 282 HD2 PRO 40 HD2 PRO 40 2.867 24.022 27.010 283 HD3 PRO 40 HD3 PRO 40 4.317 23.356 27.797 284 H GLU 41 H GLU 41 0.499 23.962 28.467 285 HA GLU 41 HA GLU 41 -1.654 24.758 28.626 286 HB2 GLU 41 HB2 GLU 41 -1.826 22.201 28.691 287 HB3 GLU 41 HB3 GLU 41 -2.099 22.370 30.425 288 HG2 GLU 41 HG2 GLU 41 -4.036 23.811 30.010 289 HG3 GLU 41 HG3 GLU 41 -3.743 23.745 28.278 290 HA PRO 42 HA PRO 42 -0.905 26.358 33.067 291 HB2 PRO 42 HB2 PRO 42 -0.368 28.967 32.428 292 HB3 PRO 42 HB3 PRO 42 0.883 27.715 32.576 293 HG2 PRO 42 HG2 PRO 42 -0.426 28.798 30.125 294 HG3 PRO 42 HG3 PRO 42 1.283 28.429 30.422 295 HD2 PRO 42 HD2 PRO 42 -0.315 26.745 29.026 296 HD3 PRO 42 HD3 PRO 42 0.994 26.148 30.071 297 H GLU 43 H GLU 43 -2.773 27.362 30.308 298 HA GLU 43 HA GLU 43 -4.462 29.242 31.628 299 HB2 GLU 43 HB2 GLU 43 -5.881 29.052 29.628 300 HB3 GLU 43 HB3 GLU 43 -4.184 29.226 29.185 301 HG2 GLU 43 HG2 GLU 43 -4.013 26.792 28.842 302 HG3 GLU 43 HG3 GLU 43 -5.700 26.600 29.315 303 HA PRO 44 HA PRO 44 -7.293 26.503 33.698 304 HB2 PRO 44 HB2 PRO 44 -9.608 27.904 33.719 305 HB3 PRO 44 HB3 PRO 44 -8.190 28.418 34.656 306 HG2 PRO 44 HG2 PRO 44 -9.166 29.407 32.015 307 HG3 PRO 44 HG3 PRO 44 -8.577 30.325 33.413 308 HD2 PRO 44 HD2 PRO 44 -7.010 29.779 31.242 309 HD3 PRO 44 HD3 PRO 44 -6.352 29.969 32.881 310 H GLU 45 H GLU 45 -9.303 25.221 33.447 311 HA GLU 45 HA GLU 45 -10.178 24.963 30.631 312 HB2 GLU 45 HB2 GLU 45 -9.550 22.705 32.558 313 HB3 GLU 45 HB3 GLU 45 -10.242 22.505 30.949 314 HG2 GLU 45 HG2 GLU 45 -8.243 23.529 29.945 315 HG3 GLU 45 HG3 GLU 45 -7.553 23.774 31.549 316 HA PRO 46 HA PRO 46 -13.811 25.310 33.637 317 HB2 PRO 46 HB2 PRO 46 -15.065 27.426 32.471 318 HB3 PRO 46 HB3 PRO 46 -13.795 27.618 33.695 319 HG2 PRO 46 HG2 PRO 46 -13.608 27.829 30.726 320 HG3 PRO 46 HG3 PRO 46 -12.888 28.859 31.978 321 HD2 PRO 46 HD2 PRO 46 -11.466 26.927 30.679 322 HD3 PRO 46 HD3 PRO 46 -11.129 27.398 32.360 323 H VAL 47 H VAL 47 -13.431 25.209 30.184 324 HA VAL 47 HA VAL 47 -16.064 23.879 29.896 325 HB VAL 47 HB VAL 47 -14.613 25.602 27.856 326 HG11 VAL 47 HG11 VAL 47 -16.695 25.315 26.519 327 HG12 VAL 47 HG12 VAL 47 -17.289 24.172 27.724 328 HG13 VAL 47 HG13 VAL 47 -15.855 23.785 26.772 329 HG21 VAL 47 HG21 VAL 47 -17.210 26.071 29.360 330 HG22 VAL 47 HG22 VAL 47 -16.500 27.149 28.160 331 HG23 VAL 47 HG23 VAL 47 -15.682 26.883 29.699 332 H SER 48 H SER 48 -16.040 21.879 29.036 333 HA SER 48 HA SER 48 -13.595 20.469 28.724 334 HB2 SER 48 HB2 SER 48 -14.968 18.584 28.112 335 HB3 SER 48 HB3 SER 48 -15.789 19.456 29.406 336 HG SER 48 HG SER 48 -17.158 20.350 27.911 337 H PHE 49 H PHE 49 -12.904 19.323 26.786 338 HA PHE 49 HA PHE 49 -12.729 21.085 24.511 339 HB2 PHE 49 HB2 PHE 49 -10.847 19.621 25.256 340 HB3 PHE 49 HB3 PHE 49 -11.800 18.210 24.789 341 HD1 PHE 49 HD1 PHE 49 -10.210 21.321 23.497 342 HD2 PHE 49 HD2 PHE 49 -11.950 17.522 22.503 343 HE1 PHE 49 HE1 PHE 49 -9.425 21.574 21.158 344 HE2 PHE 49 HE2 PHE 49 -11.165 17.773 20.165 345 HZ PHE 49 HZ PHE 49 -9.901 19.799 19.493 346 H ASP 50 H ASP 50 -14.128 17.897 25.135 347 HA ASP 50 HA ASP 50 -15.780 18.148 22.691 348 HB2 ASP 50 HB2 ASP 50 -14.227 16.226 22.712 349 HB3 ASP 50 HB3 ASP 50 -14.979 15.649 24.196 350 H ASP 51 H ASP 51 -17.756 18.851 23.164 351 HA ASP 51 HA ASP 51 -19.005 18.692 25.699 352 HB2 ASP 51 HB2 ASP 51 -20.161 19.138 22.936 353 HB3 ASP 51 HB3 ASP 51 -21.076 19.320 24.431 354 H GLU 52 H GLU 52 -20.554 17.307 26.520 355 HA GLU 52 HA GLU 52 -21.392 15.002 24.925 356 HB2 GLU 52 HB2 GLU 52 -19.864 14.820 27.529 357 HB3 GLU 52 HB3 GLU 52 -20.804 13.485 26.865 358 HG2 GLU 52 HG2 GLU 52 -18.521 14.890 25.441 359 HG3 GLU 52 HG3 GLU 52 -18.406 13.325 26.240 360 H VAL 53 H VAL 53 -22.487 17.518 26.410 361 HA VAL 53 HA VAL 53 -24.640 16.075 27.791 362 HB VAL 53 HB VAL 53 -24.845 17.986 29.360 363 HG11 VAL 53 HG11 VAL 53 -23.578 16.026 30.054 364 HG12 VAL 53 HG12 VAL 53 -22.771 17.475 30.653 365 HG13 VAL 53 HG13 VAL 53 -22.136 16.633 29.240 366 HG21 VAL 53 HG21 VAL 53 -23.066 19.657 29.485 367 HG22 VAL 53 HG22 VAL 53 -23.763 19.683 27.867 368 HG23 VAL 53 HG23 VAL 53 -22.211 18.891 28.146 369 H LEU 54 H LEU 54 -26.731 16.906 27.572 370 HA LEU 54 HA LEU 54 -27.129 19.206 25.792 371 HB2 LEU 54 HB2 LEU 54 -28.206 16.423 25.285 372 HB3 LEU 54 HB3 LEU 54 -28.838 17.869 24.502 373 HG LEU 54 HG LEU 54 -25.913 17.080 24.385 374 HD11 LEU 54 HD11 LEU 54 -26.475 16.312 22.058 375 HD12 LEU 54 HD12 LEU 54 -28.182 16.476 22.469 376 HD13 LEU 54 HD13 LEU 54 -27.179 15.306 23.325 377 HD21 LEU 54 HD21 LEU 54 -27.662 19.046 22.871 378 HD22 LEU 54 HD22 LEU 54 -26.046 18.586 22.337 379 HD23 LEU 54 HD23 LEU 54 -26.261 19.417 23.877 380 H GLU 55 H GLU 55 -28.899 20.403 26.322 381 HA GLU 55 HA GLU 55 -31.034 19.240 27.937 382 HB2 GLU 55 HB2 GLU 55 -29.256 20.048 29.541 383 HB3 GLU 55 HB3 GLU 55 -29.542 21.679 28.929 384 HG2 GLU 55 HG2 GLU 55 -31.918 21.507 29.576 385 HG3 GLU 55 HG3 GLU 55 -31.635 19.879 30.188 386 H LEU 56 H LEU 56 -32.808 19.842 26.898 387 HA LEU 56 HA LEU 56 -33.006 22.611 25.866 388 HB2 LEU 56 HB2 LEU 56 -33.525 20.002 24.529 389 HB3 LEU 56 HB3 LEU 56 -34.744 21.238 24.261 390 HG LEU 56 HG LEU 56 -33.045 21.266 22.483 391 HD11 LEU 56 HD11 LEU 56 -32.702 23.597 22.391 392 HD12 LEU 56 HD12 LEU 56 -32.581 23.740 24.144 393 HD13 LEU 56 HD13 LEU 56 -34.141 23.407 23.393 394 HD21 LEU 56 HD21 LEU 56 -31.185 20.477 24.134 395 HD22 LEU 56 HD22 LEU 56 -30.969 22.197 24.464 396 HD23 LEU 56 HD23 LEU 56 -30.743 21.579 22.830 397 H THR 57 H THR 57 -34.416 23.664 27.123 398 HA THR 57 HA THR 57 -36.334 22.434 28.801 399 HB THR 57 HB THR 57 -36.218 25.293 27.778 400 HG1 THR 57 HG1 THR 57 -34.365 24.424 28.940 401 HG21 THR 57 HG21 THR 57 -37.670 24.016 30.117 402 HG22 THR 57 HG22 THR 57 -38.396 24.856 28.746 403 HG23 THR 57 HG23 THR 57 -37.450 25.758 29.931 404 H ASP 58 H ASP 58 -36.592 24.030 25.638 405 HA ASP 58 HA ASP 58 -39.415 23.325 25.414 406 HB2 ASP 58 HB2 ASP 58 -38.672 25.552 24.690 407 HB3 ASP 58 HB3 ASP 58 -37.593 24.809 23.509 408 HA PRO 59 HA PRO 59 -37.958 19.578 23.213 409 HB2 PRO 59 HB2 PRO 59 -40.366 18.361 22.868 410 HB3 PRO 59 HB3 PRO 59 -39.501 18.346 24.420 411 HG2 PRO 59 HG2 PRO 59 -41.757 20.088 23.531 412 HG3 PRO 59 HG3 PRO 59 -41.516 19.259 25.079 413 HD2 PRO 59 HD2 PRO 59 -40.971 21.903 24.757 414 HD3 PRO 59 HD3 PRO 59 -40.050 20.873 25.876 415 H ILE 60 H ILE 60 -38.038 18.814 21.049 416 HA ILE 60 HA ILE 60 -39.645 20.434 19.165 417 HB ILE 60 HB ILE 60 -37.730 20.444 17.599 418 HG12 ILE 60 HG12 ILE 60 -36.059 19.433 19.921 419 HG13 ILE 60 HG13 ILE 60 -36.655 18.366 18.652 420 HG21 ILE 60 HG21 ILE 60 -38.083 22.373 19.055 421 HG22 ILE 60 HG22 ILE 60 -36.352 22.086 18.878 422 HG23 ILE 60 HG23 ILE 60 -37.181 21.592 20.353 423 HD11 ILE 60 HD11 ILE 60 -34.794 20.739 18.326 424 HD12 ILE 60 HD12 ILE 60 -35.533 19.886 16.968 425 HD13 ILE 60 HD13 ILE 60 -34.417 19.040 18.040 426 H ALA 61 H ALA 61 -40.058 19.427 17.108 427 HA ALA 61 HA ALA 61 -39.782 16.488 17.092 428 HB1 ALA 61 HB1 ALA 61 -42.303 17.893 16.199 429 HB2 ALA 61 HB2 ALA 61 -42.087 17.310 17.848 430 HB3 ALA 61 HB3 ALA 61 -42.059 16.173 16.500 431 HA PRO 62 HA PRO 62 -38.576 18.379 12.994 432 HB2 PRO 62 HB2 PRO 62 -36.063 17.413 12.769 433 HB3 PRO 62 HB3 PRO 62 -36.428 18.851 13.746 434 HG2 PRO 62 HG2 PRO 62 -35.955 16.041 14.618 435 HG3 PRO 62 HG3 PRO 62 -35.395 17.558 15.344 436 HD2 PRO 62 HD2 PRO 62 -37.578 16.123 16.257 437 HD3 PRO 62 HD3 PRO 62 -37.348 17.865 16.521 438 H GLU 63 H GLU 63 -40.319 16.354 13.089 439 HA GLU 63 HA GLU 63 -41.114 14.508 11.987 440 HB2 GLU 63 HB2 GLU 63 -38.819 15.314 10.204 441 HB3 GLU 63 HB3 GLU 63 -39.817 13.908 9.838 442 HG2 GLU 63 HG2 GLU 63 -40.742 15.816 8.664 443 HG3 GLU 63 HG3 GLU 63 -41.841 15.385 9.966 444 HA PRO 64 HA PRO 64 -38.807 11.033 13.514 445 HB2 PRO 64 HB2 PRO 64 -39.924 8.927 12.252 446 HB3 PRO 64 HB3 PRO 64 -40.846 9.916 13.402 447 HG2 PRO 64 HG2 PRO 64 -40.876 9.958 10.424 448 HG3 PRO 64 HG3 PRO 64 -42.221 10.095 11.568 449 HD2 PRO 64 HD2 PRO 64 -41.028 12.256 10.309 450 HD3 PRO 64 HD3 PRO 64 -41.928 12.360 11.837 451 H GLU 65 H GLU 65 -36.952 12.106 12.202 452 HA GLU 65 HA GLU 65 -35.767 10.028 10.491 453 HB2 GLU 65 HB2 GLU 65 -36.828 11.795 9.036 454 HB3 GLU 65 HB3 GLU 65 -35.697 12.956 9.732 455 HG2 GLU 65 HG2 GLU 65 -33.801 11.581 8.950 456 HG3 GLU 65 HG3 GLU 65 -34.927 10.422 8.253 457 H LEU 66 H LEU 66 -33.812 9.536 11.203 458 HA LEU 66 HA LEU 66 -32.117 11.629 12.390 459 HB2 LEU 66 HB2 LEU 66 -33.259 10.346 14.220 460 HB3 LEU 66 HB3 LEU 66 -32.486 8.882 13.619 461 HG LEU 66 HG LEU 66 -30.255 10.008 13.939 462 HD11 LEU 66 HD11 LEU 66 -30.294 11.980 15.555 463 HD12 LEU 66 HD12 LEU 66 -32.018 12.123 15.208 464 HD13 LEU 66 HD13 LEU 66 -30.836 12.339 13.916 465 HD21 LEU 66 HD21 LEU 66 -32.016 9.787 16.399 466 HD22 LEU 66 HD22 LEU 66 -30.253 9.735 16.392 467 HD23 LEU 66 HD23 LEU 66 -31.177 8.448 15.613 468 HA PRO 67 HA PRO 67 -29.894 9.189 9.073 469 HB2 PRO 67 HB2 PRO 67 -28.349 11.739 9.002 470 HB3 PRO 67 HB3 PRO 67 -29.002 10.779 7.662 471 HG2 PRO 67 HG2 PRO 67 -30.149 13.049 8.353 472 HG3 PRO 67 HG3 PRO 67 -31.134 11.641 7.913 473 HD2 PRO 67 HD2 PRO 67 -30.521 12.722 10.654 474 HD3 PRO 67 HD3 PRO 67 -32.060 12.101 10.008 475 HA PRO 68 HA PRO 68 -26.578 8.089 11.923 476 HB2 PRO 68 HB2 PRO 68 -24.943 6.641 10.301 477 HB3 PRO 68 HB3 PRO 68 -26.505 6.026 10.879 478 HG2 PRO 68 HG2 PRO 68 -25.814 7.250 8.247 479 HG3 PRO 68 HG3 PRO 68 -26.798 5.817 8.600 480 HD2 PRO 68 HD2 PRO 68 -27.912 8.237 8.039 481 HD3 PRO 68 HD3 PRO 68 -28.674 7.071 9.145 482 H LEU 69 H LEU 69 -24.381 8.602 12.425 483 HA LEU 69 HA LEU 69 -23.366 10.926 10.955 484 HB2 LEU 69 HB2 LEU 69 -23.605 11.059 13.418 485 HB3 LEU 69 HB3 LEU 69 -22.479 9.719 13.595 486 HG LEU 69 HG LEU 69 -20.737 11.102 12.423 487 HD11 LEU 69 HD11 LEU 69 -22.104 12.650 11.171 488 HD12 LEU 69 HD12 LEU 69 -21.186 13.590 12.346 489 HD13 LEU 69 HD13 LEU 69 -22.886 13.228 12.642 490 HD21 LEU 69 HD21 LEU 69 -20.735 11.006 14.848 491 HD22 LEU 69 HD22 LEU 69 -21.997 12.236 14.936 492 HD23 LEU 69 HD23 LEU 69 -20.386 12.664 14.358 493 H GLU 70 H GLU 70 -21.921 10.642 9.418 494 HA GLU 70 HA GLU 70 -19.957 8.436 9.650 495 HB2 GLU 70 HB2 GLU 70 -21.235 9.541 7.134 496 HB3 GLU 70 HB3 GLU 70 -19.960 8.321 7.178 497 HG2 GLU 70 HG2 GLU 70 -21.438 6.831 8.492 498 HG3 GLU 70 HG3 GLU 70 -22.715 8.044 8.416 499 H THR 71 H THR 71 -17.868 8.828 8.804 500 HA THR 71 HA THR 71 -17.187 11.685 8.416 501 HB THR 71 HB THR 71 -15.079 11.270 9.626 502 HG1 THR 71 HG1 THR 71 -14.715 9.329 10.577 503 HG21 THR 71 HG21 THR 71 -17.647 10.615 11.083 504 HG22 THR 71 HG22 THR 71 -16.849 12.183 10.956 505 HG23 THR 71 HG23 THR 71 -16.117 10.896 11.915 506 H VAL 72 H VAL 72 -15.183 12.037 7.227 507 HA VAL 72 HA VAL 72 -14.394 9.807 5.473 508 HB VAL 72 HB VAL 72 -16.099 11.134 4.292 509 HG11 VAL 72 HG11 VAL 72 -15.553 13.293 5.491 510 HG12 VAL 72 HG12 VAL 72 -15.771 13.446 3.749 511 HG13 VAL 72 HG13 VAL 72 -14.147 13.444 4.437 512 HG21 VAL 72 HG21 VAL 72 -14.440 10.097 2.897 513 HG22 VAL 72 HG22 VAL 72 -13.255 11.347 3.269 514 HG23 VAL 72 HG23 VAL 72 -14.664 11.735 2.283 515 H GLY 73 H GLY 73 -12.286 9.766 4.865 516 HA2 GLY 73 HA2 GLY 73 -10.457 11.909 4.936 517 HA3 GLY 73 HA3 GLY 73 -10.340 11.016 6.450 518 H ASP 74 H ASP 74 -10.165 10.693 2.926 519 HA ASP 74 HA ASP 74 -7.919 8.938 3.050 520 HB2 ASP 74 HB2 ASP 74 -8.977 6.963 2.043 521 HB3 ASP 74 HB3 ASP 74 -9.661 7.300 3.629 522 H ILE 75 H ILE 75 -7.595 7.990 0.700 523 HA ILE 75 HA ILE 75 -7.437 10.192 -1.044 524 HB ILE 75 HB ILE 75 -5.856 8.283 -1.056 525 HG12 ILE 75 HG12 ILE 75 -7.223 8.478 -3.750 526 HG13 ILE 75 HG13 ILE 75 -6.294 9.816 -3.073 527 HG21 ILE 75 HG21 ILE 75 -7.662 6.530 -0.745 528 HG22 ILE 75 HG22 ILE 75 -6.457 6.142 -1.973 529 HG23 ILE 75 HG23 ILE 75 -8.048 6.728 -2.454 530 HD11 ILE 75 HD11 ILE 75 -5.296 7.043 -3.776 531 HD12 ILE 75 HD12 ILE 75 -4.362 8.182 -2.801 532 HD13 ILE 75 HD13 ILE 75 -4.780 8.584 -4.466 533 H ASP 76 H ASP 76 -9.946 7.894 -0.468 534 HA ASP 76 HA ASP 76 -11.219 7.897 -2.966 535 HB2 ASP 76 HB2 ASP 76 -12.294 7.519 -0.172 536 HB3 ASP 76 HB3 ASP 76 -13.297 7.350 -1.608 537 H VAL 77 H VAL 77 -12.708 9.253 -3.907 538 HA VAL 77 HA VAL 77 -12.633 11.957 -3.531 539 HB VAL 77 HB VAL 77 -13.619 10.836 -5.496 540 HG11 VAL 77 HG11 VAL 77 -16.006 10.364 -3.684 541 HG12 VAL 77 HG12 VAL 77 -14.924 9.114 -4.300 542 HG13 VAL 77 HG13 VAL 77 -15.942 10.028 -5.415 543 HG21 VAL 77 HG21 VAL 77 -15.350 12.471 -5.929 544 HG22 VAL 77 HG22 VAL 77 -14.101 13.249 -4.959 545 HG23 VAL 77 HG23 VAL 77 -15.607 12.726 -4.205 546 H TYR 78 H TYR 78 -13.432 13.416 -2.181 547 HA TYR 78 HA TYR 78 -14.881 12.550 0.173 548 HB2 TYR 78 HB2 TYR 78 -13.863 15.258 -0.716 549 HB3 TYR 78 HB3 TYR 78 -14.667 14.963 0.828 550 HD1 TYR 78 HD1 TYR 78 -11.629 14.388 -1.161 551 HD2 TYR 78 HD2 TYR 78 -13.607 13.605 2.569 552 HE1 TYR 78 HE1 TYR 78 -9.484 13.610 -0.189 553 HE2 TYR 78 HE2 TYR 78 -11.461 12.827 3.542 554 HH TYR 78 HH TYR 78 -8.944 13.286 3.044 555 H SER 79 H SER 79 -17.002 12.570 0.427 556 HA SER 79 HA SER 79 -18.659 14.426 -1.162 557 HB2 SER 79 HB2 SER 79 -20.281 12.612 -1.531 558 HB3 SER 79 HB3 SER 79 -18.716 12.193 -2.217 559 HG SER 79 HG SER 79 -18.738 10.532 -0.951 560 HA PRO 80 HA PRO 80 -20.637 15.247 2.741 561 HB2 PRO 80 HB2 PRO 80 -23.285 15.541 2.104 562 HB3 PRO 80 HB3 PRO 80 -22.053 16.762 1.730 563 HG2 PRO 80 HG2 PRO 80 -23.246 14.680 -0.039 564 HG3 PRO 80 HG3 PRO 80 -22.893 16.382 -0.381 565 HD2 PRO 80 HD2 PRO 80 -21.261 14.394 -1.225 566 HD3 PRO 80 HD3 PRO 80 -20.628 15.982 -0.741 567 HA PRO 81 HA PRO 81 -22.056 11.324 4.338 568 HB2 PRO 81 HB2 PRO 81 -23.451 12.072 6.579 569 HB3 PRO 81 HB3 PRO 81 -21.680 12.065 6.479 570 HG2 PRO 81 HG2 PRO 81 -23.578 14.345 6.189 571 HG3 PRO 81 HG3 PRO 81 -22.035 14.267 7.056 572 HD2 PRO 81 HD2 PRO 81 -22.235 15.411 4.609 573 HD3 PRO 81 HD3 PRO 81 -20.773 14.537 5.120 574 H GLU 82 H GLU 82 -24.407 13.833 3.673 575 HA GLU 82 HA GLU 82 -26.460 11.749 3.244 576 HB2 GLU 82 HB2 GLU 82 -28.180 13.448 3.952 577 HB3 GLU 82 HB3 GLU 82 -27.129 12.885 5.248 578 HG2 GLU 82 HG2 GLU 82 -25.746 14.921 5.016 579 HG3 GLU 82 HG3 GLU 82 -26.786 15.485 3.713 580 HA PRO 83 HA PRO 83 -25.997 14.353 -0.603 581 HB2 PRO 83 HB2 PRO 83 -25.266 12.444 -2.369 582 HB3 PRO 83 HB3 PRO 83 -24.084 13.210 -1.289 583 HG2 PRO 83 HG2 PRO 83 -25.404 10.551 -1.071 584 HG3 PRO 83 HG3 PRO 83 -23.730 11.012 -0.724 585 HD2 PRO 83 HD2 PRO 83 -25.696 10.703 1.208 586 HD3 PRO 83 HD3 PRO 83 -24.228 11.680 1.418 587 H GLU 84 H GLU 84 -28.384 13.854 0.379 588 HA GLU 84 HA GLU 84 -30.030 11.953 -0.912 589 HB2 GLU 84 HB2 GLU 84 -30.633 13.114 1.195 590 HB3 GLU 84 HB3 GLU 84 -30.806 14.622 0.300 591 HG2 GLU 84 HG2 GLU 84 -33.008 13.607 0.612 592 HG3 GLU 84 HG3 GLU 84 -32.579 13.564 -1.094 593 H SER 85 H SER 85 -29.342 15.376 -1.642 594 HA SER 85 HA SER 85 -30.686 15.030 -4.253 595 HB2 SER 85 HB2 SER 85 -31.003 17.486 -4.207 596 HB3 SER 85 HB3 SER 85 -31.782 16.692 -2.842 597 HG SER 85 HG SER 85 -29.735 18.495 -2.896 598 H GLU 86 H GLU 86 -28.095 14.094 -4.008 599 HA GLU 86 HA GLU 86 -26.585 16.055 -5.624 600 HB2 GLU 86 HB2 GLU 86 -25.452 14.200 -3.504 601 HB3 GLU 86 HB3 GLU 86 -24.497 15.222 -4.576 602 HG2 GLU 86 HG2 GLU 86 -26.569 16.229 -2.597 603 HG3 GLU 86 HG3 GLU 86 -24.828 16.258 -2.339 604 HA PRO 87 HA PRO 87 -27.140 11.954 -7.834 605 HB2 PRO 87 HB2 PRO 87 -27.790 12.973 -10.278 606 HB3 PRO 87 HB3 PRO 87 -28.988 12.688 -8.999 607 HG2 PRO 87 HG2 PRO 87 -27.643 15.230 -9.798 608 HG3 PRO 87 HG3 PRO 87 -29.344 14.934 -9.393 609 HD2 PRO 87 HD2 PRO 87 -27.607 16.026 -7.611 610 HD3 PRO 87 HD3 PRO 87 -28.954 14.978 -7.106 611 H ALA 88 H ALA 88 -25.608 10.926 -9.016 612 HA ALA 88 HA ALA 88 -23.895 11.909 -10.964 613 HB1 ALA 88 HB1 ALA 88 -22.835 12.260 -8.165 614 HB2 ALA 88 HB2 ALA 88 -22.735 13.370 -9.533 615 HB3 ALA 88 HB3 ALA 88 -21.735 11.919 -9.503 616 H TYR 89 H TYR 89 -23.797 9.952 -8.011 617 HA TYR 89 HA TYR 89 -22.239 7.835 -9.124 618 HB2 TYR 89 HB2 TYR 89 -23.987 7.992 -6.662 619 HB3 TYR 89 HB3 TYR 89 -22.978 6.601 -7.065 620 HD1 TYR 89 HD1 TYR 89 -23.002 10.108 -5.974 621 HD2 TYR 89 HD2 TYR 89 -20.525 6.767 -7.040 622 HE1 TYR 89 HE1 TYR 89 -21.036 11.255 -4.990 623 HE2 TYR 89 HE2 TYR 89 -18.559 7.912 -6.053 624 HH TYR 89 HH TYR 89 -18.489 11.151 -5.332 625 H THR 90 H THR 90 -25.672 8.517 -8.966 626 HA THR 90 HA THR 90 -26.269 5.888 -10.187 627 HB THR 90 HB THR 90 -28.158 7.790 -8.773 628 HG1 THR 90 HG1 THR 90 -27.021 5.339 -7.913 629 HG21 THR 90 HG21 THR 90 -29.615 5.728 -8.749 630 HG22 THR 90 HG22 THR 90 -28.461 4.971 -9.844 631 HG23 THR 90 HG23 THR 90 -29.350 6.405 -10.356 632 HA PRO 91 HA PRO 91 -26.969 8.806 -13.694 633 HB2 PRO 91 HB2 PRO 91 -26.639 7.049 -15.721 634 HB3 PRO 91 HB3 PRO 91 -25.259 7.733 -14.838 635 HG2 PRO 91 HG2 PRO 91 -26.579 5.074 -14.518 636 HG3 PRO 91 HG3 PRO 91 -24.852 5.475 -14.566 637 HD2 PRO 91 HD2 PRO 91 -26.201 5.050 -12.226 638 HD3 PRO 91 HD3 PRO 91 -24.803 6.143 -12.351 639 HA PRO 92 HA PRO 92 -31.261 7.858 -14.534 640 HB2 PRO 92 HB2 PRO 92 -31.666 8.855 -17.041 641 HB3 PRO 92 HB3 PRO 92 -31.447 9.894 -15.620 642 HG2 PRO 92 HG2 PRO 92 -29.463 9.101 -17.704 643 HG3 PRO 92 HG3 PRO 92 -29.757 10.693 -16.973 644 HD2 PRO 92 HD2 PRO 92 -27.704 9.104 -16.175 645 HD3 PRO 92 HD3 PRO 92 -28.556 10.183 -15.050 646 HA PRO 93 HA PRO 93 -31.585 4.002 -16.734 647 HB2 PRO 93 HB2 PRO 93 -33.998 4.152 -18.074 648 HB3 PRO 93 HB3 PRO 93 -33.836 3.809 -16.340 649 HG2 PRO 93 HG2 PRO 93 -34.470 6.382 -17.707 650 HG3 PRO 93 HG3 PRO 93 -35.175 5.679 -16.239 651 HD2 PRO 93 HD2 PRO 93 -33.337 7.649 -16.102 652 HD3 PRO 93 HD3 PRO 93 -33.385 6.344 -14.897 653 H ALA 94 H ALA 94 -30.923 3.106 -18.630 654 HA ALA 94 HA ALA 94 -31.307 4.321 -21.203 655 HB1 ALA 94 HB1 ALA 94 -29.036 4.906 -21.690 656 HB2 ALA 94 HB2 ALA 94 -28.466 4.225 -20.167 657 HB3 ALA 94 HB3 ALA 94 -29.439 5.696 -20.167 658 H ALA 95 H ALA 95 -30.196 3.048 -22.904 659 HA ALA 95 HA ALA 95 -29.459 0.331 -22.035 660 HB1 ALA 95 HB1 ALA 95 -31.280 0.596 -24.386 661 HB2 ALA 95 HB2 ALA 95 -31.968 0.747 -22.765 662 HB3 ALA 95 HB3 ALA 95 -31.115 -0.729 -23.229 663 HA PRO 96 HA PRO 96 -26.885 1.885 -25.683 664 HB2 PRO 96 HB2 PRO 96 -24.599 2.668 -24.514 665 HB3 PRO 96 HB3 PRO 96 -26.009 3.749 -24.574 666 HG2 PRO 96 HG2 PRO 96 -25.014 2.064 -22.322 667 HG3 PRO 96 HG3 PRO 96 -25.616 3.730 -22.301 668 HD2 PRO 96 HD2 PRO 96 -27.149 1.533 -21.614 669 HD3 PRO 96 HD3 PRO 96 -27.818 3.071 -22.200 670 H VAL 97 H VAL 97 -25.374 0.521 -26.730 671 HA VAL 97 HA VAL 97 -25.054 -2.096 -25.800 672 HB VAL 97 HB VAL 97 -23.385 -0.587 -27.843 673 HG11 VAL 97 HG11 VAL 97 -22.804 -2.786 -28.736 674 HG12 VAL 97 HG12 VAL 97 -23.786 -3.578 -27.503 675 HG13 VAL 97 HG13 VAL 97 -22.325 -2.705 -27.039 676 HG21 VAL 97 HG21 VAL 97 -24.910 -1.615 -29.484 677 HG22 VAL 97 HG22 VAL 97 -25.810 -0.618 -28.341 678 HG23 VAL 97 HG23 VAL 97 -25.817 -2.373 -28.174 679 H PHE 98 H PHE 98 -23.707 -3.014 -24.413 680 HA PHE 98 HA PHE 98 -21.920 -1.501 -22.806 681 HB2 PHE 98 HB2 PHE 98 -23.123 -3.521 -22.018 682 HB3 PHE 98 HB3 PHE 98 -22.152 -4.511 -23.110 683 HD1 PHE 98 HD1 PHE 98 -21.967 -2.211 -20.179 684 HD2 PHE 98 HD2 PHE 98 -19.945 -5.199 -22.513 685 HE1 PHE 98 HE1 PHE 98 -20.184 -2.346 -18.462 686 HE2 PHE 98 HE2 PHE 98 -18.163 -5.334 -20.795 687 HZ PHE 98 HZ PHE 98 -18.281 -3.908 -18.769 688 H ASP 99 H ASP 99 -19.787 -1.161 -22.935 689 HA ASP 99 HA ASP 99 -18.339 -2.268 -25.260 690 HB2 ASP 99 HB2 ASP 99 -17.710 0.153 -23.550 691 HB3 ASP 99 HB3 ASP 99 -16.798 -0.375 -24.962 692 H ARG 100 H ARG 100 -16.102 -2.939 -24.927 693 HA ARG 100 HA ARG 100 -15.749 -4.688 -22.768 694 HB2 ARG 100 HB2 ARG 100 -14.511 -4.736 -24.971 695 HB3 ARG 100 HB3 ARG 100 -13.525 -3.404 -24.370 696 HG2 ARG 100 HG2 ARG 100 -12.757 -4.760 -22.492 697 HG3 ARG 100 HG3 ARG 100 -13.827 -6.078 -22.972 698 HD2 ARG 100 HD2 ARG 100 -11.585 -4.969 -24.685 699 HD3 ARG 100 HD3 ARG 100 -11.474 -6.436 -23.715 700 HE ARG 100 HE ARG 100 -13.723 -6.716 -25.350 701 HH11 ARG 100 HH11 ARG 100 -10.257 -6.381 -25.764 702 HH12 ARG 100 HH12 ARG 100 -10.231 -7.275 -27.247 703 HH21 ARG 100 HH21 ARG 100 -13.643 -7.869 -27.279 704 HH22 ARG 100 HH22 ARG 100 -12.134 -8.110 -28.097 705 H ASP 101 H ASP 101 -16.081 -3.750 -20.793 706 HA ASP 101 HA ASP 101 -14.130 -1.693 -19.939 707 HB2 ASP 101 HB2 ASP 101 -16.468 -0.861 -20.041 708 HB3 ASP 101 HB3 ASP 101 -16.944 -2.129 -18.911 709 H GLU 102 H GLU 102 -12.635 -2.609 -18.686 710 HA GLU 102 HA GLU 102 -13.492 -4.275 -16.440 711 HB2 GLU 102 HB2 GLU 102 -11.763 -5.985 -16.899 712 HB3 GLU 102 HB3 GLU 102 -12.983 -5.926 -18.167 713 HG2 GLU 102 HG2 GLU 102 -11.474 -4.531 -19.549 714 HG3 GLU 102 HG3 GLU 102 -10.251 -4.610 -18.285 715 H VAL 103 H VAL 103 -12.200 -4.120 -14.655 716 HA VAL 103 HA VAL 103 -9.603 -2.819 -14.800 717 HB VAL 103 HB VAL 103 -10.199 -1.065 -13.149 718 HG11 VAL 103 HG11 VAL 103 -10.215 -0.702 -15.659 719 HG12 VAL 103 HG12 VAL 103 -11.200 0.432 -14.736 720 HG13 VAL 103 HG13 VAL 103 -11.966 -0.899 -15.600 721 HG21 VAL 103 HG21 VAL 103 -12.695 -0.537 -12.966 722 HG22 VAL 103 HG22 VAL 103 -12.153 -1.962 -12.080 723 HG23 VAL 103 HG23 VAL 103 -12.991 -2.148 -13.619 724 H ALA 104 H ALA 104 -8.369 -3.036 -12.867 725 HA ALA 104 HA ALA 104 -9.475 -4.394 -10.575 726 HB1 ALA 104 HB1 ALA 104 -9.236 -6.384 -11.823 727 HB2 ALA 104 HB2 ALA 104 -7.785 -6.318 -10.824 728 HB3 ALA 104 HB3 ALA 104 -7.704 -5.860 -12.526 729 H GLU 105 H GLU 105 -6.193 -4.420 -11.972 730 HA GLU 105 HA GLU 105 -4.193 -3.618 -11.204 731 HB2 GLU 105 HB2 GLU 105 -5.249 -1.445 -11.652 732 HB3 GLU 105 HB3 GLU 105 -5.960 -1.441 -10.042 733 HG2 GLU 105 HG2 GLU 105 -3.947 -0.059 -10.024 734 HG3 GLU 105 HG3 GLU 105 -3.664 -1.506 -9.064 735 H GLN 106 H GLN 106 -5.924 -2.384 -8.353 736 HA GLN 106 HA GLN 106 -5.212 -4.659 -6.711 737 HB2 GLN 106 HB2 GLN 106 -3.076 -3.345 -6.942 738 HB3 GLN 106 HB3 GLN 106 -3.880 -2.011 -6.119 739 HG2 GLN 106 HG2 GLN 106 -2.602 -3.321 -4.496 740 HG3 GLN 106 HG3 GLN 106 -4.324 -3.510 -4.180 741 HE21 GLN 106 HE21 GLN 106 -4.746 -5.649 -3.625 742 HE22 GLN 106 HE22 GLN 106 -4.032 -7.003 -4.356 743 H LEU 107 H LEU 107 -6.615 -1.453 -7.053 744 HA LEU 107 HA LEU 107 -7.583 -1.034 -4.472 745 HB2 LEU 107 HB2 LEU 107 -7.672 0.499 -6.583 746 HB3 LEU 107 HB3 LEU 107 -9.214 -0.289 -6.898 747 HG LEU 107 HG LEU 107 -8.600 0.922 -4.198 748 HD11 LEU 107 HD11 LEU 107 -8.341 2.601 -6.106 749 HD12 LEU 107 HD12 LEU 107 -9.542 3.008 -4.881 750 HD13 LEU 107 HD13 LEU 107 -10.055 2.348 -6.434 751 HD21 LEU 107 HD21 LEU 107 -10.519 -0.494 -4.151 752 HD22 LEU 107 HD22 LEU 107 -11.093 0.103 -5.710 753 HD23 LEU 107 HD23 LEU 107 -11.163 1.141 -4.286 754 H VAL 108 H VAL 108 -9.730 -2.119 -7.141 755 HA VAL 108 HA VAL 108 -11.588 -3.282 -5.312 756 HB VAL 108 HB VAL 108 -12.268 -2.321 -7.483 757 HG11 VAL 108 HG11 VAL 108 -11.778 -3.407 -9.572 758 HG12 VAL 108 HG12 VAL 108 -11.001 -4.760 -8.752 759 HG13 VAL 108 HG13 VAL 108 -10.243 -3.170 -8.738 760 HG21 VAL 108 HG21 VAL 108 -13.879 -4.025 -8.069 761 HG22 VAL 108 HG22 VAL 108 -13.624 -4.110 -6.328 762 HG23 VAL 108 HG23 VAL 108 -12.860 -5.293 -7.390 763 H GLY 109 H GLY 109 -11.644 -5.249 -4.462 764 HA2 GLY 109 HA2 GLY 109 -10.243 -7.481 -5.759 765 HA3 GLY 109 HA3 GLY 109 -9.794 -7.070 -4.105 766 H VAL 110 H VAL 110 -12.725 -7.661 -6.052 767 HA VAL 110 HA VAL 110 -14.765 -8.595 -5.499 768 HB VAL 110 HB VAL 110 -12.950 -10.588 -4.103 769 HG11 VAL 110 HG11 VAL 110 -15.390 -10.843 -3.636 770 HG12 VAL 110 HG12 VAL 110 -14.741 -12.192 -4.568 771 HG13 VAL 110 HG13 VAL 110 -15.687 -10.939 -5.372 772 HG21 VAL 110 HG21 VAL 110 -12.980 -11.781 -6.283 773 HG22 VAL 110 HG22 VAL 110 -12.231 -10.190 -6.428 774 HG23 VAL 110 HG23 VAL 110 -13.883 -10.440 -6.992 775 H SER 111 H SER 111 -15.655 -7.010 -4.157 776 HA SER 111 HA SER 111 -16.000 -7.817 -1.383 777 HB2 SER 111 HB2 SER 111 -15.304 -5.693 -0.437 778 HB3 SER 111 HB3 SER 111 -13.964 -6.383 -1.348 779 HG SER 111 HG SER 111 -15.812 -4.431 -2.280 780 H ALA 112 H ALA 112 -17.685 -6.571 -0.299 781 HA ALA 112 HA ALA 112 -19.340 -4.739 -1.767 782 HB1 ALA 112 HB1 ALA 112 -21.162 -6.073 -2.302 783 HB2 ALA 112 HB2 ALA 112 -20.727 -7.314 -1.126 784 HB3 ALA 112 HB3 ALA 112 -19.828 -7.177 -2.638 785 H ALA 113 H ALA 113 -19.291 -7.167 0.815 786 HA ALA 113 HA ALA 113 -19.949 -7.122 3.006 787 HB1 ALA 113 HB1 ALA 113 -19.865 -4.712 4.039 788 HB2 ALA 113 HB2 ALA 113 -19.125 -4.285 2.497 789 HB3 ALA 113 HB3 ALA 113 -18.372 -5.500 3.531 790 H SER 114 H SER 114 -21.625 -6.320 4.541 791 HA SER 114 HA SER 114 -24.004 -5.251 3.151 792 HB2 SER 114 HB2 SER 114 -23.915 -7.549 5.119 793 HB3 SER 114 HB3 SER 114 -25.384 -6.819 4.476 794 HG SER 114 HG SER 114 -24.919 -7.601 2.502 795 H ALA 115 H ALA 115 -25.516 -4.146 4.512 796 HA ALA 115 HA ALA 115 -24.689 -3.508 7.238 797 HB1 ALA 115 HB1 ALA 115 -23.553 -1.728 6.209 798 HB2 ALA 115 HB2 ALA 115 -25.116 -1.019 6.619 799 HB3 ALA 115 HB3 ALA 115 -24.787 -1.536 4.966 800 H ALA 116 H ALA 116 -26.404 -2.588 8.480 801 HA ALA 116 HA ALA 116 -28.973 -2.130 7.309 802 HB1 ALA 116 HB1 ALA 116 -28.853 -4.426 9.255 803 HB2 ALA 116 HB2 ALA 116 -28.692 -4.706 7.521 804 HB3 ALA 116 HB3 ALA 116 -30.161 -3.975 8.163 805 H ALA 117 H ALA 117 -30.498 -1.330 8.996 806 HA ALA 117 HA ALA 117 -29.252 -0.824 11.601 807 HB1 ALA 117 HB1 ALA 117 -30.598 1.391 10.052 808 HB2 ALA 117 HB2 ALA 117 -28.855 1.122 9.994 809 HB3 ALA 117 HB3 ALA 117 -29.635 1.519 11.526 810 H SER 118 H SER 118 -30.757 -0.437 13.287 811 HA SER 118 HA SER 118 -33.560 -0.202 12.848 812 HB2 SER 118 HB2 SER 118 -33.349 -2.577 12.248 813 HB3 SER 118 HB3 SER 118 -32.512 -2.897 13.766 814 HG SER 118 HG SER 118 -34.365 -2.876 14.766 815 H ALA 119 H ALA 119 -34.006 1.137 14.485 816 HA ALA 119 HA ALA 119 -33.106 0.400 17.176 817 HB1 ALA 119 HB1 ALA 119 -32.601 2.884 17.555 818 HB2 ALA 119 HB2 ALA 119 -32.581 3.028 15.797 819 HB3 ALA 119 HB3 ALA 119 -31.428 1.967 16.609 820 H PHE 120 H PHE 120 -34.579 0.823 18.757 821 HA PHE 120 HA PHE 120 -36.961 2.431 18.045 822 HB2 PHE 120 HB2 PHE 120 -36.911 -0.200 19.553 823 HB3 PHE 120 HB3 PHE 120 -38.335 0.821 19.337 824 HD1 PHE 120 HD1 PHE 120 -36.024 -1.527 17.736 825 HD2 PHE 120 HD2 PHE 120 -39.331 1.137 17.092 826 HE1 PHE 120 HE1 PHE 120 -36.445 -2.582 15.531 827 HE2 PHE 120 HE2 PHE 120 -39.751 0.084 14.887 828 HZ PHE 120 HZ PHE 120 -38.307 -1.776 14.106 829 H GLY 121 H GLY 121 -37.865 3.646 19.707 830 HA2 GLY 121 HA2 GLY 121 -36.073 4.414 21.821 831 HA3 GLY 121 HA3 GLY 121 -37.686 5.055 21.534 832 H SER 122 H SER 122 -36.145 3.927 23.952 833 HA SER 122 HA SER 122 -37.545 1.591 24.807 834 HB2 SER 122 HB2 SER 122 -36.471 1.955 26.934 835 HB3 SER 122 HB3 SER 122 -35.308 2.329 25.666 836 HG SER 122 HG SER 122 -36.124 3.890 27.618 837 H LEU 123 H LEU 123 -38.956 1.489 26.695 838 HA LEU 123 HA LEU 123 -40.498 3.887 27.320 839 HB2 LEU 123 HB2 LEU 123 -42.651 2.793 26.833 840 HB3 LEU 123 HB3 LEU 123 -41.685 2.994 25.375 841 HG LEU 123 HG LEU 123 -41.506 0.410 26.934 842 HD11 LEU 123 HD11 LEU 123 -43.361 -0.526 25.678 843 HD12 LEU 123 HD12 LEU 123 -43.589 0.991 24.805 844 HD13 LEU 123 HD13 LEU 123 -43.933 0.906 26.533 845 HD21 LEU 123 HD21 LEU 123 -41.017 1.323 24.092 846 HD22 LEU 123 HD22 LEU 123 -41.256 -0.388 24.453 847 HD23 LEU 123 HD23 LEU 123 -39.915 0.486 25.186 848 H SER 124 H SER 124 -42.229 3.324 29.026 849 HA SER 124 HA SER 124 -41.776 0.990 30.636 850 HB2 SER 124 HB2 SER 124 -40.962 2.131 32.615 851 HB3 SER 124 HB3 SER 124 -39.851 2.459 31.288 852 HG SER 124 HG SER 124 -40.598 4.309 32.613 853 H SER 125 H SER 125 -43.266 1.015 32.529 854 HA SER 125 HA SER 125 -45.392 3.018 32.319 855 HB2 SER 125 HB2 SER 125 -46.074 1.095 30.905 856 HB3 SER 125 HB3 SER 125 -45.897 0.025 32.294 857 HG SER 125 HG SER 125 -47.999 0.597 32.312 858 H ALA 126 H ALA 126 -43.655 3.241 34.237 859 HA ALA 126 HA ALA 126 -45.114 2.549 36.640 860 HB1 ALA 126 HB1 ALA 126 -43.878 0.668 36.957 861 HB2 ALA 126 HB2 ALA 126 -42.659 1.808 37.531 862 HB3 ALA 126 HB3 ALA 126 -42.595 1.206 35.874 863 H LEU 127 H LEU 127 -44.402 3.744 38.496 864 HA LEU 127 HA LEU 127 -42.284 5.679 38.206 865 HB2 LEU 127 HB2 LEU 127 -43.732 7.659 38.578 866 HB3 LEU 127 HB3 LEU 127 -44.038 6.875 37.032 867 HG LEU 127 HG LEU 127 -45.892 5.553 38.406 868 HD11 LEU 127 HD11 LEU 127 -46.915 7.301 40.062 869 HD12 LEU 127 HD12 LEU 127 -45.284 7.969 40.116 870 HD13 LEU 127 HD13 LEU 127 -45.574 6.304 40.617 871 HD21 LEU 127 HD21 LEU 127 -47.516 7.407 37.862 872 HD22 LEU 127 HD22 LEU 127 -46.436 6.992 36.530 873 HD23 LEU 127 HD23 LEU 127 -46.135 8.440 37.496 874 H LEU 128 H LEU 128 -41.900 6.900 40.173 875 HA LEU 128 HA LEU 128 -42.128 5.280 42.498 876 HB2 LEU 128 HB2 LEU 128 -41.143 8.074 41.952 877 HB3 LEU 128 HB3 LEU 128 -41.294 7.494 43.609 878 HG LEU 128 HG LEU 128 -39.921 5.455 42.854 879 HD11 LEU 128 HD11 LEU 128 -38.407 6.015 40.883 880 HD12 LEU 128 HD12 LEU 128 -39.531 7.320 40.500 881 HD13 LEU 128 HD13 LEU 128 -40.081 5.643 40.466 882 HD21 LEU 128 HD21 LEU 128 -38.958 7.205 44.258 883 HD22 LEU 128 HD22 LEU 128 -38.688 8.227 42.847 884 HD23 LEU 128 HD23 LEU 128 -37.775 6.729 43.036 885 H MET 129 H MET 129 -43.460 5.381 44.228 886 HA MET 129 HA MET 129 -45.551 7.466 44.275 887 HB2 MET 129 HB2 MET 129 -46.421 5.325 43.283 888 HB3 MET 129 HB3 MET 129 -46.055 4.526 44.813 889 HG2 MET 129 HG2 MET 129 -47.563 6.035 46.003 890 HG3 MET 129 HG3 MET 129 -47.880 6.928 44.516 891 HE1 MET 129 HE1 MET 129 -48.206 3.849 46.578 892 HE2 MET 129 HE2 MET 129 -47.548 2.979 45.193 893 HE3 MET 129 HE3 MET 129 -49.221 2.713 45.678 894 HA PRO 130 HA PRO 130 -43.393 7.073 48.403 895 HB2 PRO 130 HB2 PRO 130 -43.501 9.736 49.037 896 HB3 PRO 130 HB3 PRO 130 -42.197 9.008 48.078 897 HG2 PRO 130 HG2 PRO 130 -44.599 10.521 47.162 898 HG3 PRO 130 HG3 PRO 130 -42.918 10.622 46.602 899 HD2 PRO 130 HD2 PRO 130 -44.805 9.248 45.223 900 HD3 PRO 130 HD3 PRO 130 -43.105 8.732 45.264 901 H LYS 131 H LYS 131 -46.394 8.592 47.429 902 HA LYS 131 HA LYS 131 -47.434 8.672 50.160 903 HB2 LYS 131 HB2 LYS 131 -48.649 9.460 47.504 904 HB3 LYS 131 HB3 LYS 131 -49.466 9.620 49.058 905 HG2 LYS 131 HG2 LYS 131 -47.648 11.081 49.868 906 HG3 LYS 131 HG3 LYS 131 -46.832 10.927 48.311 907 HD2 LYS 131 HD2 LYS 131 -48.783 11.934 47.183 908 HD3 LYS 131 HD3 LYS 131 -49.600 12.093 48.739 909 HE2 LYS 131 HE2 LYS 131 -47.789 13.560 49.546 910 HE3 LYS 131 HE3 LYS 131 -46.964 13.398 47.996 911 HZ1 LYS 131 HZ1 LYS 131 -49.579 14.677 48.536 912 HZ2 LYS 131 HZ2 LYS 131 -49.065 14.276 46.969 913 HZ3 LYS 131 HZ3 LYS 131 -48.181 15.393 47.898 914 H ASP 132 H ASP 132 -48.772 7.213 51.028 915 HA ASP 132 HA ASP 132 -49.792 5.035 49.295 916 HB2 ASP 132 HB2 ASP 132 -48.001 4.389 50.955 917 HB3 ASP 132 HB3 ASP 132 -49.122 4.834 52.238 918 H GLY 133 H GLY 133 -50.391 6.981 52.191 919 HA2 GLY 133 HA2 GLY 133 -52.369 7.823 53.061 920 HA3 GLY 133 HA3 GLY 133 -53.195 7.243 51.616 921 H LEU 134 H LEU 134 -51.488 5.825 54.412 922 HA LEU 134 HA LEU 134 -52.921 3.396 54.444 923 HB2 LEU 134 HB2 LEU 134 -51.396 4.859 56.605 924 HB3 LEU 134 HB3 LEU 134 -52.077 3.249 56.827 925 HG LEU 134 HG LEU 134 -50.185 3.925 54.559 926 HD11 LEU 134 HD11 LEU 134 -49.603 2.805 57.316 927 HD12 LEU 134 HD12 LEU 134 -48.982 4.306 56.634 928 HD13 LEU 134 HD13 LEU 134 -48.463 2.756 55.971 929 HD21 LEU 134 HD21 LEU 134 -49.856 1.401 54.678 930 HD22 LEU 134 HD22 LEU 134 -51.453 1.918 54.138 931 HD23 LEU 134 HD23 LEU 134 -51.221 1.355 55.792 932 H GLU 135 H GLU 135 -53.456 6.477 56.111 933 HA GLU 135 HA GLU 135 -55.721 5.516 57.616 934 HB2 GLU 135 HB2 GLU 135 -54.734 8.330 57.084 935 HB3 GLU 135 HB3 GLU 135 -56.015 7.905 58.219 936 HG2 GLU 135 HG2 GLU 135 -54.427 6.484 59.474 937 HG3 GLU 135 HG3 GLU 135 -53.144 6.933 58.350 938 H HIS 136 H HIS 136 -57.885 5.878 57.229 939 HA HIS 136 HA HIS 136 -58.710 7.317 54.822 940 HB2 HIS 136 HB2 HIS 136 -58.249 4.976 54.085 941 HB3 HIS 136 HB3 HIS 136 -59.437 4.406 55.254 942 HD2 HIS 136 HD2 HIS 136 -62.006 4.333 54.227 943 HE1 HIS 136 HE1 HIS 136 -61.408 6.914 50.940 944 HE2 HIS 136 HE2 HIS 136 -63.084 5.400 52.101 945 H HIS 137 H HIS 137 -60.587 8.351 55.139 946 HA HIS 137 HA HIS 137 -62.594 7.366 56.993 947 HB2 HIS 137 HB2 HIS 137 -60.918 8.645 58.400 948 HB3 HIS 137 HB3 HIS 137 -61.367 10.086 57.490 949 HD2 HIS 137 HD2 HIS 137 -62.750 7.898 60.384 950 HE1 HIS 137 HE1 HIS 137 -65.703 10.777 59.479 951 HE2 HIS 137 HE2 HIS 137 -65.010 8.975 61.130 952 H HIS 138 H HIS 138 -64.600 8.038 56.424 953 HA HIS 138 HA HIS 138 -64.934 10.369 54.684 954 HB2 HIS 138 HB2 HIS 138 -64.574 8.347 53.217 955 HB3 HIS 138 HB3 HIS 138 -66.046 7.664 53.905 956 HD2 HIS 138 HD2 HIS 138 -68.279 8.381 52.458 957 HE1 HIS 138 HE1 HIS 138 -66.766 11.911 50.704 958 HE2 HIS 138 HE2 HIS 138 -68.770 10.356 50.822 959 H HIS 139 H HIS 139 -66.745 7.552 55.926 960 HA HIS 139 HA HIS 139 -69.150 9.048 56.354 961 HB2 HIS 139 HB2 HIS 139 -68.263 6.299 57.245 962 HB3 HIS 139 HB3 HIS 139 -69.863 6.957 57.579 963 HD2 HIS 139 HD2 HIS 139 -71.633 6.886 55.406 964 HE1 HIS 139 HE1 HIS 139 -68.879 5.462 52.539 965 HE2 HIS 139 HE2 HIS 139 -71.324 5.998 52.969 966 H HIS 140 H HIS 140 -70.079 9.708 58.289 967 HA HIS 140 HA HIS 140 -68.270 10.656 60.294 968 HB2 HIS 140 HB2 HIS 140 -71.289 10.610 60.119 969 HB3 HIS 140 HB3 HIS 140 -70.406 11.353 61.452 970 HD2 HIS 140 HD2 HIS 140 -69.316 13.868 60.877 971 HE1 HIS 140 HE1 HIS 140 -70.331 13.952 56.779 972 HE2 HIS 140 HE2 HIS 140 -69.388 15.314 58.703 973 H HIS 141 H HIS 141 -68.069 10.027 62.441 974 HA HIS 141 HA HIS 141 -67.865 8.533 64.174 975 HB2 HIS 141 HB2 HIS 141 -70.350 8.995 64.227 976 HB3 HIS 141 HB3 HIS 141 -70.575 7.520 63.287 977 HD2 HIS 141 HD2 HIS 141 -70.896 5.317 64.910 978 HE1 HIS 141 HE1 HIS 141 -68.919 6.788 68.338 979 HE2 HIS 141 HE2 HIS 141 -70.215 4.824 67.383 Start of MODEL 2 1 H1 MET 1 HT1 MET 1 -1.770 10.957 -5.565 2 H2 MET 1 HT2 MET 1 -2.259 12.473 -4.973 3 H3 MET 1 HT3 MET 1 -3.030 11.058 -4.433 4 HA MET 1 HA MET 1 -1.544 11.820 -2.733 5 HB2 MET 1 HB2 MET 1 -1.008 9.293 -4.249 6 HB3 MET 1 HB3 MET 1 0.184 9.753 -3.031 7 HG2 MET 1 HG2 MET 1 -2.795 9.572 -2.486 8 HG3 MET 1 HG3 MET 1 -1.651 8.273 -2.143 9 HE1 MET 1 HE1 MET 1 -3.114 10.379 0.924 10 HE2 MET 1 HE2 MET 1 -2.435 8.754 0.953 11 HE3 MET 1 HE3 MET 1 -3.532 9.220 -0.344 12 H SER 2 H SER 2 -0.069 11.561 -5.921 13 HA SER 2 HA SER 2 1.896 13.585 -5.184 14 HB2 SER 2 HB2 SER 2 3.055 11.512 -4.585 15 HB3 SER 2 HB3 SER 2 2.742 10.858 -6.190 16 HG SER 2 HG SER 2 4.143 13.275 -5.679 17 H ASP 3 H ASP 3 2.584 14.800 -6.898 18 HA ASP 3 HA ASP 3 1.048 14.688 -9.311 19 HB2 ASP 3 HB2 ASP 3 3.490 16.329 -8.591 20 HB3 ASP 3 HB3 ASP 3 2.496 16.575 -10.024 21 H GLN 4 H GLN 4 1.767 14.233 -11.421 22 HA GLN 4 HA GLN 4 3.378 11.995 -11.777 23 HB2 GLN 4 HB2 GLN 4 3.360 12.567 -14.183 24 HB3 GLN 4 HB3 GLN 4 1.760 12.729 -13.464 25 HG2 GLN 4 HG2 GLN 4 2.150 15.180 -13.220 26 HG3 GLN 4 HG3 GLN 4 3.706 14.991 -14.026 27 HE21 GLN 4 HE21 GLN 4 0.615 15.956 -14.666 28 HE22 GLN 4 HE22 GLN 4 0.510 15.521 -16.303 29 H SER 5 H SER 5 5.442 11.812 -12.948 30 HA SER 5 HA SER 5 7.699 12.210 -13.094 31 HB2 SER 5 HB2 SER 5 6.737 15.077 -13.269 32 HB3 SER 5 HB3 SER 5 8.380 14.547 -13.628 33 HG SER 5 HG SER 5 7.547 13.265 -15.284 34 H GLN 6 H GLN 6 7.363 11.453 -10.738 35 HA GLN 6 HA GLN 6 9.162 12.895 -9.093 36 HB2 GLN 6 HB2 GLN 6 7.071 14.283 -8.810 37 HB3 GLN 6 HB3 GLN 6 6.307 12.869 -8.085 38 HG2 GLN 6 HG2 GLN 6 8.042 12.797 -6.349 39 HG3 GLN 6 HG3 GLN 6 8.855 14.176 -7.086 40 HE21 GLN 6 HE21 GLN 6 7.412 13.814 -4.370 41 HE22 GLN 6 HE22 GLN 6 6.341 15.129 -4.310 42 H GLU 7 H GLU 7 6.272 10.934 -8.308 43 HA GLU 7 HA GLU 7 7.780 8.510 -8.015 44 HB2 GLU 7 HB2 GLU 7 8.294 10.029 -5.975 45 HB3 GLU 7 HB3 GLU 7 6.679 9.597 -5.436 46 HG2 GLU 7 HG2 GLU 7 8.873 7.612 -6.118 47 HG3 GLU 7 HG3 GLU 7 8.409 8.081 -4.486 48 HA PRO 8 HA PRO 8 3.226 8.002 -8.801 49 HB2 PRO 8 HB2 PRO 8 4.129 5.516 -10.140 50 HB3 PRO 8 HB3 PRO 8 3.092 6.816 -10.755 51 HG2 PRO 8 HG2 PRO 8 5.601 6.464 -11.615 52 HG3 PRO 8 HG3 PRO 8 4.863 8.069 -11.474 53 HD2 PRO 8 HD2 PRO 8 6.856 6.746 -9.666 54 HD3 PRO 8 HD3 PRO 8 6.725 8.454 -10.145 55 H THR 9 H THR 9 3.031 7.638 -6.508 56 HA THR 9 HA THR 9 3.728 5.186 -5.240 57 HB THR 9 HB THR 9 1.603 7.175 -4.396 58 HG1 THR 9 HG1 THR 9 3.173 8.427 -3.746 59 HG21 THR 9 HG21 THR 9 2.168 6.365 -2.137 60 HG22 THR 9 HG22 THR 9 3.344 5.247 -2.828 61 HG23 THR 9 HG23 THR 9 1.626 5.035 -3.158 62 H MET 10 H MET 10 2.355 3.474 -4.585 63 HA MET 10 HA MET 10 0.588 2.504 -6.537 64 HB2 MET 10 HB2 MET 10 0.953 1.758 -3.630 65 HB3 MET 10 HB3 MET 10 -0.088 0.862 -4.735 66 HG2 MET 10 HG2 MET 10 1.819 0.432 -6.219 67 HG3 MET 10 HG3 MET 10 2.871 1.373 -5.160 68 HE1 MET 10 HE1 MET 10 3.393 -1.505 -6.164 69 HE2 MET 10 HE2 MET 10 3.958 -2.367 -4.735 70 HE3 MET 10 HE3 MET 10 4.525 -0.728 -5.049 71 H GLU 11 H GLU 11 -0.074 4.160 -3.453 72 HA GLU 11 HA GLU 11 -2.870 3.932 -3.447 73 HB2 GLU 11 HB2 GLU 11 -1.480 4.709 -1.527 74 HB3 GLU 11 HB3 GLU 11 -1.202 6.226 -2.379 75 HG2 GLU 11 HG2 GLU 11 -3.604 6.703 -2.383 76 HG3 GLU 11 HG3 GLU 11 -3.939 5.152 -1.626 77 H GLU 12 H GLU 12 -0.720 6.182 -5.039 78 HA GLU 12 HA GLU 12 -2.653 8.084 -5.934 79 HB2 GLU 12 HB2 GLU 12 -0.163 8.430 -5.970 80 HB3 GLU 12 HB3 GLU 12 -0.069 7.281 -7.301 81 HG2 GLU 12 HG2 GLU 12 -1.610 8.710 -8.626 82 HG3 GLU 12 HG3 GLU 12 -1.630 9.881 -7.310 83 H ILE 13 H ILE 13 -1.200 5.215 -7.381 84 HA ILE 13 HA ILE 13 -2.550 5.227 -9.840 85 HB ILE 13 HB ILE 13 -1.378 2.946 -8.226 86 HG12 ILE 13 HG12 ILE 13 -0.310 4.326 -10.703 87 HG13 ILE 13 HG13 ILE 13 0.089 4.867 -9.074 88 HG21 ILE 13 HG21 ILE 13 -2.907 1.903 -9.768 89 HG22 ILE 13 HG22 ILE 13 -1.315 1.793 -10.519 90 HG23 ILE 13 HG23 ILE 13 -2.462 3.017 -11.061 91 HD11 ILE 13 HD11 ILE 13 1.761 3.260 -10.143 92 HD12 ILE 13 HD12 ILE 13 0.523 2.014 -9.990 93 HD13 ILE 13 HD13 ILE 13 1.170 2.796 -8.548 94 H LEU 14 H LEU 14 -3.438 3.596 -6.755 95 HA LEU 14 HA LEU 14 -5.686 2.219 -7.597 96 HB2 LEU 14 HB2 LEU 14 -4.815 3.436 -5.004 97 HB3 LEU 14 HB3 LEU 14 -6.506 2.962 -5.137 98 HG LEU 14 HG LEU 14 -5.625 0.696 -5.991 99 HD11 LEU 14 HD11 LEU 14 -3.303 1.562 -6.386 100 HD12 LEU 14 HD12 LEU 14 -3.361 0.102 -5.399 101 HD13 LEU 14 HD13 LEU 14 -3.102 1.672 -4.638 102 HD21 LEU 14 HD21 LEU 14 -6.603 0.857 -3.795 103 HD22 LEU 14 HD22 LEU 14 -5.164 1.645 -3.154 104 HD23 LEU 14 HD23 LEU 14 -5.101 -0.052 -3.626 105 H ALA 15 H ALA 15 -5.459 5.598 -6.439 106 HA ALA 15 HA ALA 15 -8.168 6.263 -6.626 107 HB1 ALA 15 HB1 ALA 15 -6.339 7.644 -5.573 108 HB2 ALA 15 HB2 ALA 15 -7.471 8.557 -6.571 109 HB3 ALA 15 HB3 ALA 15 -5.875 8.146 -7.198 110 H SER 16 H SER 16 -5.597 6.658 -9.121 111 HA SER 16 HA SER 16 -7.209 7.822 -11.083 112 HB2 SER 16 HB2 SER 16 -4.765 7.745 -11.231 113 HB3 SER 16 HB3 SER 16 -4.819 5.995 -11.420 114 HG SER 16 HG SER 16 -4.697 7.322 -13.400 115 H ILE 17 H ILE 17 -6.612 4.423 -10.332 116 HA ILE 17 HA ILE 17 -7.853 3.257 -12.567 117 HB ILE 17 HB ILE 17 -7.444 2.237 -9.737 118 HG12 ILE 17 HG12 ILE 17 -5.982 1.516 -12.293 119 HG13 ILE 17 HG13 ILE 17 -5.460 2.841 -11.257 120 HG21 ILE 17 HG21 ILE 17 -9.218 0.889 -10.697 121 HG22 ILE 17 HG22 ILE 17 -7.727 -0.044 -10.826 122 HG23 ILE 17 HG23 ILE 17 -8.373 0.784 -12.242 123 HD11 ILE 17 HD11 ILE 17 -4.387 0.505 -10.879 124 HD12 ILE 17 HD12 ILE 17 -5.921 0.085 -10.117 125 HD13 ILE 17 HD13 ILE 17 -4.943 1.397 -9.463 126 H ARG 18 H ARG 18 -9.209 4.168 -9.394 127 HA ARG 18 HA ARG 18 -11.914 3.942 -10.588 128 HB2 ARG 18 HB2 ARG 18 -12.768 3.025 -8.465 129 HB3 ARG 18 HB3 ARG 18 -11.555 1.972 -9.188 130 HG2 ARG 18 HG2 ARG 18 -9.855 2.762 -7.657 131 HG3 ARG 18 HG3 ARG 18 -10.931 4.010 -7.031 132 HD2 ARG 18 HD2 ARG 18 -12.426 2.317 -6.115 133 HD3 ARG 18 HD3 ARG 18 -11.447 1.033 -6.820 134 HE ARG 18 HE ARG 18 -9.923 1.304 -5.088 135 HH11 ARG 18 HH11 ARG 18 -12.086 4.059 -5.147 136 HH12 ARG 18 HH12 ARG 18 -11.496 4.698 -3.648 137 HH21 ARG 18 HH21 ARG 18 -9.180 2.173 -3.152 138 HH22 ARG 18 HH22 ARG 18 -9.863 3.639 -2.531 139 H ARG 19 H ARG 19 -13.382 5.473 -10.068 140 HA ARG 19 HA ARG 19 -12.567 8.012 -9.236 141 HB2 ARG 19 HB2 ARG 19 -14.657 7.464 -10.520 142 HB3 ARG 19 HB3 ARG 19 -15.368 6.878 -9.017 143 HG2 ARG 19 HG2 ARG 19 -15.032 9.105 -7.996 144 HG3 ARG 19 HG3 ARG 19 -14.343 9.692 -9.509 145 HD2 ARG 19 HD2 ARG 19 -17.148 8.589 -9.183 146 HD3 ARG 19 HD3 ARG 19 -16.741 10.299 -9.278 147 HE ARG 19 HE ARG 19 -16.799 8.401 -11.479 148 HH11 ARG 19 HH11 ARG 19 -15.623 11.508 -10.360 149 HH12 ARG 19 HH12 ARG 19 -15.393 12.126 -11.962 150 HH21 ARG 19 HH21 ARG 19 -16.482 9.243 -13.541 151 HH22 ARG 19 HH22 ARG 19 -15.876 10.852 -13.747 152 H ILE 20 H ILE 20 -12.203 8.908 -7.309 153 HA ILE 20 HA ILE 20 -12.794 7.325 -4.896 154 HB ILE 20 HB ILE 20 -11.099 8.742 -3.783 155 HG12 ILE 20 HG12 ILE 20 -10.525 9.879 -6.538 156 HG13 ILE 20 HG13 ILE 20 -11.509 10.731 -5.349 157 HG21 ILE 20 HG21 ILE 20 -10.503 6.608 -4.942 158 HG22 ILE 20 HG22 ILE 20 -9.174 7.768 -4.925 159 HG23 ILE 20 HG23 ILE 20 -10.124 7.537 -6.393 160 HD11 ILE 20 HD11 ILE 20 -9.270 11.563 -5.103 161 HD12 ILE 20 HD12 ILE 20 -8.598 9.933 -5.101 162 HD13 ILE 20 HD13 ILE 20 -9.558 10.492 -3.732 163 H ILE 21 H ILE 21 -14.092 9.953 -6.547 164 HA ILE 21 HA ILE 21 -14.867 11.484 -4.194 165 HB ILE 21 HB ILE 21 -15.709 11.780 -7.103 166 HG12 ILE 21 HG12 ILE 21 -13.735 13.465 -5.531 167 HG13 ILE 21 HG13 ILE 21 -13.228 12.098 -6.520 168 HG21 ILE 21 HG21 ILE 21 -17.292 12.775 -5.432 169 HG22 ILE 21 HG22 ILE 21 -16.503 13.998 -6.427 170 HG23 ILE 21 HG23 ILE 21 -15.956 13.721 -4.774 171 HD11 ILE 21 HD11 ILE 21 -14.361 13.169 -8.486 172 HD12 ILE 21 HD12 ILE 21 -13.029 14.130 -7.844 173 HD13 ILE 21 HD13 ILE 21 -14.695 14.576 -7.476 174 H SER 22 H SER 22 -16.243 10.403 -2.920 175 HA SER 22 HA SER 22 -18.833 9.592 -4.056 176 HB2 SER 22 HB2 SER 22 -17.171 7.904 -2.172 177 HB3 SER 22 HB3 SER 22 -18.826 7.553 -2.660 178 HG SER 22 HG SER 22 -17.109 6.502 -3.903 179 H GLU 23 H GLU 23 -20.555 9.522 -2.475 180 HA GLU 23 HA GLU 23 -20.000 10.676 0.149 181 HB2 GLU 23 HB2 GLU 23 -21.708 12.445 -0.137 182 HB3 GLU 23 HB3 GLU 23 -20.346 12.663 -1.232 183 HG2 GLU 23 HG2 GLU 23 -21.647 11.600 -3.054 184 HG3 GLU 23 HG3 GLU 23 -23.011 11.400 -1.958 185 H ASP 24 H ASP 24 -21.545 10.215 1.677 186 HA ASP 24 HA ASP 24 -23.994 8.819 0.880 187 HB2 ASP 24 HB2 ASP 24 -21.944 7.206 1.194 188 HB3 ASP 24 HB3 ASP 24 -22.261 7.466 2.910 189 H ASP 25 H ASP 25 -25.588 8.817 2.389 190 HA ASP 25 HA ASP 25 -25.150 10.529 4.753 191 HB2 ASP 25 HB2 ASP 25 -27.715 9.844 3.300 192 HB3 ASP 25 HB3 ASP 25 -27.581 10.919 4.690 193 H ALA 26 H ALA 26 -24.781 7.474 4.375 194 HA ALA 26 HA ALA 26 -26.759 6.150 5.912 195 HB1 ALA 26 HB1 ALA 26 -25.299 4.278 5.890 196 HB2 ALA 26 HB2 ALA 26 -23.875 5.296 5.682 197 HB3 ALA 26 HB3 ALA 26 -25.023 5.105 4.358 198 HA PRO 27 HA PRO 27 -25.663 7.409 10.044 199 HB2 PRO 27 HB2 PRO 27 -26.325 5.198 11.518 200 HB3 PRO 27 HB3 PRO 27 -27.523 6.322 10.846 201 HG2 PRO 27 HG2 PRO 27 -26.614 3.682 9.800 202 HG3 PRO 27 HG3 PRO 27 -28.252 4.351 9.902 203 HD2 PRO 27 HD2 PRO 27 -26.852 4.352 7.581 204 HD3 PRO 27 HD3 PRO 27 -27.988 5.656 7.996 205 H ALA 28 H ALA 28 -24.265 4.520 8.681 206 HA ALA 28 HA ALA 28 -22.278 3.425 9.015 207 HB1 ALA 28 HB1 ALA 28 -20.365 4.808 9.733 208 HB2 ALA 28 HB2 ALA 28 -21.476 6.087 10.225 209 HB3 ALA 28 HB3 ALA 28 -21.340 5.644 8.524 210 H GLU 29 H GLU 29 -23.491 2.072 10.528 211 HA GLU 29 HA GLU 29 -22.240 2.094 13.166 212 HB2 GLU 29 HB2 GLU 29 -24.445 1.682 14.286 213 HB3 GLU 29 HB3 GLU 29 -24.297 3.305 13.618 214 HG2 GLU 29 HG2 GLU 29 -25.569 2.589 11.614 215 HG3 GLU 29 HG3 GLU 29 -25.738 0.977 12.301 216 HA PRO 30 HA PRO 30 -22.910 -2.032 10.953 217 HB2 PRO 30 HB2 PRO 30 -20.321 -2.720 10.516 218 HB3 PRO 30 HB3 PRO 30 -21.251 -1.735 9.375 219 HG2 PRO 30 HG2 PRO 30 -19.272 -0.881 11.440 220 HG3 PRO 30 HG3 PRO 30 -19.458 -0.336 9.762 221 HD2 PRO 30 HD2 PRO 30 -20.422 1.094 11.867 222 HD3 PRO 30 HD3 PRO 30 -21.212 1.092 10.274 223 H ALA 31 H ALA 31 -22.584 -4.116 11.869 224 HA ALA 31 HA ALA 31 -20.938 -4.407 14.250 225 HB1 ALA 31 HB1 ALA 31 -22.800 -3.563 15.401 226 HB2 ALA 31 HB2 ALA 31 -23.015 -5.310 15.502 227 HB3 ALA 31 HB3 ALA 31 -23.945 -4.373 14.332 228 H ALA 32 H ALA 32 -20.747 -6.592 14.958 229 HA ALA 32 HA ALA 32 -21.936 -8.690 13.305 230 HB1 ALA 32 HB1 ALA 32 -18.950 -8.688 13.662 231 HB2 ALA 32 HB2 ALA 32 -19.689 -7.846 12.299 232 HB3 ALA 32 HB3 ALA 32 -19.927 -9.582 12.498 233 H GLU 33 H GLU 33 -21.836 -10.763 14.277 234 HA GLU 33 HA GLU 33 -22.026 -10.797 17.081 235 HB2 GLU 33 HB2 GLU 33 -21.666 -13.021 15.067 236 HB3 GLU 33 HB3 GLU 33 -21.934 -13.311 16.787 237 HG2 GLU 33 HG2 GLU 33 -24.064 -12.170 16.719 238 HG3 GLU 33 HG3 GLU 33 -23.778 -11.629 15.069 239 H ALA 34 H ALA 34 -19.372 -11.774 14.916 240 HA ALA 34 HA ALA 34 -17.150 -12.169 15.291 241 HB1 ALA 34 HB1 ALA 34 -17.538 -9.859 16.502 242 HB2 ALA 34 HB2 ALA 34 -16.030 -10.741 16.741 243 HB3 ALA 34 HB3 ALA 34 -17.299 -10.816 17.964 244 H ALA 35 H ALA 35 -16.709 -14.196 15.593 245 HA ALA 35 HA ALA 35 -17.577 -15.610 17.993 246 HB1 ALA 35 HB1 ALA 35 -16.100 -17.314 16.268 247 HB2 ALA 35 HB2 ALA 35 -17.095 -16.277 15.242 248 HB3 ALA 35 HB3 ALA 35 -17.848 -17.258 16.501 249 HA PRO 36 HA PRO 36 -13.429 -14.706 19.755 250 HB2 PRO 36 HB2 PRO 36 -14.339 -16.827 21.661 251 HB3 PRO 36 HB3 PRO 36 -13.598 -15.249 21.996 252 HG2 PRO 36 HG2 PRO 36 -16.173 -15.582 22.373 253 HG3 PRO 36 HG3 PRO 36 -15.575 -14.096 21.609 254 HD2 PRO 36 HD2 PRO 36 -16.877 -16.482 20.322 255 HD3 PRO 36 HD3 PRO 36 -17.099 -14.752 19.970 256 HA PRO 37 HA PRO 37 -11.878 -19.258 19.411 257 HB2 PRO 37 HB2 PRO 37 -13.495 -21.215 18.463 258 HB3 PRO 37 HB3 PRO 37 -13.451 -20.766 20.180 259 HG2 PRO 37 HG2 PRO 37 -15.420 -20.010 18.077 260 HG3 PRO 37 HG3 PRO 37 -15.694 -20.483 19.763 261 HD2 PRO 37 HD2 PRO 37 -15.704 -17.884 18.912 262 HD3 PRO 37 HD3 PRO 37 -15.274 -18.362 20.568 263 HA PRO 38 HA PRO 38 -10.935 -18.825 15.070 264 HB2 PRO 38 HB2 PRO 38 -9.512 -21.082 14.517 265 HB3 PRO 38 HB3 PRO 38 -8.864 -19.755 15.501 266 HG2 PRO 38 HG2 PRO 38 -10.064 -22.343 16.375 267 HG3 PRO 38 HG3 PRO 38 -8.618 -21.511 16.976 268 HD2 PRO 38 HD2 PRO 38 -11.001 -21.387 18.280 269 HD3 PRO 38 HD3 PRO 38 -9.841 -20.040 18.292 270 HA PRO 39 HA PRO 39 -14.061 -21.030 12.761 271 HB2 PRO 39 HB2 PRO 39 -13.138 -20.898 10.202 272 HB3 PRO 39 HB3 PRO 39 -13.781 -19.486 11.064 273 HG2 PRO 39 HG2 PRO 39 -10.943 -20.300 10.626 274 HG3 PRO 39 HG3 PRO 39 -11.690 -18.697 10.487 275 HD2 PRO 39 HD2 PRO 39 -10.274 -19.440 12.685 276 HD3 PRO 39 HD3 PRO 39 -11.660 -18.331 12.781 277 HA PRO 40 HA PRO 40 -12.706 -25.267 12.318 278 HB2 PRO 40 HB2 PRO 40 -14.561 -26.324 10.625 279 HB3 PRO 40 HB3 PRO 40 -14.927 -25.903 12.310 280 HG2 PRO 40 HG2 PRO 40 -15.485 -24.363 9.815 281 HG3 PRO 40 HG3 PRO 40 -16.531 -24.652 11.218 282 HD2 PRO 40 HD2 PRO 40 -15.182 -22.318 10.888 283 HD3 PRO 40 HD3 PRO 40 -15.505 -23.005 12.496 284 H GLU 41 H GLU 41 -11.597 -26.699 10.930 285 HA GLU 41 HA GLU 41 -10.248 -25.486 8.728 286 HB2 GLU 41 HB2 GLU 41 -10.289 -28.329 9.763 287 HB3 GLU 41 HB3 GLU 41 -9.242 -27.777 8.457 288 HG2 GLU 41 HG2 GLU 41 -9.288 -26.610 11.257 289 HG3 GLU 41 HG3 GLU 41 -8.086 -27.749 10.660 290 HA PRO 42 HA PRO 42 -12.991 -26.651 5.416 291 HB2 PRO 42 HB2 PRO 42 -11.299 -26.900 3.301 292 HB3 PRO 42 HB3 PRO 42 -11.705 -25.329 4.021 293 HG2 PRO 42 HG2 PRO 42 -9.287 -27.028 4.435 294 HG3 PRO 42 HG3 PRO 42 -9.405 -25.275 4.196 295 HD2 PRO 42 HD2 PRO 42 -9.086 -26.385 6.661 296 HD3 PRO 42 HD3 PRO 42 -9.985 -24.872 6.406 297 H GLU 43 H GLU 43 -13.682 -28.414 4.109 298 HA GLU 43 HA GLU 43 -12.174 -30.935 4.421 299 HB2 GLU 43 HB2 GLU 43 -14.300 -32.124 4.837 300 HB3 GLU 43 HB3 GLU 43 -13.973 -30.927 6.087 301 HG2 GLU 43 HG2 GLU 43 -15.494 -29.335 4.961 302 HG3 GLU 43 HG3 GLU 43 -15.826 -30.535 3.714 303 HA PRO 44 HA PRO 44 -12.920 -31.410 0.067 304 HB2 PRO 44 HB2 PRO 44 -13.121 -34.107 -0.261 305 HB3 PRO 44 HB3 PRO 44 -11.586 -33.295 0.104 306 HG2 PRO 44 HG2 PRO 44 -13.444 -34.738 1.939 307 HG3 PRO 44 HG3 PRO 44 -11.674 -34.793 1.854 308 HD2 PRO 44 HD2 PRO 44 -12.989 -33.302 3.711 309 HD3 PRO 44 HD3 PRO 44 -11.417 -32.815 3.041 310 H GLU 45 H GLU 45 -14.553 -31.648 -1.467 311 HA GLU 45 HA GLU 45 -17.159 -32.665 -0.519 312 HB2 GLU 45 HB2 GLU 45 -16.677 -30.092 -2.053 313 HB3 GLU 45 HB3 GLU 45 -18.262 -30.776 -1.697 314 HG2 GLU 45 HG2 GLU 45 -16.214 -29.952 0.387 315 HG3 GLU 45 HG3 GLU 45 -17.625 -29.003 -0.073 316 HA PRO 46 HA PRO 46 -15.937 -34.468 -4.685 317 HB2 PRO 46 HB2 PRO 46 -16.428 -37.081 -4.098 318 HB3 PRO 46 HB3 PRO 46 -14.877 -36.294 -3.740 319 HG2 PRO 46 HG2 PRO 46 -17.180 -36.846 -1.924 320 HG3 PRO 46 HG3 PRO 46 -15.443 -37.055 -1.636 321 HD2 PRO 46 HD2 PRO 46 -16.816 -34.902 -0.696 322 HD3 PRO 46 HD3 PRO 46 -15.106 -34.805 -1.177 323 H VAL 47 H VAL 47 -17.336 -35.295 -6.307 324 HA VAL 47 HA VAL 47 -20.182 -35.566 -5.546 325 HB VAL 47 HB VAL 47 -20.799 -34.349 -7.618 326 HG11 VAL 47 HG11 VAL 47 -18.944 -32.776 -5.806 327 HG12 VAL 47 HG12 VAL 47 -20.620 -33.178 -5.431 328 HG13 VAL 47 HG13 VAL 47 -20.251 -32.115 -6.789 329 HG21 VAL 47 HG21 VAL 47 -17.845 -33.657 -7.777 330 HG22 VAL 47 HG22 VAL 47 -19.114 -33.105 -8.869 331 HG23 VAL 47 HG23 VAL 47 -18.652 -34.807 -8.843 332 H SER 48 H SER 48 -21.468 -36.846 -6.946 333 HA SER 48 HA SER 48 -19.907 -38.837 -8.478 334 HB2 SER 48 HB2 SER 48 -22.599 -39.085 -7.125 335 HB3 SER 48 HB3 SER 48 -21.830 -40.350 -8.080 336 HG SER 48 HG SER 48 -20.063 -40.236 -6.607 337 H PHE 49 H PHE 49 -21.398 -36.134 -9.255 338 HA PHE 49 HA PHE 49 -23.126 -37.207 -11.378 339 HB2 PHE 49 HB2 PHE 49 -22.710 -34.383 -10.375 340 HB3 PHE 49 HB3 PHE 49 -23.791 -34.827 -11.697 341 HD1 PHE 49 HD1 PHE 49 -23.256 -34.898 -8.072 342 HD2 PHE 49 HD2 PHE 49 -25.803 -36.201 -11.276 343 HE1 PHE 49 HE1 PHE 49 -25.029 -35.463 -6.432 344 HE2 PHE 49 HE2 PHE 49 -27.576 -36.766 -9.636 345 HZ PHE 49 HZ PHE 49 -27.189 -36.397 -7.214 346 H ASP 50 H ASP 50 -19.897 -36.497 -11.076 347 HA ASP 50 HA ASP 50 -19.581 -35.168 -13.657 348 HB2 ASP 50 HB2 ASP 50 -18.150 -34.514 -11.752 349 HB3 ASP 50 HB3 ASP 50 -17.503 -36.152 -11.686 350 H ASP 51 H ASP 51 -20.178 -36.612 -15.211 351 HA ASP 51 HA ASP 51 -18.613 -39.126 -15.383 352 HB2 ASP 51 HB2 ASP 51 -21.362 -38.552 -16.514 353 HB3 ASP 51 HB3 ASP 51 -20.475 -40.068 -16.671 354 H GLU 52 H GLU 52 -20.407 -36.861 -17.500 355 HA GLU 52 HA GLU 52 -18.097 -36.439 -19.180 356 HB2 GLU 52 HB2 GLU 52 -19.020 -38.613 -20.024 357 HB3 GLU 52 HB3 GLU 52 -20.554 -37.802 -20.331 358 HG2 GLU 52 HG2 GLU 52 -19.262 -37.883 -22.400 359 HG3 GLU 52 HG3 GLU 52 -19.380 -36.215 -21.852 360 H VAL 53 H VAL 53 -18.311 -34.501 -20.269 361 HA VAL 53 HA VAL 53 -20.799 -33.036 -19.696 362 HB VAL 53 HB VAL 53 -18.041 -31.984 -20.438 363 HG11 VAL 53 HG11 VAL 53 -20.593 -30.541 -19.647 364 HG12 VAL 53 HG12 VAL 53 -19.769 -30.442 -21.203 365 HG13 VAL 53 HG13 VAL 53 -19.008 -29.774 -19.759 366 HG21 VAL 53 HG21 VAL 53 -19.557 -32.072 -17.810 367 HG22 VAL 53 HG22 VAL 53 -18.074 -31.153 -18.068 368 HG23 VAL 53 HG23 VAL 53 -18.054 -32.912 -18.189 369 H LEU 54 H LEU 54 -22.166 -32.669 -21.318 370 HA LEU 54 HA LEU 54 -21.714 -33.560 -23.957 371 HB2 LEU 54 HB2 LEU 54 -23.825 -31.724 -22.803 372 HB3 LEU 54 HB3 LEU 54 -23.854 -32.333 -24.457 373 HG LEU 54 HG LEU 54 -23.703 -34.153 -22.037 374 HD11 LEU 54 HD11 LEU 54 -25.789 -32.788 -22.017 375 HD12 LEU 54 HD12 LEU 54 -26.111 -34.497 -22.309 376 HD13 LEU 54 HD13 LEU 54 -26.146 -33.351 -23.650 377 HD21 LEU 54 HD21 LEU 54 -22.980 -35.242 -24.072 378 HD22 LEU 54 HD22 LEU 54 -24.328 -34.560 -24.980 379 HD23 LEU 54 HD23 LEU 54 -24.625 -35.789 -23.751 380 H GLU 55 H GLU 55 -21.401 -32.456 -25.868 381 HA GLU 55 HA GLU 55 -19.919 -29.945 -25.624 382 HB2 GLU 55 HB2 GLU 55 -19.222 -32.024 -27.023 383 HB3 GLU 55 HB3 GLU 55 -20.403 -31.442 -28.194 384 HG2 GLU 55 HG2 GLU 55 -19.239 -29.263 -28.291 385 HG3 GLU 55 HG3 GLU 55 -18.065 -29.837 -27.112 386 H LEU 56 H LEU 56 -22.945 -30.171 -25.386 387 HA LEU 56 HA LEU 56 -23.666 -28.265 -27.533 388 HB2 LEU 56 HB2 LEU 56 -25.423 -30.265 -26.090 389 HB3 LEU 56 HB3 LEU 56 -26.004 -29.059 -27.235 390 HG LEU 56 HG LEU 56 -23.898 -31.129 -27.930 391 HD11 LEU 56 HD11 LEU 56 -25.645 -32.429 -28.965 392 HD12 LEU 56 HD12 LEU 56 -26.846 -31.181 -28.630 393 HD13 LEU 56 HD13 LEU 56 -26.147 -32.112 -27.305 394 HD21 LEU 56 HD21 LEU 56 -23.836 -29.231 -29.426 395 HD22 LEU 56 HD22 LEU 56 -25.595 -29.194 -29.542 396 HD23 LEU 56 HD23 LEU 56 -24.691 -30.521 -30.272 397 H THR 57 H THR 57 -24.842 -26.472 -27.006 398 HA THR 57 HA THR 57 -25.664 -25.979 -24.262 399 HB THR 57 HB THR 57 -23.296 -25.381 -24.146 400 HG1 THR 57 HG1 THR 57 -24.869 -23.035 -24.288 401 HG21 THR 57 HG21 THR 57 -23.808 -23.235 -26.208 402 HG22 THR 57 HG22 THR 57 -23.183 -24.820 -26.661 403 HG23 THR 57 HG23 THR 57 -22.262 -23.789 -25.566 404 H ASP 58 H ASP 58 -27.301 -24.563 -24.105 405 HA ASP 58 HA ASP 58 -28.357 -23.431 -26.593 406 HB2 ASP 58 HB2 ASP 58 -29.575 -23.675 -23.829 407 HB3 ASP 58 HB3 ASP 58 -30.398 -23.019 -25.239 408 HA PRO 59 HA PRO 59 -27.025 -19.325 -25.487 409 HB2 PRO 59 HB2 PRO 59 -28.932 -17.745 -26.630 410 HB3 PRO 59 HB3 PRO 59 -27.706 -18.611 -27.580 411 HG2 PRO 59 HG2 PRO 59 -30.550 -19.342 -27.047 412 HG3 PRO 59 HG3 PRO 59 -29.628 -19.430 -28.559 413 HD2 PRO 59 HD2 PRO 59 -30.074 -21.620 -27.006 414 HD3 PRO 59 HD3 PRO 59 -28.596 -21.426 -27.976 415 H ILE 60 H ILE 60 -27.294 -17.841 -23.842 416 HA ILE 60 HA ILE 60 -29.772 -17.124 -22.676 417 HB ILE 60 HB ILE 60 -29.591 -19.522 -21.917 418 HG12 ILE 60 HG12 ILE 60 -30.013 -18.924 -19.451 419 HG13 ILE 60 HG13 ILE 60 -29.687 -17.258 -19.917 420 HG21 ILE 60 HG21 ILE 60 -27.946 -20.264 -20.433 421 HG22 ILE 60 HG22 ILE 60 -27.474 -18.630 -19.970 422 HG23 ILE 60 HG23 ILE 60 -27.020 -19.264 -21.551 423 HD11 ILE 60 HD11 ILE 60 -31.706 -18.938 -21.405 424 HD12 ILE 60 HD12 ILE 60 -31.543 -17.183 -21.389 425 HD13 ILE 60 HD13 ILE 60 -32.147 -18.024 -19.962 426 H ALA 61 H ALA 61 -27.679 -15.667 -23.613 427 HA ALA 61 HA ALA 61 -25.702 -14.896 -21.776 428 HB1 ALA 61 HB1 ALA 61 -25.286 -14.109 -23.906 429 HB2 ALA 61 HB2 ALA 61 -25.917 -12.650 -23.143 430 HB3 ALA 61 HB3 ALA 61 -26.962 -13.630 -24.172 431 HA PRO 62 HA PRO 62 -28.561 -11.367 -20.212 432 HB2 PRO 62 HB2 PRO 62 -31.211 -11.359 -20.792 433 HB3 PRO 62 HB3 PRO 62 -29.999 -10.630 -21.864 434 HG2 PRO 62 HG2 PRO 62 -31.350 -13.280 -22.062 435 HG3 PRO 62 HG3 PRO 62 -30.998 -12.096 -23.333 436 HD2 PRO 62 HD2 PRO 62 -29.469 -14.319 -22.912 437 HD3 PRO 62 HD3 PRO 62 -28.813 -12.811 -23.584 438 H GLU 63 H GLU 63 -29.463 -11.312 -18.174 439 HA GLU 63 HA GLU 63 -30.944 -13.672 -17.217 440 HB2 GLU 63 HB2 GLU 63 -28.519 -12.438 -15.886 441 HB3 GLU 63 HB3 GLU 63 -29.581 -13.619 -15.121 442 HG2 GLU 63 HG2 GLU 63 -28.074 -14.089 -17.711 443 HG3 GLU 63 HG3 GLU 63 -27.540 -14.652 -16.131 444 HA PRO 64 HA PRO 64 -33.657 -10.643 -15.339 445 HB2 PRO 64 HB2 PRO 64 -33.595 -12.367 -12.892 446 HB3 PRO 64 HB3 PRO 64 -34.991 -11.745 -13.796 447 HG2 PRO 64 HG2 PRO 64 -34.313 -14.272 -14.022 448 HG3 PRO 64 HG3 PRO 64 -34.788 -13.349 -15.461 449 HD2 PRO 64 HD2 PRO 64 -32.027 -14.134 -14.555 450 HD3 PRO 64 HD3 PRO 64 -32.715 -14.130 -16.197 451 H GLU 65 H GLU 65 -31.050 -11.960 -13.361 452 HA GLU 65 HA GLU 65 -30.230 -9.291 -12.532 453 HB2 GLU 65 HB2 GLU 65 -30.156 -9.904 -10.134 454 HB3 GLU 65 HB3 GLU 65 -31.803 -9.904 -10.756 455 HG2 GLU 65 HG2 GLU 65 -31.690 -12.366 -11.036 456 HG3 GLU 65 HG3 GLU 65 -30.054 -12.358 -10.385 457 H LEU 66 H LEU 66 -28.080 -9.345 -11.459 458 HA LEU 66 HA LEU 66 -26.494 -11.626 -12.466 459 HB2 LEU 66 HB2 LEU 66 -25.739 -8.736 -12.016 460 HB3 LEU 66 HB3 LEU 66 -24.546 -10.000 -12.294 461 HG LEU 66 HG LEU 66 -25.804 -10.557 -14.437 462 HD11 LEU 66 HD11 LEU 66 -27.931 -9.569 -14.188 463 HD12 LEU 66 HD12 LEU 66 -27.113 -8.492 -15.316 464 HD13 LEU 66 HD13 LEU 66 -27.258 -8.044 -13.615 465 HD21 LEU 66 HD21 LEU 66 -24.505 -7.846 -14.058 466 HD22 LEU 66 HD22 LEU 66 -24.857 -8.541 -15.641 467 HD23 LEU 66 HD23 LEU 66 -23.724 -9.347 -14.555 468 HA PRO 67 HA PRO 67 -25.449 -12.811 -8.290 469 HB2 PRO 67 HB2 PRO 67 -22.646 -13.220 -9.223 470 HB3 PRO 67 HB3 PRO 67 -23.750 -14.363 -8.435 471 HG2 PRO 67 HG2 PRO 67 -23.204 -14.584 -11.007 472 HG3 PRO 67 HG3 PRO 67 -24.850 -14.860 -10.403 473 HD2 PRO 67 HD2 PRO 67 -23.742 -12.441 -11.808 474 HD3 PRO 67 HD3 PRO 67 -25.314 -13.247 -12.019 475 HA PRO 68 HA PRO 68 -23.578 -9.073 -6.617 476 HB2 PRO 68 HB2 PRO 68 -23.077 -9.820 -4.042 477 HB3 PRO 68 HB3 PRO 68 -24.710 -9.470 -4.643 478 HG2 PRO 68 HG2 PRO 68 -23.369 -12.102 -4.233 479 HG3 PRO 68 HG3 PRO 68 -25.030 -11.611 -3.854 480 HD2 PRO 68 HD2 PRO 68 -24.412 -13.058 -6.078 481 HD3 PRO 68 HD3 PRO 68 -25.762 -11.902 -6.035 482 H LEU 69 H LEU 69 -21.548 -8.193 -6.399 483 HA LEU 69 HA LEU 69 -19.256 -10.042 -6.100 484 HB2 LEU 69 HB2 LEU 69 -19.542 -9.370 -8.476 485 HB3 LEU 69 HB3 LEU 69 -19.441 -7.679 -7.997 486 HG LEU 69 HG LEU 69 -17.149 -8.147 -7.061 487 HD11 LEU 69 HD11 LEU 69 -17.631 -10.831 -8.388 488 HD12 LEU 69 HD12 LEU 69 -17.264 -10.534 -6.689 489 HD13 LEU 69 HD13 LEU 69 -16.034 -10.247 -7.920 490 HD21 LEU 69 HD21 LEU 69 -17.571 -7.232 -9.369 491 HD22 LEU 69 HD22 LEU 69 -17.442 -8.879 -9.988 492 HD23 LEU 69 HD23 LEU 69 -16.051 -8.114 -9.219 493 H GLU 70 H GLU 70 -17.963 -9.493 -4.462 494 HA GLU 70 HA GLU 70 -18.022 -6.699 -3.475 495 HB2 GLU 70 HB2 GLU 70 -17.701 -9.304 -1.972 496 HB3 GLU 70 HB3 GLU 70 -17.384 -7.720 -1.257 497 HG2 GLU 70 HG2 GLU 70 -19.669 -7.019 -1.637 498 HG3 GLU 70 HG3 GLU 70 -20.012 -8.475 -2.563 499 H THR 71 H THR 71 -16.129 -5.649 -3.216 500 HA THR 71 HA THR 71 -13.607 -7.157 -3.436 501 HB THR 71 HB THR 71 -14.219 -4.626 -4.992 502 HG1 THR 71 HG1 THR 71 -14.675 -5.892 -6.618 503 HG21 THR 71 HG21 THR 71 -11.872 -6.476 -5.383 504 HG22 THR 71 HG22 THR 71 -11.801 -5.186 -4.183 505 HG23 THR 71 HG23 THR 71 -12.047 -4.795 -5.883 506 H VAL 72 H VAL 72 -12.178 -6.556 -1.909 507 HA VAL 72 HA VAL 72 -12.483 -3.893 -0.647 508 HB VAL 72 HB VAL 72 -11.886 -6.512 0.774 509 HG11 VAL 72 HG11 VAL 72 -10.701 -4.595 1.784 510 HG12 VAL 72 HG12 VAL 72 -12.003 -5.152 2.835 511 HG13 VAL 72 HG13 VAL 72 -12.217 -3.696 1.863 512 HG21 VAL 72 HG21 VAL 72 -14.291 -4.676 1.003 513 HG22 VAL 72 HG22 VAL 72 -14.061 -6.220 1.825 514 HG23 VAL 72 HG23 VAL 72 -14.274 -6.176 0.074 515 H GLY 73 H GLY 73 -10.673 -2.720 -0.702 516 HA2 GLY 73 HA2 GLY 73 -8.153 -3.979 -1.525 517 HA3 GLY 73 HA3 GLY 73 -8.492 -2.249 -1.488 518 H ASP 74 H ASP 74 -6.140 -2.843 -0.425 519 HA ASP 74 HA ASP 74 -6.357 -1.996 2.272 520 HB2 ASP 74 HB2 ASP 74 -6.982 -4.431 2.510 521 HB3 ASP 74 HB3 ASP 74 -5.347 -4.827 1.977 522 H ILE 75 H ILE 75 -4.962 -0.466 1.201 523 HA ILE 75 HA ILE 75 -2.465 -1.075 0.064 524 HB ILE 75 HB ILE 75 -3.423 1.425 1.505 525 HG12 ILE 75 HG12 ILE 75 -3.051 0.908 -1.460 526 HG13 ILE 75 HG13 ILE 75 -4.578 0.608 -0.634 527 HG21 ILE 75 HG21 ILE 75 -1.016 1.539 1.531 528 HG22 ILE 75 HG22 ILE 75 -1.537 2.520 0.161 529 HG23 ILE 75 HG23 ILE 75 -0.904 0.897 -0.108 530 HD11 ILE 75 HD11 ILE 75 -4.237 2.919 -1.787 531 HD12 ILE 75 HD12 ILE 75 -3.212 3.290 -0.402 532 HD13 ILE 75 HD13 ILE 75 -4.913 2.892 -0.158 533 H ASP 76 H ASP 76 -3.375 -0.268 3.407 534 HA ASP 76 HA ASP 76 -2.335 -0.595 5.406 535 HB2 ASP 76 HB2 ASP 76 -2.368 -2.976 4.399 536 HB3 ASP 76 HB3 ASP 76 -0.650 -2.722 4.104 537 H VAL 77 H VAL 77 -1.300 1.433 5.398 538 HA VAL 77 HA VAL 77 1.322 1.793 4.248 539 HB VAL 77 HB VAL 77 -0.235 3.520 6.205 540 HG11 VAL 77 HG11 VAL 77 1.302 5.324 5.460 541 HG12 VAL 77 HG12 VAL 77 2.209 4.145 4.513 542 HG13 VAL 77 HG13 VAL 77 2.173 4.023 6.272 543 HG21 VAL 77 HG21 VAL 77 -0.719 4.880 4.179 544 HG22 VAL 77 HG22 VAL 77 -1.387 3.253 4.054 545 HG23 VAL 77 HG23 VAL 77 0.094 3.667 3.191 546 H TYR 78 H TYR 78 3.278 1.598 5.224 547 HA TYR 78 HA TYR 78 3.676 1.588 8.037 548 HB2 TYR 78 HB2 TYR 78 4.420 -0.759 8.305 549 HB3 TYR 78 HB3 TYR 78 2.702 -0.648 7.937 550 HD1 TYR 78 HD1 TYR 78 6.033 -1.541 6.599 551 HD2 TYR 78 HD2 TYR 78 1.811 -1.435 5.827 552 HE1 TYR 78 HE1 TYR 78 6.356 -3.007 4.623 553 HE2 TYR 78 HE2 TYR 78 2.133 -2.898 3.853 554 HH TYR 78 HH TYR 78 4.497 -3.301 2.232 555 H SER 79 H SER 79 5.942 1.302 8.620 556 HA SER 79 HA SER 79 7.768 1.653 6.313 557 HB2 SER 79 HB2 SER 79 7.460 3.742 7.588 558 HB3 SER 79 HB3 SER 79 7.955 2.913 9.062 559 HG SER 79 HG SER 79 9.483 3.333 6.703 560 HA PRO 80 HA PRO 80 9.108 -2.273 8.411 561 HB2 PRO 80 HB2 PRO 80 10.814 -2.329 5.956 562 HB3 PRO 80 HB3 PRO 80 9.858 -3.625 6.700 563 HG2 PRO 80 HG2 PRO 80 8.989 -2.456 4.516 564 HG3 PRO 80 HG3 PRO 80 7.862 -2.826 5.835 565 HD2 PRO 80 HD2 PRO 80 9.090 -0.178 5.100 566 HD3 PRO 80 HD3 PRO 80 7.423 -0.543 5.601 567 HA PRO 81 HA PRO 81 13.804 -0.699 8.162 568 HB2 PRO 81 HB2 PRO 81 13.216 2.196 7.699 569 HB3 PRO 81 HB3 PRO 81 14.581 1.216 7.128 570 HG2 PRO 81 HG2 PRO 81 12.663 1.900 5.464 571 HG3 PRO 81 HG3 PRO 81 13.347 0.263 5.416 572 HD2 PRO 81 HD2 PRO 81 10.735 1.178 6.589 573 HD3 PRO 81 HD3 PRO 81 11.100 -0.294 5.660 574 H GLU 82 H GLU 82 14.516 -0.558 10.199 575 HA GLU 82 HA GLU 82 12.897 0.337 12.340 576 HB2 GLU 82 HB2 GLU 82 15.819 -0.397 12.174 577 HB3 GLU 82 HB3 GLU 82 15.048 0.081 13.683 578 HG2 GLU 82 HG2 GLU 82 14.127 -2.204 11.912 579 HG3 GLU 82 HG3 GLU 82 15.089 -2.392 13.375 580 HA PRO 83 HA PRO 83 15.692 4.239 12.620 581 HB2 PRO 83 HB2 PRO 83 17.303 4.941 10.556 582 HB3 PRO 83 HB3 PRO 83 17.830 3.828 11.835 583 HG2 PRO 83 HG2 PRO 83 16.831 3.217 9.092 584 HG3 PRO 83 HG3 PRO 83 18.202 2.519 9.973 585 HD2 PRO 83 HD2 PRO 83 15.793 1.270 9.786 586 HD3 PRO 83 HD3 PRO 83 16.865 1.077 11.187 587 H GLU 84 H GLU 84 15.183 6.388 12.001 588 HA GLU 84 HA GLU 84 13.811 8.001 11.122 589 HB2 GLU 84 HB2 GLU 84 14.507 6.531 8.564 590 HB3 GLU 84 HB3 GLU 84 13.782 8.137 8.642 591 HG2 GLU 84 HG2 GLU 84 15.737 8.955 9.916 592 HG3 GLU 84 HG3 GLU 84 16.465 7.352 9.822 593 H SER 85 H SER 85 12.236 6.388 12.379 594 HA SER 85 HA SER 85 10.203 5.233 10.628 595 HB2 SER 85 HB2 SER 85 10.793 3.976 12.628 596 HB3 SER 85 HB3 SER 85 10.448 5.373 13.645 597 HG SER 85 HG SER 85 8.477 4.666 13.663 598 H GLU 86 H GLU 86 8.272 6.173 10.181 599 HA GLU 86 HA GLU 86 7.459 8.547 11.715 600 HB2 GLU 86 HB2 GLU 86 8.726 9.266 9.663 601 HB3 GLU 86 HB3 GLU 86 7.479 8.488 8.688 602 HG2 GLU 86 HG2 GLU 86 6.926 10.840 8.883 603 HG3 GLU 86 HG3 GLU 86 5.767 9.919 9.834 604 HA PRO 87 HA PRO 87 3.922 5.597 10.854 605 HB2 PRO 87 HB2 PRO 87 2.887 5.548 13.371 606 HB3 PRO 87 HB3 PRO 87 4.211 4.482 12.861 607 HG2 PRO 87 HG2 PRO 87 4.326 7.031 14.408 608 HG3 PRO 87 HG3 PRO 87 5.196 5.509 14.677 609 HD2 PRO 87 HD2 PRO 87 6.355 7.649 13.453 610 HD3 PRO 87 HD3 PRO 87 6.788 5.971 13.053 611 H ALA 88 H ALA 88 1.780 6.178 10.478 612 HA ALA 88 HA ALA 88 0.613 8.542 11.669 613 HB1 ALA 88 HB1 ALA 88 0.228 9.616 9.402 614 HB2 ALA 88 HB2 ALA 88 1.456 8.520 8.769 615 HB3 ALA 88 HB3 ALA 88 1.881 9.698 10.011 616 H TYR 89 H TYR 89 -1.616 8.733 11.265 617 HA TYR 89 HA TYR 89 -2.959 6.907 9.470 618 HB2 TYR 89 HB2 TYR 89 -2.428 5.517 11.513 619 HB3 TYR 89 HB3 TYR 89 -3.466 6.601 12.439 620 HD1 TYR 89 HD1 TYR 89 -3.383 4.172 9.634 621 HD2 TYR 89 HD2 TYR 89 -5.860 6.490 12.268 622 HE1 TYR 89 HE1 TYR 89 -5.376 2.906 8.874 623 HE2 TYR 89 HE2 TYR 89 -7.853 5.225 11.508 624 HH TYR 89 HH TYR 89 -7.664 2.344 9.818 625 H THR 90 H THR 90 -3.534 9.071 8.728 626 HA THR 90 HA THR 90 -5.233 10.728 10.390 627 HB THR 90 HB THR 90 -5.420 12.138 8.367 628 HG1 THR 90 HG1 THR 90 -5.162 11.177 6.546 629 HG21 THR 90 HG21 THR 90 -3.487 12.452 9.836 630 HG22 THR 90 HG22 THR 90 -3.011 12.690 8.155 631 HG23 THR 90 HG23 THR 90 -2.609 11.185 8.981 632 HA PRO 91 HA PRO 91 -9.119 8.922 9.183 633 HB2 PRO 91 HB2 PRO 91 -10.828 11.036 9.158 634 HB3 PRO 91 HB3 PRO 91 -10.150 10.374 10.660 635 HG2 PRO 91 HG2 PRO 91 -9.296 12.767 9.096 636 HG3 PRO 91 HG3 PRO 91 -9.483 12.574 10.848 637 HD2 PRO 91 HD2 PRO 91 -7.056 12.445 9.620 638 HD3 PRO 91 HD3 PRO 91 -7.432 11.522 11.092 639 HA PRO 92 HA PRO 92 -9.497 9.383 4.747 640 HB2 PRO 92 HB2 PRO 92 -11.993 8.394 4.262 641 HB3 PRO 92 HB3 PRO 92 -10.614 7.365 4.698 642 HG2 PRO 92 HG2 PRO 92 -12.828 8.386 6.415 643 HG3 PRO 92 HG3 PRO 92 -12.091 6.774 6.363 644 HD2 PRO 92 HD2 PRO 92 -11.447 8.603 8.273 645 HD3 PRO 92 HD3 PRO 92 -10.281 7.406 7.666 646 HA PRO 93 HA PRO 93 -11.591 13.296 4.109 647 HB2 PRO 93 HB2 PRO 93 -11.788 13.397 1.392 648 HB3 PRO 93 HB3 PRO 93 -10.258 13.626 2.260 649 HG2 PRO 93 HG2 PRO 93 -11.307 11.194 0.889 650 HG3 PRO 93 HG3 PRO 93 -9.672 11.880 0.874 651 HD2 PRO 93 HD2 PRO 93 -10.343 9.759 2.444 652 HD3 PRO 93 HD3 PRO 93 -9.114 10.950 2.924 653 H ALA 94 H ALA 94 -12.942 10.395 2.653 654 HA ALA 94 HA ALA 94 -15.642 11.226 3.272 655 HB1 ALA 94 HB1 ALA 94 -16.421 10.891 0.900 656 HB2 ALA 94 HB2 ALA 94 -14.728 10.969 0.413 657 HB3 ALA 94 HB3 ALA 94 -15.491 12.363 1.177 658 H ALA 95 H ALA 95 -17.197 9.588 3.038 659 HA ALA 95 HA ALA 95 -17.910 7.425 3.325 660 HB1 ALA 95 HB1 ALA 95 -16.389 5.971 1.505 661 HB2 ALA 95 HB2 ALA 95 -16.331 7.626 0.884 662 HB3 ALA 95 HB3 ALA 95 -17.888 6.834 1.152 663 HA PRO 96 HA PRO 96 -14.152 6.522 6.099 664 HB2 PRO 96 HB2 PRO 96 -16.482 5.847 7.860 665 HB3 PRO 96 HB3 PRO 96 -14.953 6.653 8.273 666 HG2 PRO 96 HG2 PRO 96 -17.149 8.072 8.045 667 HG3 PRO 96 HG3 PRO 96 -15.628 8.678 7.359 668 HD2 PRO 96 HD2 PRO 96 -17.968 7.432 5.941 669 HD3 PRO 96 HD3 PRO 96 -16.947 8.801 5.441 670 H VAL 97 H VAL 97 -17.184 4.767 5.583 671 HA VAL 97 HA VAL 97 -15.990 2.184 6.147 672 HB VAL 97 HB VAL 97 -18.211 1.280 5.506 673 HG11 VAL 97 HG11 VAL 97 -17.795 2.014 7.814 674 HG12 VAL 97 HG12 VAL 97 -19.466 2.339 7.354 675 HG13 VAL 97 HG13 VAL 97 -18.290 3.653 7.391 676 HG21 VAL 97 HG21 VAL 97 -18.683 3.087 3.786 677 HG22 VAL 97 HG22 VAL 97 -19.026 4.179 5.127 678 HG23 VAL 97 HG23 VAL 97 -20.026 2.747 4.878 679 H PHE 98 H PHE 98 -15.850 0.457 4.628 680 HA PHE 98 HA PHE 98 -15.138 -0.486 2.662 681 HB2 PHE 98 HB2 PHE 98 -16.971 1.629 1.502 682 HB3 PHE 98 HB3 PHE 98 -16.264 0.299 0.580 683 HD1 PHE 98 HD1 PHE 98 -18.758 1.250 3.094 684 HD2 PHE 98 HD2 PHE 98 -16.913 -2.040 1.039 685 HE1 PHE 98 HE1 PHE 98 -20.584 -0.247 3.851 686 HE2 PHE 98 HE2 PHE 98 -18.740 -3.537 1.797 687 HZ PHE 98 HZ PHE 98 -20.575 -2.640 3.203 688 H ASP 99 H ASP 99 -13.931 -0.062 0.605 689 HA ASP 99 HA ASP 99 -12.135 2.255 0.960 690 HB2 ASP 99 HB2 ASP 99 -11.656 -0.381 -0.452 691 HB3 ASP 99 HB3 ASP 99 -10.480 0.921 -0.284 692 H ARG 100 H ARG 100 -14.760 2.230 -0.472 693 HA ARG 100 HA ARG 100 -15.702 3.062 -2.394 694 HB2 ARG 100 HB2 ARG 100 -12.939 4.235 -2.415 695 HB3 ARG 100 HB3 ARG 100 -13.952 4.432 -3.842 696 HG2 ARG 100 HG2 ARG 100 -14.430 6.347 -2.538 697 HG3 ARG 100 HG3 ARG 100 -15.777 5.260 -2.207 698 HD2 ARG 100 HD2 ARG 100 -14.959 6.206 -0.112 699 HD3 ARG 100 HD3 ARG 100 -14.607 4.483 -0.152 700 HE ARG 100 HE ARG 100 -12.406 5.959 -1.188 701 HH11 ARG 100 HH11 ARG 100 -13.995 5.183 1.839 702 HH12 ARG 100 HH12 ARG 100 -12.553 5.382 2.779 703 HH21 ARG 100 HH21 ARG 100 -10.559 6.213 0.073 704 HH22 ARG 100 HH22 ARG 100 -10.625 5.961 1.785 705 H ASP 101 H ASP 101 -14.156 0.404 -2.390 706 HA ASP 101 HA ASP 101 -13.089 -0.023 -4.986 707 HB2 ASP 101 HB2 ASP 101 -12.981 -1.488 -2.795 708 HB3 ASP 101 HB3 ASP 101 -14.435 -2.225 -3.465 709 H GLU 102 H GLU 102 -14.075 -1.237 -6.758 710 HA GLU 102 HA GLU 102 -16.798 -1.900 -6.898 711 HB2 GLU 102 HB2 GLU 102 -17.638 -0.065 -8.354 712 HB3 GLU 102 HB3 GLU 102 -17.276 0.478 -6.719 713 HG2 GLU 102 HG2 GLU 102 -15.022 1.246 -7.556 714 HG3 GLU 102 HG3 GLU 102 -15.562 0.867 -9.190 715 H VAL 103 H VAL 103 -14.042 -0.605 -8.718 716 HA VAL 103 HA VAL 103 -14.648 -2.525 -10.885 717 HB VAL 103 HB VAL 103 -14.785 -0.115 -11.493 718 HG11 VAL 103 HG11 VAL 103 -11.809 -0.117 -10.919 719 HG12 VAL 103 HG12 VAL 103 -13.037 0.733 -9.982 720 HG13 VAL 103 HG13 VAL 103 -12.718 1.207 -11.650 721 HG21 VAL 103 HG21 VAL 103 -13.780 -0.397 -13.587 722 HG22 VAL 103 HG22 VAL 103 -13.985 -2.062 -13.049 723 HG23 VAL 103 HG23 VAL 103 -12.407 -1.285 -12.931 724 H ALA 104 H ALA 104 -13.187 -3.169 -8.445 725 HA ALA 104 HA ALA 104 -11.316 -4.322 -7.783 726 HB1 ALA 104 HB1 ALA 104 -11.958 -5.529 -9.969 727 HB2 ALA 104 HB2 ALA 104 -10.315 -5.761 -9.372 728 HB3 ALA 104 HB3 ALA 104 -10.619 -4.644 -10.703 729 H GLU 105 H GLU 105 -8.711 -4.468 -8.924 730 HA GLU 105 HA GLU 105 -7.748 -1.792 -9.446 731 HB2 GLU 105 HB2 GLU 105 -7.620 -2.993 -6.741 732 HB3 GLU 105 HB3 GLU 105 -6.070 -2.412 -7.338 733 HG2 GLU 105 HG2 GLU 105 -6.794 -0.183 -7.456 734 HG3 GLU 105 HG3 GLU 105 -8.499 -0.642 -7.555 735 H GLN 106 H GLN 106 -5.490 -1.788 -9.996 736 HA GLN 106 HA GLN 106 -4.593 -4.391 -11.034 737 HB2 GLN 106 HB2 GLN 106 -3.686 -1.583 -11.716 738 HB3 GLN 106 HB3 GLN 106 -3.086 -3.058 -12.471 739 HG2 GLN 106 HG2 GLN 106 -5.979 -2.139 -12.503 740 HG3 GLN 106 HG3 GLN 106 -4.848 -1.961 -13.841 741 HE21 GLN 106 HE21 GLN 106 -7.336 -3.899 -12.834 742 HE22 GLN 106 HE22 GLN 106 -6.882 -5.356 -13.577 743 H LEU 107 H LEU 107 -4.209 -3.000 -8.203 744 HA LEU 107 HA LEU 107 -1.325 -3.633 -8.017 745 HB2 LEU 107 HB2 LEU 107 -2.883 -1.334 -6.848 746 HB3 LEU 107 HB3 LEU 107 -1.406 -1.908 -6.067 747 HG LEU 107 HG LEU 107 -1.502 -1.210 -9.013 748 HD11 LEU 107 HD11 LEU 107 -2.107 0.829 -7.933 749 HD12 LEU 107 HD12 LEU 107 -0.372 0.948 -8.230 750 HD13 LEU 107 HD13 LEU 107 -0.966 0.555 -6.616 751 HD21 LEU 107 HD21 LEU 107 0.419 -2.532 -8.422 752 HD22 LEU 107 HD22 LEU 107 0.689 -1.597 -6.951 753 HD23 LEU 107 HD23 LEU 107 0.983 -0.865 -8.528 754 H VAL 108 H VAL 108 -4.121 -3.062 -5.838 755 HA VAL 108 HA VAL 108 -3.651 -5.687 -4.619 756 HB VAL 108 HB VAL 108 -2.300 -4.084 -3.313 757 HG11 VAL 108 HG11 VAL 108 -3.703 -2.074 -3.785 758 HG12 VAL 108 HG12 VAL 108 -3.348 -2.274 -2.069 759 HG13 VAL 108 HG13 VAL 108 -4.935 -2.716 -2.699 760 HG21 VAL 108 HG21 VAL 108 -3.567 -6.045 -2.260 761 HG22 VAL 108 HG22 VAL 108 -4.740 -4.854 -1.699 762 HG23 VAL 108 HG23 VAL 108 -3.064 -4.763 -1.158 763 H GLY 109 H GLY 109 -5.461 -6.614 -3.687 764 HA2 GLY 109 HA2 GLY 109 -7.917 -5.171 -3.276 765 HA3 GLY 109 HA3 GLY 109 -7.956 -6.171 -4.724 766 H VAL 110 H VAL 110 -7.375 -6.270 -1.215 767 HA VAL 110 HA VAL 110 -8.647 -8.906 -1.115 768 HB VAL 110 HB VAL 110 -6.902 -9.764 0.432 769 HG11 VAL 110 HG11 VAL 110 -5.269 -10.286 -1.282 770 HG12 VAL 110 HG12 VAL 110 -5.748 -8.876 -2.226 771 HG13 VAL 110 HG13 VAL 110 -6.863 -10.228 -2.034 772 HG21 VAL 110 HG21 VAL 110 -6.040 -7.520 1.151 773 HG22 VAL 110 HG22 VAL 110 -5.315 -7.324 -0.445 774 HG23 VAL 110 HG23 VAL 110 -4.755 -8.609 0.626 775 H SER 111 H SER 111 -9.562 -9.393 0.983 776 HA SER 111 HA SER 111 -10.504 -7.069 2.368 777 HB2 SER 111 HB2 SER 111 -11.750 -8.624 3.727 778 HB3 SER 111 HB3 SER 111 -11.818 -9.185 2.059 779 HG SER 111 HG SER 111 -10.345 -10.180 4.243 780 H ALA 112 H ALA 112 -10.254 -6.682 4.674 781 HA ALA 112 HA ALA 112 -8.055 -7.921 6.088 782 HB1 ALA 112 HB1 ALA 112 -6.620 -6.453 4.995 783 HB2 ALA 112 HB2 ALA 112 -7.044 -5.529 6.436 784 HB3 ALA 112 HB3 ALA 112 -7.833 -5.177 4.898 785 H ALA 113 H ALA 113 -7.886 -7.158 8.300 786 HA ALA 113 HA ALA 113 -10.007 -5.417 9.295 787 HB1 ALA 113 HB1 ALA 113 -9.732 -8.229 10.370 788 HB2 ALA 113 HB2 ALA 113 -10.956 -7.759 9.190 789 HB3 ALA 113 HB3 ALA 113 -10.952 -7.029 10.796 790 H SER 114 H SER 114 -9.583 -4.576 11.345 791 HA SER 114 HA SER 114 -7.295 -5.479 12.878 792 HB2 SER 114 HB2 SER 114 -6.023 -3.420 12.715 793 HB3 SER 114 HB3 SER 114 -6.259 -4.080 11.100 794 HG SER 114 HG SER 114 -7.463 -1.863 12.341 795 H ALA 115 H ALA 115 -7.045 -4.330 14.890 796 HA ALA 115 HA ALA 115 -9.029 -2.404 15.722 797 HB1 ALA 115 HB1 ALA 115 -10.530 -4.077 16.205 798 HB2 ALA 115 HB2 ALA 115 -9.587 -4.124 17.696 799 HB3 ALA 115 HB3 ALA 115 -9.270 -5.294 16.413 800 H ALA 116 H ALA 116 -8.590 -1.577 17.853 801 HA ALA 116 HA ALA 116 -6.040 -2.439 19.039 802 HB1 ALA 116 HB1 ALA 116 -6.674 0.484 18.675 803 HB2 ALA 116 HB2 ALA 116 -5.784 -0.428 17.455 804 HB3 ALA 116 HB3 ALA 116 -5.129 -0.263 19.085 805 H ALA 117 H ALA 117 -8.689 -0.075 19.414 806 HA ALA 117 HA ALA 117 -9.281 -1.107 22.073 807 HB1 ALA 117 HB1 ALA 117 -9.199 1.482 22.773 808 HB2 ALA 117 HB2 ALA 117 -7.922 1.483 21.553 809 HB3 ALA 117 HB3 ALA 117 -7.807 0.411 22.950 810 H SER 118 H SER 118 -11.296 -0.367 22.898 811 HA SER 118 HA SER 118 -13.076 0.797 20.840 812 HB2 SER 118 HB2 SER 118 -14.900 -0.416 21.951 813 HB3 SER 118 HB3 SER 118 -13.631 -1.520 21.427 814 HG SER 118 HG SER 118 -14.577 -1.485 23.757 815 H ALA 119 H ALA 119 -11.408 1.873 23.363 816 HA ALA 119 HA ALA 119 -13.284 2.967 25.149 817 HB1 ALA 119 HB1 ALA 119 -11.021 2.900 25.856 818 HB2 ALA 119 HB2 ALA 119 -11.391 4.611 25.638 819 HB3 ALA 119 HB3 ALA 119 -10.467 3.745 24.411 820 H PHE 120 H PHE 120 -14.246 4.981 25.271 821 HA PHE 120 HA PHE 120 -14.979 6.207 22.800 822 HB2 PHE 120 HB2 PHE 120 -15.430 7.000 25.684 823 HB3 PHE 120 HB3 PHE 120 -16.092 7.897 24.315 824 HD1 PHE 120 HD1 PHE 120 -16.258 4.787 26.261 825 HD2 PHE 120 HD2 PHE 120 -17.789 6.894 22.845 826 HE1 PHE 120 HE1 PHE 120 -18.134 3.172 26.106 827 HE2 PHE 120 HE2 PHE 120 -19.665 5.279 22.690 828 HZ PHE 120 HZ PHE 120 -19.838 3.418 24.320 829 H GLY 121 H GLY 121 -14.445 8.212 21.978 830 HA2 GLY 121 HA2 GLY 121 -13.073 10.318 22.954 831 HA3 GLY 121 HA3 GLY 121 -11.780 9.167 22.629 832 H SER 122 H SER 122 -11.175 11.028 21.164 833 HA SER 122 HA SER 122 -11.994 10.373 18.456 834 HB2 SER 122 HB2 SER 122 -12.636 12.632 17.844 835 HB3 SER 122 HB3 SER 122 -13.651 12.093 19.179 836 HG SER 122 HG SER 122 -12.720 13.505 20.462 837 H LEU 123 H LEU 123 -10.614 11.440 16.848 838 HA LEU 123 HA LEU 123 -7.957 12.124 17.971 839 HB2 LEU 123 HB2 LEU 123 -8.807 10.573 15.538 840 HB3 LEU 123 HB3 LEU 123 -7.257 11.410 15.537 841 HG LEU 123 HG LEU 123 -6.799 10.225 17.777 842 HD11 LEU 123 HD11 LEU 123 -9.231 8.713 16.796 843 HD12 LEU 123 HD12 LEU 123 -8.982 9.454 18.377 844 HD13 LEU 123 HD13 LEU 123 -8.074 8.011 17.928 845 HD21 LEU 123 HD21 LEU 123 -5.794 9.605 15.555 846 HD22 LEU 123 HD22 LEU 123 -7.117 8.461 15.328 847 HD23 LEU 123 HD23 LEU 123 -5.973 8.235 16.652 848 H SER 124 H SER 124 -7.133 14.073 17.528 849 HA SER 124 HA SER 124 -7.642 15.494 15.110 850 HB2 SER 124 HB2 SER 124 -8.826 17.398 16.046 851 HB3 SER 124 HB3 SER 124 -9.770 15.943 16.355 852 HG SER 124 HG SER 124 -8.629 17.677 18.096 853 H SER 125 H SER 125 -6.345 17.445 15.019 854 HA SER 125 HA SER 125 -4.559 17.904 17.271 855 HB2 SER 125 HB2 SER 125 -2.540 17.586 15.952 856 HB3 SER 125 HB3 SER 125 -3.490 16.104 15.937 857 HG SER 125 HG SER 125 -2.628 17.019 13.854 858 H ALA 126 H ALA 126 -3.203 19.842 16.935 859 HA ALA 126 HA ALA 126 -4.425 21.734 15.013 860 HB1 ALA 126 HB1 ALA 126 -5.070 22.747 16.958 861 HB2 ALA 126 HB2 ALA 126 -3.426 23.390 16.897 862 HB3 ALA 126 HB3 ALA 126 -3.791 21.986 17.904 863 H LEU 127 H LEU 127 -3.045 23.315 14.095 864 HA LEU 127 HA LEU 127 -0.244 23.382 14.602 865 HB2 LEU 127 HB2 LEU 127 -0.724 21.193 13.225 866 HB3 LEU 127 HB3 LEU 127 -0.878 22.304 11.866 867 HG LEU 127 HG LEU 127 1.524 22.392 13.704 868 HD11 LEU 127 HD11 LEU 127 1.487 20.125 12.870 869 HD12 LEU 127 HD12 LEU 127 2.683 21.019 11.933 870 HD13 LEU 127 HD13 LEU 127 1.097 20.677 11.241 871 HD21 LEU 127 HD21 LEU 127 0.877 23.368 10.912 872 HD22 LEU 127 HD22 LEU 127 2.531 23.287 11.518 873 HD23 LEU 127 HD23 LEU 127 1.351 24.326 12.314 874 H LEU 128 H LEU 128 0.226 25.451 14.270 875 HA LEU 128 HA LEU 128 -1.281 26.969 12.236 876 HB2 LEU 128 HB2 LEU 128 0.127 27.716 14.788 877 HB3 LEU 128 HB3 LEU 128 -0.107 28.931 13.533 878 HG LEU 128 HG LEU 128 -2.583 28.230 13.540 879 HD11 LEU 128 HD11 LEU 128 -2.408 26.132 14.735 880 HD12 LEU 128 HD12 LEU 128 -3.319 27.254 15.746 881 HD13 LEU 128 HD13 LEU 128 -1.624 26.923 16.103 882 HD21 LEU 128 HD21 LEU 128 -1.956 30.347 14.491 883 HD22 LEU 128 HD22 LEU 128 -1.270 29.572 15.919 884 HD23 LEU 128 HD23 LEU 128 -3.016 29.564 15.664 885 H MET 129 H MET 129 -0.251 28.109 10.635 886 HA MET 129 HA MET 129 1.346 28.467 9.026 887 HB2 MET 129 HB2 MET 129 3.053 28.773 11.512 888 HB3 MET 129 HB3 MET 129 3.533 29.285 9.895 889 HG2 MET 129 HG2 MET 129 1.044 30.270 11.320 890 HG3 MET 129 HG3 MET 129 2.574 31.145 11.280 891 HE1 MET 129 HE1 MET 129 -0.153 32.867 9.010 892 HE2 MET 129 HE2 MET 129 1.272 33.398 9.900 893 HE3 MET 129 HE3 MET 129 0.106 32.328 10.675 894 HA PRO 130 HA PRO 130 2.757 23.912 9.523 895 HB2 PRO 130 HB2 PRO 130 1.687 23.974 6.724 896 HB3 PRO 130 HB3 PRO 130 1.563 22.695 7.949 897 HG2 PRO 130 HG2 PRO 130 -0.520 24.204 7.430 898 HG3 PRO 130 HG3 PRO 130 -0.119 23.796 9.110 899 HD2 PRO 130 HD2 PRO 130 0.348 26.375 7.636 900 HD3 PRO 130 HD3 PRO 130 -0.177 26.116 9.316 901 H LYS 131 H LYS 131 3.024 26.235 6.858 902 HA LYS 131 HA LYS 131 5.897 25.790 6.713 903 HB2 LYS 131 HB2 LYS 131 5.885 25.383 4.280 904 HB3 LYS 131 HB3 LYS 131 5.044 24.104 5.152 905 HG2 LYS 131 HG2 LYS 131 2.874 25.190 4.632 906 HG3 LYS 131 HG3 LYS 131 3.727 26.442 3.729 907 HD2 LYS 131 HD2 LYS 131 4.594 24.778 2.165 908 HD3 LYS 131 HD3 LYS 131 3.853 23.478 3.099 909 HE2 LYS 131 HE2 LYS 131 2.436 24.014 1.178 910 HE3 LYS 131 HE3 LYS 131 1.615 24.480 2.667 911 HZ1 LYS 131 HZ1 LYS 131 1.638 26.150 0.772 912 HZ2 LYS 131 HZ2 LYS 131 3.276 26.397 1.150 913 HZ3 LYS 131 HZ3 LYS 131 2.076 26.721 2.308 914 H ASP 132 H ASP 132 7.002 27.404 5.417 915 HA ASP 132 HA ASP 132 5.416 29.819 4.825 916 HB2 ASP 132 HB2 ASP 132 6.591 29.843 7.133 917 HB3 ASP 132 HB3 ASP 132 8.081 30.012 6.208 918 H GLY 133 H GLY 133 8.759 28.567 4.750 919 HA2 GLY 133 HA2 GLY 133 8.897 29.061 1.868 920 HA3 GLY 133 HA3 GLY 133 10.052 29.919 2.885 921 H LEU 134 H LEU 134 9.381 27.043 1.240 922 HA LEU 134 HA LEU 134 11.621 25.648 2.586 923 HB2 LEU 134 HB2 LEU 134 9.178 24.488 1.227 924 HB3 LEU 134 HB3 LEU 134 10.538 23.536 1.818 925 HG LEU 134 HG LEU 134 8.927 25.403 3.585 926 HD11 LEU 134 HD11 LEU 134 7.871 23.296 4.436 927 HD12 LEU 134 HD12 LEU 134 8.644 22.419 3.115 928 HD13 LEU 134 HD13 LEU 134 7.438 23.658 2.765 929 HD21 LEU 134 HD21 LEU 134 11.094 24.919 4.527 930 HD22 LEU 134 HD22 LEU 134 10.969 23.215 4.092 931 HD23 LEU 134 HD23 LEU 134 9.942 23.878 5.362 932 H GLU 135 H GLU 135 13.241 24.836 1.360 933 HA GLU 135 HA GLU 135 13.015 24.851 -1.564 934 HB2 GLU 135 HB2 GLU 135 13.931 27.085 -0.819 935 HB3 GLU 135 HB3 GLU 135 15.311 26.219 -0.144 936 HG2 GLU 135 HG2 GLU 135 15.811 25.276 -2.370 937 HG3 GLU 135 HG3 GLU 135 14.432 26.138 -3.047 938 H HIS 136 H HIS 136 14.030 23.146 -2.456 939 HA HIS 136 HA HIS 136 16.265 21.847 -1.111 940 HB2 HIS 136 HB2 HIS 136 14.187 20.837 -0.116 941 HB3 HIS 136 HB3 HIS 136 13.748 20.281 -1.730 942 HD2 HIS 136 HD2 HIS 136 14.781 17.782 -2.287 943 HE1 HIS 136 HE1 HIS 136 17.940 17.791 0.514 944 HE2 HIS 136 HE2 HIS 136 16.743 16.408 -1.247 945 H HIS 137 H HIS 137 17.608 20.837 -2.519 946 HA HIS 137 HA HIS 137 17.215 21.283 -5.336 947 HB2 HIS 137 HB2 HIS 137 19.390 19.822 -3.817 948 HB3 HIS 137 HB3 HIS 137 19.424 20.140 -5.551 949 HD2 HIS 137 HD2 HIS 137 20.420 21.903 -2.309 950 HE1 HIS 137 HE1 HIS 137 20.227 24.920 -5.255 951 HE2 HIS 137 HE2 HIS 137 20.988 24.384 -2.893 952 H HIS 138 H HIS 138 16.998 19.742 -6.962 953 HA HIS 138 HA HIS 138 16.689 16.937 -6.315 954 HB2 HIS 138 HB2 HIS 138 14.368 16.766 -7.122 955 HB3 HIS 138 HB3 HIS 138 14.474 17.787 -5.692 956 HD2 HIS 138 HD2 HIS 138 13.268 18.028 -9.352 957 HE1 HIS 138 HE1 HIS 138 13.266 21.961 -7.817 958 HE2 HIS 138 HE2 HIS 138 12.533 20.500 -9.761 959 H HIS 139 H HIS 139 16.230 15.625 -8.262 960 HA HIS 139 HA HIS 139 16.970 16.959 -10.788 961 HB2 HIS 139 HB2 HIS 139 18.231 14.421 -9.714 962 HB3 HIS 139 HB3 HIS 139 18.501 15.090 -11.322 963 HD2 HIS 139 HD2 HIS 139 19.989 15.414 -7.822 964 HE1 HIS 139 HE1 HIS 139 21.260 18.843 -9.931 965 HE2 HIS 139 HE2 HIS 139 21.597 17.471 -7.821 966 H HIS 140 H HIS 140 16.184 15.976 -12.657 967 HA HIS 140 HA HIS 140 13.715 14.594 -12.394 968 HB2 HIS 140 HB2 HIS 140 13.735 14.502 -14.853 969 HB3 HIS 140 HB3 HIS 140 14.157 16.109 -14.268 970 HD2 HIS 140 HD2 HIS 140 16.753 16.966 -14.949 971 HE1 HIS 140 HE1 HIS 140 17.954 13.423 -16.906 972 HE2 HIS 140 HE2 HIS 140 18.597 15.829 -16.407 973 H HIS 141 H HIS 141 16.975 13.476 -12.583 974 HA HIS 141 HA HIS 141 16.037 10.708 -13.066 975 HB2 HIS 141 HB2 HIS 141 17.627 11.684 -14.772 976 HB3 HIS 141 HB3 HIS 141 18.837 11.773 -13.494 977 HD2 HIS 141 HD2 HIS 141 20.332 9.461 -13.348 978 HE1 HIS 141 HE1 HIS 141 17.538 6.814 -15.082 979 HE2 HIS 141 HE2 HIS 141 19.880 7.008 -14.120 Start of MODEL 3 1 H1 MET 1 HT1 MET 1 0.643 5.264 -15.669 2 H2 MET 1 HT2 MET 1 0.650 6.947 -15.908 3 H3 MET 1 HT3 MET 1 -0.822 6.103 -15.827 4 HA MET 1 HA MET 1 -0.107 7.404 -13.782 5 HB2 MET 1 HB2 MET 1 -0.992 5.622 -12.282 6 HB3 MET 1 HB3 MET 1 -1.958 5.808 -13.747 7 HG2 MET 1 HG2 MET 1 -0.583 3.903 -14.748 8 HG3 MET 1 HG3 MET 1 0.063 3.636 -13.130 9 HE1 MET 1 HE1 MET 1 -3.797 4.539 -14.356 10 HE2 MET 1 HE2 MET 1 -4.037 2.864 -14.847 11 HE3 MET 1 HE3 MET 1 -2.682 3.779 -15.502 12 H SER 2 H SER 2 1.660 7.900 -12.714 13 HA SER 2 HA SER 2 3.756 7.810 -11.786 14 HB2 SER 2 HB2 SER 2 2.912 4.957 -11.246 15 HB3 SER 2 HB3 SER 2 4.257 5.784 -10.470 16 HG SER 2 HG SER 2 2.249 5.838 -9.278 17 H ASP 3 H ASP 3 3.568 7.306 -14.632 18 HA ASP 3 HA ASP 3 5.754 5.375 -15.091 19 HB2 ASP 3 HB2 ASP 3 3.875 6.695 -17.066 20 HB3 ASP 3 HB3 ASP 3 5.105 5.496 -17.462 21 H GLN 4 H GLN 4 7.712 6.263 -15.048 22 HA GLN 4 HA GLN 4 9.440 7.767 -15.273 23 HB2 GLN 4 HB2 GLN 4 7.828 8.341 -17.769 24 HB3 GLN 4 HB3 GLN 4 9.434 9.008 -17.472 25 HG2 GLN 4 HG2 GLN 4 10.407 6.798 -17.356 26 HG3 GLN 4 HG3 GLN 4 8.816 6.044 -17.420 27 HE21 GLN 4 HE21 GLN 4 11.135 5.781 -19.342 28 HE22 GLN 4 HE22 GLN 4 10.506 6.221 -20.856 29 H SER 5 H SER 5 7.181 8.598 -13.666 30 HA SER 5 HA SER 5 7.546 11.520 -13.819 31 HB2 SER 5 HB2 SER 5 4.921 10.090 -13.343 32 HB3 SER 5 HB3 SER 5 5.171 11.826 -13.197 33 HG SER 5 HG SER 5 5.625 10.259 -15.526 34 H GLN 6 H GLN 6 7.092 12.611 -11.767 35 HA GLN 6 HA GLN 6 8.274 11.247 -9.557 36 HB2 GLN 6 HB2 GLN 6 7.807 13.331 -8.304 37 HB3 GLN 6 HB3 GLN 6 8.576 13.665 -9.854 38 HG2 GLN 6 HG2 GLN 6 6.340 14.150 -10.835 39 HG3 GLN 6 HG3 GLN 6 5.607 13.877 -9.255 40 HE21 GLN 6 HE21 GLN 6 6.588 16.348 -11.223 41 HE22 GLN 6 HE22 GLN 6 6.978 17.511 -10.050 42 H GLU 7 H GLU 7 6.989 11.639 -7.309 43 HA GLU 7 HA GLU 7 5.362 10.714 -5.972 44 HB2 GLU 7 HB2 GLU 7 3.706 11.944 -8.188 45 HB3 GLU 7 HB3 GLU 7 3.033 11.372 -6.658 46 HG2 GLU 7 HG2 GLU 7 5.184 13.500 -6.939 47 HG3 GLU 7 HG3 GLU 7 3.480 13.821 -6.629 48 HA PRO 8 HA PRO 8 4.584 7.022 -8.810 49 HB2 PRO 8 HB2 PRO 8 6.583 5.346 -8.180 50 HB3 PRO 8 HB3 PRO 8 6.831 6.685 -9.323 51 HG2 PRO 8 HG2 PRO 8 7.610 6.476 -6.456 52 HG3 PRO 8 HG3 PRO 8 8.499 7.173 -7.820 53 HD2 PRO 8 HD2 PRO 8 7.014 8.643 -5.970 54 HD3 PRO 8 HD3 PRO 8 7.482 9.216 -7.586 55 H THR 9 H THR 9 3.750 7.793 -6.016 56 HA THR 9 HA THR 9 3.865 5.551 -4.292 57 HB THR 9 HB THR 9 1.742 7.712 -4.378 58 HG1 THR 9 HG1 THR 9 3.376 8.952 -3.973 59 HG21 THR 9 HG21 THR 9 1.099 7.016 -2.303 60 HG22 THR 9 HG22 THR 9 2.747 6.642 -1.812 61 HG23 THR 9 HG23 THR 9 1.830 5.481 -2.766 62 H MET 10 H MET 10 2.490 3.853 -3.982 63 HA MET 10 HA MET 10 0.975 2.884 -6.185 64 HB2 MET 10 HB2 MET 10 1.166 1.993 -3.304 65 HB3 MET 10 HB3 MET 10 0.243 1.124 -4.531 66 HG2 MET 10 HG2 MET 10 2.245 0.793 -5.871 67 HG3 MET 10 HG3 MET 10 3.191 1.791 -4.766 68 HE1 MET 10 HE1 MET 10 0.399 -0.994 -4.021 69 HE2 MET 10 HE2 MET 10 1.467 -2.393 -4.087 70 HE3 MET 10 HE3 MET 10 1.308 -1.347 -5.497 71 H GLU 11 H GLU 11 0.178 4.740 -3.389 72 HA GLU 11 HA GLU 11 -2.608 4.296 -3.166 73 HB2 GLU 11 HB2 GLU 11 -0.970 6.788 -2.631 74 HB3 GLU 11 HB3 GLU 11 -2.684 6.655 -2.239 75 HG2 GLU 11 HG2 GLU 11 -2.269 4.811 -0.734 76 HG3 GLU 11 HG3 GLU 11 -0.587 4.708 -1.242 77 H GLU 12 H GLU 12 -0.833 6.775 -4.956 78 HA GLU 12 HA GLU 12 -2.932 8.023 -6.255 79 HB2 GLU 12 HB2 GLU 12 -0.542 8.768 -6.234 80 HB3 GLU 12 HB3 GLU 12 -0.183 7.511 -7.412 81 HG2 GLU 12 HG2 GLU 12 -0.538 9.621 -8.586 82 HG3 GLU 12 HG3 GLU 12 -1.855 8.515 -8.966 83 H ILE 13 H ILE 13 -1.164 5.076 -7.220 84 HA ILE 13 HA ILE 13 -2.241 4.754 -9.778 85 HB ILE 13 HB ILE 13 -1.361 2.666 -7.761 86 HG12 ILE 13 HG12 ILE 13 0.410 4.286 -8.310 87 HG13 ILE 13 HG13 ILE 13 0.783 2.713 -8.991 88 HG21 ILE 13 HG21 ILE 13 -1.615 2.362 -10.767 89 HG22 ILE 13 HG22 ILE 13 -2.767 1.713 -9.601 90 HG23 ILE 13 HG23 ILE 13 -1.105 1.124 -9.621 91 HD11 ILE 13 HD11 ILE 13 1.167 3.846 -10.925 92 HD12 ILE 13 HD12 ILE 13 0.318 5.282 -10.353 93 HD13 ILE 13 HD13 ILE 13 -0.587 3.948 -11.071 94 H LEU 14 H LEU 14 -3.442 3.511 -6.628 95 HA LEU 14 HA LEU 14 -5.683 2.142 -7.659 96 HB2 LEU 14 HB2 LEU 14 -5.001 3.288 -4.957 97 HB3 LEU 14 HB3 LEU 14 -6.595 2.603 -5.259 98 HG LEU 14 HG LEU 14 -5.338 0.530 -6.159 99 HD11 LEU 14 HD11 LEU 14 -3.121 1.924 -4.637 100 HD12 LEU 14 HD12 LEU 14 -3.111 1.494 -6.347 101 HD13 LEU 14 HD13 LEU 14 -3.078 0.231 -5.120 102 HD21 LEU 14 HD21 LEU 14 -5.272 -0.450 -3.979 103 HD22 LEU 14 HD22 LEU 14 -6.526 0.787 -3.912 104 HD23 LEU 14 HD23 LEU 14 -4.941 1.105 -3.213 105 H ALA 15 H ALA 15 -5.213 5.480 -6.633 106 HA ALA 15 HA ALA 15 -7.911 6.347 -6.805 107 HB1 ALA 15 HB1 ALA 15 -6.469 7.817 -5.673 108 HB2 ALA 15 HB2 ALA 15 -6.760 8.632 -7.211 109 HB3 ALA 15 HB3 ALA 15 -5.254 7.753 -6.949 110 H SER 16 H SER 16 -5.287 6.152 -9.142 111 HA SER 16 HA SER 16 -6.496 7.521 -11.285 112 HB2 SER 16 HB2 SER 16 -4.412 5.334 -11.258 113 HB3 SER 16 HB3 SER 16 -4.865 6.249 -12.694 114 HG SER 16 HG SER 16 -3.648 7.799 -11.993 115 H ILE 17 H ILE 17 -6.656 4.133 -10.286 116 HA ILE 17 HA ILE 17 -7.985 3.176 -12.626 117 HB ILE 17 HB ILE 17 -7.899 2.033 -9.818 118 HG12 ILE 17 HG12 ILE 17 -5.660 2.256 -10.824 119 HG13 ILE 17 HG13 ILE 17 -6.119 0.566 -10.707 120 HG21 ILE 17 HG21 ILE 17 -9.748 1.002 -10.954 121 HG22 ILE 17 HG22 ILE 17 -8.410 -0.145 -11.009 122 HG23 ILE 17 HG23 ILE 17 -8.811 0.812 -12.436 123 HD11 ILE 17 HD11 ILE 17 -6.832 0.684 -13.140 124 HD12 ILE 17 HD12 ILE 17 -5.102 0.902 -12.878 125 HD13 ILE 17 HD13 ILE 17 -6.128 2.300 -13.203 126 H ARG 18 H ARG 18 -9.193 4.075 -9.382 127 HA ARG 18 HA ARG 18 -11.349 4.336 -8.594 128 HB2 ARG 18 HB2 ARG 18 -10.891 6.186 -10.876 129 HB3 ARG 18 HB3 ARG 18 -12.566 6.026 -10.365 130 HG2 ARG 18 HG2 ARG 18 -10.348 6.566 -8.386 131 HG3 ARG 18 HG3 ARG 18 -11.190 7.869 -9.223 132 HD2 ARG 18 HD2 ARG 18 -13.357 6.872 -8.379 133 HD3 ARG 18 HD3 ARG 18 -12.394 5.784 -7.387 134 HE ARG 18 HE ARG 18 -12.787 8.638 -6.962 135 HH11 ARG 18 HH11 ARG 18 -10.868 5.815 -6.172 136 HH12 ARG 18 HH12 ARG 18 -10.273 6.493 -4.695 137 HH21 ARG 18 HH21 ARG 18 -11.991 9.477 -5.037 138 HH22 ARG 18 HH22 ARG 18 -10.904 8.549 -4.057 139 H ARG 19 H ARG 19 -12.829 4.760 -11.744 140 HA ARG 19 HA ARG 19 -13.868 2.004 -11.686 141 HB2 ARG 19 HB2 ARG 19 -15.469 3.573 -10.561 142 HB3 ARG 19 HB3 ARG 19 -15.590 4.464 -12.077 143 HG2 ARG 19 HG2 ARG 19 -16.469 2.506 -13.217 144 HG3 ARG 19 HG3 ARG 19 -16.205 1.509 -11.789 145 HD2 ARG 19 HD2 ARG 19 -17.814 2.875 -10.523 146 HD3 ARG 19 HD3 ARG 19 -18.070 3.897 -11.934 147 HE ARG 19 HE ARG 19 -18.594 1.277 -12.738 148 HH11 ARG 19 HH11 ARG 19 -19.908 3.571 -10.437 149 HH12 ARG 19 HH12 ARG 19 -21.507 2.916 -10.521 150 HH21 ARG 19 HH21 ARG 19 -20.686 0.453 -12.814 151 HH22 ARG 19 HH22 ARG 19 -21.943 1.163 -11.856 152 H ILE 20 H ILE 20 -14.256 1.101 -13.663 153 HA ILE 20 HA ILE 20 -12.881 2.088 -15.912 154 HB ILE 20 HB ILE 20 -15.066 -0.010 -15.732 155 HG12 ILE 20 HG12 ILE 20 -13.113 -0.535 -14.322 156 HG13 ILE 20 HG13 ILE 20 -13.192 -1.629 -15.694 157 HG21 ILE 20 HG21 ILE 20 -14.230 -0.865 -17.868 158 HG22 ILE 20 HG22 ILE 20 -13.019 0.418 -17.935 159 HG23 ILE 20 HG23 ILE 20 -14.734 0.815 -18.056 160 HD11 ILE 20 HD11 ILE 20 -11.339 0.757 -15.370 161 HD12 ILE 20 HD12 ILE 20 -11.492 -0.166 -16.863 162 HD13 ILE 20 HD13 ILE 20 -10.880 -0.945 -15.406 163 H ILE 21 H ILE 21 -16.359 2.092 -15.117 164 HA ILE 21 HA ILE 21 -16.748 4.158 -17.205 165 HB ILE 21 HB ILE 21 -19.016 3.256 -17.589 166 HG12 ILE 21 HG12 ILE 21 -18.151 0.862 -15.935 167 HG13 ILE 21 HG13 ILE 21 -19.142 2.161 -15.271 168 HG21 ILE 21 HG21 ILE 21 -16.801 1.205 -17.908 169 HG22 ILE 21 HG22 ILE 21 -17.118 2.547 -19.008 170 HG23 ILE 21 HG23 ILE 21 -18.302 1.253 -18.834 171 HD11 ILE 21 HD11 ILE 21 -19.841 0.368 -17.615 172 HD12 ILE 21 HD12 ILE 21 -20.797 1.763 -17.116 173 HD13 ILE 21 HD13 ILE 21 -20.615 0.385 -16.030 174 H SER 22 H SER 22 -18.387 5.719 -16.796 175 HA SER 22 HA SER 22 -19.324 5.901 -14.005 176 HB2 SER 22 HB2 SER 22 -17.935 8.112 -15.530 177 HB3 SER 22 HB3 SER 22 -18.715 8.298 -13.962 178 HG SER 22 HG SER 22 -16.969 7.526 -13.109 179 H GLU 23 H GLU 23 -20.451 5.510 -16.925 180 HA GLU 23 HA GLU 23 -22.582 7.553 -16.672 181 HB2 GLU 23 HB2 GLU 23 -20.969 7.654 -18.701 182 HB3 GLU 23 HB3 GLU 23 -21.831 6.227 -19.275 183 HG2 GLU 23 HG2 GLU 23 -23.948 7.433 -19.237 184 HG3 GLU 23 HG3 GLU 23 -23.169 8.841 -18.520 185 H ASP 24 H ASP 24 -22.452 4.848 -15.465 186 HA ASP 24 HA ASP 24 -24.316 3.206 -16.974 187 HB2 ASP 24 HB2 ASP 24 -22.479 2.272 -15.513 188 HB3 ASP 24 HB3 ASP 24 -23.383 2.878 -14.124 189 H ASP 25 H ASP 25 -26.266 4.247 -17.116 190 HA ASP 25 HA ASP 25 -27.479 5.352 -14.719 191 HB2 ASP 25 HB2 ASP 25 -27.671 6.561 -16.870 192 HB3 ASP 25 HB3 ASP 25 -28.566 5.198 -17.540 193 H ALA 26 H ALA 26 -27.765 3.473 -13.486 194 HA ALA 26 HA ALA 26 -29.088 1.135 -14.328 195 HB1 ALA 26 HB1 ALA 26 -29.265 0.584 -11.995 196 HB2 ALA 26 HB2 ALA 26 -29.082 2.274 -11.526 197 HB3 ALA 26 HB3 ALA 26 -27.721 1.402 -12.230 198 HA PRO 27 HA PRO 27 -33.358 2.299 -14.579 199 HB2 PRO 27 HB2 PRO 27 -34.648 0.122 -13.486 200 HB3 PRO 27 HB3 PRO 27 -33.964 0.158 -15.123 201 HG2 PRO 27 HG2 PRO 27 -32.812 -0.978 -12.618 202 HG3 PRO 27 HG3 PRO 27 -32.825 -1.648 -14.260 203 HD2 PRO 27 HD2 PRO 27 -30.626 -0.448 -13.255 204 HD3 PRO 27 HD3 PRO 27 -31.061 -0.298 -14.974 205 H ALA 28 H ALA 28 -32.010 1.479 -11.480 206 HA ALA 28 HA ALA 28 -34.297 2.347 -9.931 207 HB1 ALA 28 HB1 ALA 28 -32.490 0.601 -9.277 208 HB2 ALA 28 HB2 ALA 28 -33.055 1.726 -8.040 209 HB3 ALA 28 HB3 ALA 28 -31.510 2.003 -8.845 210 H GLU 29 H GLU 29 -33.850 4.361 -11.616 211 HA GLU 29 HA GLU 29 -33.018 6.530 -9.860 212 HB2 GLU 29 HB2 GLU 29 -30.994 5.858 -11.235 213 HB3 GLU 29 HB3 GLU 29 -31.904 6.325 -12.671 214 HG2 GLU 29 HG2 GLU 29 -30.540 8.211 -12.000 215 HG3 GLU 29 HG3 GLU 29 -32.223 8.600 -11.662 216 HA PRO 30 HA PRO 30 -36.788 7.123 -12.596 217 HB2 PRO 30 HB2 PRO 30 -38.648 7.489 -10.666 218 HB3 PRO 30 HB3 PRO 30 -38.176 5.877 -11.230 219 HG2 PRO 30 HG2 PRO 30 -37.296 7.364 -8.796 220 HG3 PRO 30 HG3 PRO 30 -37.769 5.663 -8.968 221 HD2 PRO 30 HD2 PRO 30 -35.162 6.451 -8.895 222 HD3 PRO 30 HD3 PRO 30 -35.708 5.032 -9.817 223 H ALA 31 H ALA 31 -38.081 9.095 -12.875 224 HA ALA 31 HA ALA 31 -37.510 11.397 -11.219 225 HB1 ALA 31 HB1 ALA 31 -36.171 12.606 -12.637 226 HB2 ALA 31 HB2 ALA 31 -36.803 11.815 -14.083 227 HB3 ALA 31 HB3 ALA 31 -35.622 10.986 -13.069 228 H ALA 32 H ALA 32 -38.838 13.228 -11.779 229 HA ALA 32 HA ALA 32 -40.911 12.756 -13.805 230 HB1 ALA 32 HB1 ALA 32 -41.708 13.663 -11.050 231 HB2 ALA 32 HB2 ALA 32 -41.621 11.949 -11.451 232 HB3 ALA 32 HB3 ALA 32 -42.722 13.005 -12.333 233 H GLU 33 H GLU 33 -41.638 14.565 -14.781 234 HA GLU 33 HA GLU 33 -41.549 16.730 -15.555 235 HB2 GLU 33 HB2 GLU 33 -41.760 17.266 -12.581 236 HB3 GLU 33 HB3 GLU 33 -42.076 18.446 -13.850 237 HG2 GLU 33 HG2 GLU 33 -43.866 16.983 -14.750 238 HG3 GLU 33 HG3 GLU 33 -43.566 15.834 -13.446 239 H ALA 34 H ALA 34 -38.948 15.438 -14.952 240 HA ALA 34 HA ALA 34 -37.173 17.352 -13.807 241 HB1 ALA 34 HB1 ALA 34 -36.795 14.909 -15.529 242 HB2 ALA 34 HB2 ALA 34 -36.350 15.146 -13.838 243 HB3 ALA 34 HB3 ALA 34 -35.433 15.948 -15.111 244 H ALA 35 H ALA 35 -36.027 18.969 -14.693 245 HA ALA 35 HA ALA 35 -35.802 19.318 -17.553 246 HB1 ALA 35 HB1 ALA 35 -37.102 21.675 -16.342 247 HB2 ALA 35 HB2 ALA 35 -38.128 20.241 -16.450 248 HB3 ALA 35 HB3 ALA 35 -37.380 20.904 -17.907 249 HA PRO 36 HA PRO 36 -32.222 21.603 -16.226 250 HB2 PRO 36 HB2 PRO 36 -31.881 23.480 -18.170 251 HB3 PRO 36 HB3 PRO 36 -31.573 21.754 -18.441 252 HG2 PRO 36 HG2 PRO 36 -33.966 23.382 -19.161 253 HG3 PRO 36 HG3 PRO 36 -33.104 22.164 -20.117 254 HD2 PRO 36 HD2 PRO 36 -35.419 21.597 -18.808 255 HD3 PRO 36 HD3 PRO 36 -34.139 20.385 -19.042 256 HA PRO 37 HA PRO 37 -33.659 25.160 -13.933 257 HB2 PRO 37 HB2 PRO 37 -31.349 26.523 -13.422 258 HB3 PRO 37 HB3 PRO 37 -31.770 25.000 -12.614 259 HG2 PRO 37 HG2 PRO 37 -29.952 25.469 -14.933 260 HG3 PRO 37 HG3 PRO 37 -29.724 24.431 -13.515 261 HD2 PRO 37 HD2 PRO 37 -30.507 23.432 -15.917 262 HD3 PRO 37 HD3 PRO 37 -31.047 22.725 -14.377 263 HA PRO 38 HA PRO 38 -34.153 28.449 -16.942 264 HB2 PRO 38 HB2 PRO 38 -35.037 30.503 -15.400 265 HB3 PRO 38 HB3 PRO 38 -36.040 29.083 -15.761 266 HG2 PRO 38 HG2 PRO 38 -34.445 29.698 -13.315 267 HG3 PRO 38 HG3 PRO 38 -36.087 29.047 -13.453 268 HD2 PRO 38 HD2 PRO 38 -33.928 27.459 -12.962 269 HD3 PRO 38 HD3 PRO 38 -35.344 26.890 -13.874 270 HA PRO 39 HA PRO 39 -30.393 30.866 -17.066 271 HB2 PRO 39 HB2 PRO 39 -32.013 33.161 -18.083 272 HB3 PRO 39 HB3 PRO 39 -30.582 32.390 -18.792 273 HG2 PRO 39 HG2 PRO 39 -32.969 31.965 -19.825 274 HG3 PRO 39 HG3 PRO 39 -31.803 30.634 -19.674 275 HD2 PRO 39 HD2 PRO 39 -34.199 31.243 -17.959 276 HD3 PRO 39 HD3 PRO 39 -33.601 29.670 -18.543 277 HA PRO 40 HA PRO 40 -30.619 33.278 -13.271 278 HB2 PRO 40 HB2 PRO 40 -28.206 34.540 -13.289 279 HB3 PRO 40 HB3 PRO 40 -28.380 32.809 -12.943 280 HG2 PRO 40 HG2 PRO 40 -27.594 34.157 -15.487 281 HG3 PRO 40 HG3 PRO 40 -26.899 32.724 -14.708 282 HD2 PRO 40 HD2 PRO 40 -28.637 32.536 -16.791 283 HD3 PRO 40 HD3 PRO 40 -28.562 31.313 -15.502 284 H GLU 41 H GLU 41 -31.146 35.332 -12.561 285 HA GLU 41 HA GLU 41 -30.951 37.570 -14.469 286 HB2 GLU 41 HB2 GLU 41 -33.452 36.730 -12.979 287 HB3 GLU 41 HB3 GLU 41 -33.274 38.241 -13.872 288 HG2 GLU 41 HG2 GLU 41 -32.817 36.967 -15.939 289 HG3 GLU 41 HG3 GLU 41 -33.010 35.459 -15.048 290 HA PRO 42 HA PRO 42 -29.654 39.811 -10.853 291 HB2 PRO 42 HB2 PRO 42 -30.519 42.350 -11.341 292 HB3 PRO 42 HB3 PRO 42 -29.165 41.610 -12.217 293 HG2 PRO 42 HG2 PRO 42 -32.014 41.917 -13.051 294 HG3 PRO 42 HG3 PRO 42 -30.531 42.183 -13.986 295 HD2 PRO 42 HD2 PRO 42 -31.995 39.905 -14.228 296 HD3 PRO 42 HD3 PRO 42 -30.227 39.919 -14.414 297 H GLU 43 H GLU 43 -30.374 40.516 -8.833 298 HA GLU 43 HA GLU 43 -33.067 39.853 -8.125 299 HB2 GLU 43 HB2 GLU 43 -30.825 41.151 -6.559 300 HB3 GLU 43 HB3 GLU 43 -32.371 40.680 -5.859 301 HG2 GLU 43 HG2 GLU 43 -30.458 38.794 -7.268 302 HG3 GLU 43 HG3 GLU 43 -30.618 38.944 -5.521 303 HA PRO 44 HA PRO 44 -34.916 43.878 -8.707 304 HB2 PRO 44 HB2 PRO 44 -36.966 43.837 -6.925 305 HB3 PRO 44 HB3 PRO 44 -36.973 42.861 -8.406 306 HG2 PRO 44 HG2 PRO 44 -36.296 42.053 -5.614 307 HG3 PRO 44 HG3 PRO 44 -37.278 41.207 -6.824 308 HD2 PRO 44 HD2 PRO 44 -34.685 40.535 -6.332 309 HD3 PRO 44 HD3 PRO 44 -35.425 40.362 -7.938 310 H GLU 45 H GLU 45 -34.917 45.970 -7.848 311 HA GLU 45 HA GLU 45 -33.960 46.286 -5.071 312 HB2 GLU 45 HB2 GLU 45 -32.899 47.748 -7.508 313 HB3 GLU 45 HB3 GLU 45 -32.464 48.114 -5.839 314 HG2 GLU 45 HG2 GLU 45 -31.581 45.820 -5.567 315 HG3 GLU 45 HG3 GLU 45 -32.004 45.462 -7.237 316 HA PRO 46 HA PRO 46 -37.728 48.957 -6.044 317 HB2 PRO 46 HB2 PRO 46 -39.063 48.422 -3.701 318 HB3 PRO 46 HB3 PRO 46 -39.248 47.463 -5.184 319 HG2 PRO 46 HG2 PRO 46 -37.589 46.910 -2.770 320 HG3 PRO 46 HG3 PRO 46 -38.591 45.804 -3.729 321 HD2 PRO 46 HD2 PRO 46 -35.899 45.896 -4.016 322 HD3 PRO 46 HD3 PRO 46 -36.977 45.562 -5.389 323 H VAL 47 H VAL 47 -35.685 48.567 -3.220 324 HA VAL 47 HA VAL 47 -35.585 51.461 -2.860 325 HB VAL 47 HB VAL 47 -37.419 50.732 -1.376 326 HG11 VAL 47 HG11 VAL 47 -36.659 48.410 -1.001 327 HG12 VAL 47 HG12 VAL 47 -36.958 49.244 0.523 328 HG13 VAL 47 HG13 VAL 47 -35.307 49.013 -0.044 329 HG21 VAL 47 HG21 VAL 47 -36.079 52.623 -0.641 330 HG22 VAL 47 HG22 VAL 47 -34.857 51.544 0.034 331 HG23 VAL 47 HG23 VAL 47 -36.461 51.627 0.763 332 H SER 48 H SER 48 -33.624 52.176 -2.084 333 HA SER 48 HA SER 48 -31.631 50.112 -1.352 334 HB2 SER 48 HB2 SER 48 -31.209 50.799 -3.653 335 HB3 SER 48 HB3 SER 48 -31.226 52.495 -3.176 336 HG SER 48 HG SER 48 -29.180 52.202 -2.811 337 H PHE 49 H PHE 49 -30.796 50.457 0.574 338 HA PHE 49 HA PHE 49 -30.185 53.170 1.485 339 HB2 PHE 49 HB2 PHE 49 -32.490 52.683 2.306 340 HB3 PHE 49 HB3 PHE 49 -31.865 51.256 3.131 341 HD1 PHE 49 HD1 PHE 49 -31.671 54.968 2.973 342 HD2 PHE 49 HD2 PHE 49 -30.710 51.436 5.223 343 HE1 PHE 49 HE1 PHE 49 -31.033 56.374 4.913 344 HE2 PHE 49 HE2 PHE 49 -30.074 52.846 7.163 345 HZ PHE 49 HZ PHE 49 -30.237 55.315 7.007 346 H ASP 50 H ASP 50 -28.173 53.153 2.287 347 HA ASP 50 HA ASP 50 -27.064 50.588 3.264 348 HB2 ASP 50 HB2 ASP 50 -24.874 51.438 2.627 349 HB3 ASP 50 HB3 ASP 50 -25.966 51.488 1.251 350 H ASP 51 H ASP 51 -25.162 50.963 4.793 351 HA ASP 51 HA ASP 51 -25.481 53.233 6.608 352 HB2 ASP 51 HB2 ASP 51 -27.080 51.421 7.359 353 HB3 ASP 51 HB3 ASP 51 -25.678 50.396 7.641 354 H GLU 52 H GLU 52 -23.954 50.026 6.304 355 HA GLU 52 HA GLU 52 -21.306 51.154 6.233 356 HB2 GLU 52 HB2 GLU 52 -20.487 49.983 8.266 357 HB3 GLU 52 HB3 GLU 52 -21.644 51.256 8.642 358 HG2 GLU 52 HG2 GLU 52 -23.444 49.553 8.801 359 HG3 GLU 52 HG3 GLU 52 -22.262 48.289 8.468 360 H VAL 53 H VAL 53 -23.262 49.198 4.880 361 HA VAL 53 HA VAL 53 -21.863 46.669 5.003 362 HB VAL 53 HB VAL 53 -23.513 45.932 3.308 363 HG11 VAL 53 HG11 VAL 53 -24.644 47.416 5.697 364 HG12 VAL 53 HG12 VAL 53 -24.068 45.749 5.680 365 HG13 VAL 53 HG13 VAL 53 -25.510 46.194 4.768 366 HG21 VAL 53 HG21 VAL 53 -24.675 48.721 3.595 367 HG22 VAL 53 HG22 VAL 53 -25.276 47.421 2.565 368 HG23 VAL 53 HG23 VAL 53 -23.731 48.193 2.201 369 H LEU 54 H LEU 54 -21.559 49.557 3.189 370 HA LEU 54 HA LEU 54 -20.230 50.180 1.434 371 HB2 LEU 54 HB2 LEU 54 -18.543 48.849 2.799 372 HB3 LEU 54 HB3 LEU 54 -18.862 47.501 1.709 373 HG LEU 54 HG LEU 54 -18.293 49.061 -0.215 374 HD11 LEU 54 HD11 LEU 54 -18.526 51.224 0.781 375 HD12 LEU 54 HD12 LEU 54 -16.799 51.012 0.500 376 HD13 LEU 54 HD13 LEU 54 -17.461 50.800 2.120 377 HD21 LEU 54 HD21 LEU 54 -16.665 47.431 0.457 378 HD22 LEU 54 HD22 LEU 54 -16.238 48.360 1.894 379 HD23 LEU 54 HD23 LEU 54 -15.800 48.958 0.294 380 H GLU 55 H GLU 55 -20.190 50.064 -0.794 381 HA GLU 55 HA GLU 55 -21.391 47.686 -2.062 382 HB2 GLU 55 HB2 GLU 55 -22.184 50.563 -2.596 383 HB3 GLU 55 HB3 GLU 55 -22.733 49.168 -3.524 384 HG2 GLU 55 HG2 GLU 55 -23.737 48.208 -1.476 385 HG3 GLU 55 HG3 GLU 55 -23.210 49.621 -0.563 386 H LEU 56 H LEU 56 -20.495 47.121 -3.987 387 HA LEU 56 HA LEU 56 -18.599 48.987 -5.260 388 HB2 LEU 56 HB2 LEU 56 -17.319 47.442 -3.792 389 HB3 LEU 56 HB3 LEU 56 -18.010 46.073 -4.656 390 HG LEU 56 HG LEU 56 -16.997 46.981 -6.777 391 HD11 LEU 56 HD11 LEU 56 -16.730 49.319 -6.202 392 HD12 LEU 56 HD12 LEU 56 -15.124 48.644 -6.464 393 HD13 LEU 56 HD13 LEU 56 -15.709 48.912 -4.823 394 HD21 LEU 56 HD21 LEU 56 -14.974 46.511 -4.571 395 HD22 LEU 56 HD22 LEU 56 -14.771 46.169 -6.289 396 HD23 LEU 56 HD23 LEU 56 -15.913 45.226 -5.332 397 H THR 57 H THR 57 -19.054 49.193 -7.346 398 HA THR 57 HA THR 57 -20.956 47.487 -8.665 399 HB THR 57 HB THR 57 -20.548 48.916 -10.630 400 HG1 THR 57 HG1 THR 57 -18.932 50.371 -10.633 401 HG21 THR 57 HG21 THR 57 -21.413 50.944 -9.719 402 HG22 THR 57 HG22 THR 57 -20.635 50.660 -8.161 403 HG23 THR 57 HG23 THR 57 -21.998 49.658 -8.664 404 H ASP 58 H ASP 58 -20.503 46.419 -10.752 405 HA ASP 58 HA ASP 58 -18.149 44.762 -10.537 406 HB2 ASP 58 HB2 ASP 58 -20.378 44.837 -12.586 407 HB3 ASP 58 HB3 ASP 58 -19.101 43.626 -12.543 408 HA PRO 59 HA PRO 59 -15.719 47.208 -13.375 409 HB2 PRO 59 HB2 PRO 59 -13.858 45.428 -14.213 410 HB3 PRO 59 HB3 PRO 59 -13.882 46.054 -12.551 411 HG2 PRO 59 HG2 PRO 59 -14.902 43.454 -13.607 412 HG3 PRO 59 HG3 PRO 59 -13.971 43.786 -12.135 413 HD2 PRO 59 HD2 PRO 59 -16.685 43.427 -12.121 414 HD3 PRO 59 HD3 PRO 59 -15.837 44.447 -10.938 415 H ILE 60 H ILE 60 -15.314 47.558 -15.622 416 HA ILE 60 HA ILE 60 -17.301 46.605 -17.385 417 HB ILE 60 HB ILE 60 -16.135 48.786 -17.614 418 HG12 ILE 60 HG12 ILE 60 -15.695 47.122 -20.105 419 HG13 ILE 60 HG13 ILE 60 -17.309 47.534 -19.531 420 HG21 ILE 60 HG21 ILE 60 -13.898 48.931 -18.502 421 HG22 ILE 60 HG22 ILE 60 -13.811 47.183 -18.720 422 HG23 ILE 60 HG23 ILE 60 -13.840 47.869 -17.095 423 HD11 ILE 60 HD11 ILE 60 -15.159 49.600 -20.065 424 HD12 ILE 60 HD12 ILE 60 -16.869 49.894 -19.745 425 HD13 ILE 60 HD13 ILE 60 -16.373 49.131 -21.257 426 H ALA 61 H ALA 61 -14.022 45.534 -16.730 427 HA ALA 61 HA ALA 61 -13.773 43.777 -18.972 428 HB1 ALA 61 HB1 ALA 61 -11.943 44.759 -17.365 429 HB2 ALA 61 HB2 ALA 61 -11.732 43.148 -18.051 430 HB3 ALA 61 HB3 ALA 61 -12.304 43.332 -16.394 431 HA PRO 62 HA PRO 62 -16.213 40.269 -17.714 432 HB2 PRO 62 HB2 PRO 62 -13.866 38.533 -18.353 433 HB3 PRO 62 HB3 PRO 62 -15.533 38.441 -18.953 434 HG2 PRO 62 HG2 PRO 62 -13.617 39.350 -20.512 435 HG3 PRO 62 HG3 PRO 62 -15.210 40.133 -20.498 436 HD2 PRO 62 HD2 PRO 62 -12.655 41.037 -19.190 437 HD3 PRO 62 HD3 PRO 62 -13.881 41.998 -20.049 438 H GLU 63 H GLU 63 -16.601 39.127 -15.856 439 HA GLU 63 HA GLU 63 -14.354 38.682 -13.986 440 HB2 GLU 63 HB2 GLU 63 -15.687 40.715 -13.358 441 HB3 GLU 63 HB3 GLU 63 -17.100 39.678 -13.182 442 HG2 GLU 63 HG2 GLU 63 -15.908 38.340 -11.481 443 HG3 GLU 63 HG3 GLU 63 -14.498 39.383 -11.653 444 HA PRO 64 HA PRO 64 -16.628 34.671 -14.738 445 HB2 PRO 64 HB2 PRO 64 -14.030 33.660 -13.663 446 HB3 PRO 64 HB3 PRO 64 -14.960 33.111 -15.074 447 HG2 PRO 64 HG2 PRO 64 -12.758 34.516 -15.404 448 HG3 PRO 64 HG3 PRO 64 -14.182 34.827 -16.417 449 HD2 PRO 64 HD2 PRO 64 -13.170 36.400 -14.060 450 HD3 PRO 64 HD3 PRO 64 -13.828 36.988 -15.607 451 H GLU 65 H GLU 65 -17.727 33.443 -13.254 452 HA GLU 65 HA GLU 65 -17.405 34.160 -10.429 453 HB2 GLU 65 HB2 GLU 65 -19.655 34.273 -11.525 454 HB3 GLU 65 HB3 GLU 65 -19.584 32.527 -11.757 455 HG2 GLU 65 HG2 GLU 65 -19.405 32.193 -9.329 456 HG3 GLU 65 HG3 GLU 65 -19.428 33.938 -9.076 457 H LEU 66 H LEU 66 -16.545 32.811 -8.965 458 HA LEU 66 HA LEU 66 -16.004 30.016 -9.779 459 HB2 LEU 66 HB2 LEU 66 -14.463 31.784 -7.861 460 HB3 LEU 66 HB3 LEU 66 -14.081 30.104 -8.229 461 HG LEU 66 HG LEU 66 -14.212 32.269 -10.349 462 HD11 LEU 66 HD11 LEU 66 -11.858 31.206 -8.765 463 HD12 LEU 66 HD12 LEU 66 -12.434 32.871 -8.824 464 HD13 LEU 66 HD13 LEU 66 -11.696 32.144 -10.249 465 HD21 LEU 66 HD21 LEU 66 -14.455 30.007 -11.229 466 HD22 LEU 66 HD22 LEU 66 -13.078 29.450 -10.278 467 HD23 LEU 66 HD23 LEU 66 -12.833 30.582 -11.608 468 HA PRO 67 HA PRO 67 -18.902 29.575 -6.210 469 HB2 PRO 67 HB2 PRO 67 -19.793 27.074 -6.784 470 HB3 PRO 67 HB3 PRO 67 -20.420 28.520 -7.600 471 HG2 PRO 67 HG2 PRO 67 -18.372 26.560 -8.538 472 HG3 PRO 67 HG3 PRO 67 -19.728 27.284 -9.424 473 HD2 PRO 67 HD2 PRO 67 -17.176 28.202 -9.674 474 HD3 PRO 67 HD3 PRO 67 -18.593 29.270 -9.817 475 HA PRO 68 HA PRO 68 -16.207 27.246 -3.514 476 HB2 PRO 68 HB2 PRO 68 -17.903 26.246 -1.626 477 HB3 PRO 68 HB3 PRO 68 -17.471 27.966 -1.718 478 HG2 PRO 68 HG2 PRO 68 -19.914 26.578 -2.721 479 HG3 PRO 68 HG3 PRO 68 -19.770 28.117 -1.849 480 HD2 PRO 68 HD2 PRO 68 -20.108 28.021 -4.542 481 HD3 PRO 68 HD3 PRO 68 -19.155 29.298 -3.754 482 H LEU 69 H LEU 69 -15.602 25.095 -2.819 483 HA LEU 69 HA LEU 69 -17.141 22.869 -3.944 484 HB2 LEU 69 HB2 LEU 69 -15.157 21.903 -5.020 485 HB3 LEU 69 HB3 LEU 69 -15.570 23.461 -5.723 486 HG LEU 69 HG LEU 69 -13.559 23.322 -3.471 487 HD11 LEU 69 HD11 LEU 69 -13.013 22.824 -6.414 488 HD12 LEU 69 HD12 LEU 69 -12.737 21.696 -5.086 489 HD13 LEU 69 HD13 LEU 69 -11.767 23.165 -5.212 490 HD21 LEU 69 HD21 LEU 69 -14.104 25.560 -3.998 491 HD22 LEU 69 HD22 LEU 69 -14.229 25.222 -5.724 492 HD23 LEU 69 HD23 LEU 69 -12.646 25.284 -4.947 493 H GLU 70 H GLU 70 -16.863 20.920 -2.919 494 HA GLU 70 HA GLU 70 -15.171 20.940 -0.487 495 HB2 GLU 70 HB2 GLU 70 -17.869 19.625 -0.902 496 HB3 GLU 70 HB3 GLU 70 -16.869 19.462 0.543 497 HG2 GLU 70 HG2 GLU 70 -16.982 21.908 0.891 498 HG3 GLU 70 HG3 GLU 70 -17.994 22.063 -0.544 499 H THR 71 H THR 71 -14.101 19.050 0.057 500 HA THR 71 HA THR 71 -14.307 16.739 -1.728 501 HB THR 71 HB THR 71 -12.601 18.142 -2.792 502 HG1 THR 71 HG1 THR 71 -11.709 16.307 -3.166 503 HG21 THR 71 HG21 THR 71 -11.849 19.444 -0.869 504 HG22 THR 71 HG22 THR 71 -10.472 18.606 -1.584 505 HG23 THR 71 HG23 THR 71 -11.205 17.991 -0.104 506 H VAL 72 H VAL 72 -13.461 14.816 -0.868 507 HA VAL 72 HA VAL 72 -12.505 14.882 1.908 508 HB VAL 72 HB VAL 72 -14.958 14.601 2.014 509 HG11 VAL 72 HG11 VAL 72 -16.027 12.607 1.077 510 HG12 VAL 72 HG12 VAL 72 -14.488 12.072 0.407 511 HG13 VAL 72 HG13 VAL 72 -15.255 13.536 -0.209 512 HG21 VAL 72 HG21 VAL 72 -14.970 12.451 3.301 513 HG22 VAL 72 HG22 VAL 72 -13.628 13.510 3.737 514 HG23 VAL 72 HG23 VAL 72 -13.348 12.119 2.691 515 H GLY 73 H GLY 73 -11.070 13.281 2.411 516 HA2 GLY 73 HA2 GLY 73 -10.387 11.368 0.250 517 HA3 GLY 73 HA3 GLY 73 -9.186 12.141 1.279 518 H ASP 74 H ASP 74 -9.833 9.279 0.820 519 HA ASP 74 HA ASP 74 -9.880 8.473 3.629 520 HB2 ASP 74 HB2 ASP 74 -12.263 8.428 2.373 521 HB3 ASP 74 HB3 ASP 74 -11.643 6.858 1.859 522 H ILE 75 H ILE 75 -7.861 8.528 1.528 523 HA ILE 75 HA ILE 75 -7.475 5.733 0.826 524 HB ILE 75 HB ILE 75 -7.007 7.432 -0.888 525 HG12 ILE 75 HG12 ILE 75 -4.581 6.759 -1.361 526 HG13 ILE 75 HG13 ILE 75 -4.630 5.884 0.167 527 HG21 ILE 75 HG21 ILE 75 -6.205 9.150 0.904 528 HG22 ILE 75 HG22 ILE 75 -5.436 9.154 -0.678 529 HG23 ILE 75 HG23 ILE 75 -4.629 8.394 0.690 530 HD11 ILE 75 HD11 ILE 75 -5.213 4.580 -2.002 531 HD12 ILE 75 HD12 ILE 75 -6.750 5.442 -1.934 532 HD13 ILE 75 HD13 ILE 75 -6.277 4.381 -0.607 533 H ASP 76 H ASP 76 -7.022 4.659 2.634 534 HA ASP 76 HA ASP 76 -4.618 5.499 4.135 535 HB2 ASP 76 HB2 ASP 76 -5.656 4.241 6.088 536 HB3 ASP 76 HB3 ASP 76 -6.435 5.760 5.654 537 H VAL 77 H VAL 77 -2.979 4.118 3.846 538 HA VAL 77 HA VAL 77 -3.543 1.238 3.678 539 HB VAL 77 HB VAL 77 -1.971 0.978 1.775 540 HG11 VAL 77 HG11 VAL 77 -4.247 2.880 1.160 541 HG12 VAL 77 HG12 VAL 77 -4.454 1.157 1.476 542 HG13 VAL 77 HG13 VAL 77 -3.536 1.692 0.068 543 HG21 VAL 77 HG21 VAL 77 -1.534 3.098 0.419 544 HG22 VAL 77 HG22 VAL 77 -0.622 2.963 1.923 545 HG23 VAL 77 HG23 VAL 77 -2.039 4.009 1.842 546 H TYR 78 H TYR 78 -2.222 0.063 4.867 547 HA TYR 78 HA TYR 78 0.429 1.141 5.604 548 HB2 TYR 78 HB2 TYR 78 -1.543 -0.219 7.460 549 HB3 TYR 78 HB3 TYR 78 0.112 0.218 7.882 550 HD1 TYR 78 HD1 TYR 78 -3.278 1.464 7.240 551 HD2 TYR 78 HD2 TYR 78 0.782 2.586 8.084 552 HE1 TYR 78 HE1 TYR 78 -4.031 3.757 7.812 553 HE2 TYR 78 HE2 TYR 78 0.030 4.877 8.656 554 HH TYR 78 HH TYR 78 -2.816 5.725 9.483 555 H SER 79 H SER 79 2.049 -0.422 5.979 556 HA SER 79 HA SER 79 1.890 -2.744 4.362 557 HB2 SER 79 HB2 SER 79 3.888 -1.895 6.465 558 HB3 SER 79 HB3 SER 79 4.089 -3.319 5.449 559 HG SER 79 HG SER 79 4.870 -1.973 4.044 560 HA PRO 80 HA PRO 80 0.046 -5.614 7.220 561 HB2 PRO 80 HB2 PRO 80 1.079 -8.002 6.412 562 HB3 PRO 80 HB3 PRO 80 -0.139 -7.114 5.475 563 HG2 PRO 80 HG2 PRO 80 2.820 -7.232 5.097 564 HG3 PRO 80 HG3 PRO 80 1.523 -7.322 3.888 565 HD2 PRO 80 HD2 PRO 80 2.915 -5.031 4.342 566 HD3 PRO 80 HD3 PRO 80 1.204 -5.023 3.856 567 HA PRO 81 HA PRO 81 2.876 -6.114 10.674 568 HB2 PRO 81 HB2 PRO 81 1.399 -8.638 11.294 569 HB3 PRO 81 HB3 PRO 81 1.735 -7.241 12.339 570 HG2 PRO 81 HG2 PRO 81 -0.684 -7.610 11.366 571 HG3 PRO 81 HG3 PRO 81 0.017 -5.982 11.424 572 HD2 PRO 81 HD2 PRO 81 -0.273 -7.828 9.069 573 HD3 PRO 81 HD3 PRO 81 -0.526 -6.070 9.161 574 H GLU 82 H GLU 82 4.853 -7.057 10.941 575 HA GLU 82 HA GLU 82 5.558 -9.238 9.134 576 HB2 GLU 82 HB2 GLU 82 7.184 -7.308 10.777 577 HB3 GLU 82 HB3 GLU 82 7.917 -8.699 9.983 578 HG2 GLU 82 HG2 GLU 82 7.020 -7.917 7.815 579 HG3 GLU 82 HG3 GLU 82 6.299 -6.525 8.618 580 HA PRO 83 HA PRO 83 7.010 -11.320 13.213 581 HB2 PRO 83 HB2 PRO 83 6.264 -10.285 15.625 582 HB3 PRO 83 HB3 PRO 83 7.757 -9.813 14.787 583 HG2 PRO 83 HG2 PRO 83 5.127 -8.409 14.894 584 HG3 PRO 83 HG3 PRO 83 6.766 -7.747 15.038 585 HD2 PRO 83 HD2 PRO 83 5.350 -7.597 12.725 586 HD3 PRO 83 HD3 PRO 83 7.121 -7.754 12.754 587 H GLU 84 H GLU 84 3.914 -9.666 13.952 588 HA GLU 84 HA GLU 84 2.246 -11.865 13.447 589 HB2 GLU 84 HB2 GLU 84 1.627 -12.527 15.768 590 HB3 GLU 84 HB3 GLU 84 3.279 -12.973 15.358 591 HG2 GLU 84 HG2 GLU 84 4.104 -10.941 16.519 592 HG3 GLU 84 HG3 GLU 84 2.447 -10.525 16.950 593 H SER 85 H SER 85 0.033 -11.576 14.547 594 HA SER 85 HA SER 85 -0.649 -9.045 15.658 595 HB2 SER 85 HB2 SER 85 -1.903 -8.102 13.812 596 HB3 SER 85 HB3 SER 85 -0.235 -8.356 13.302 597 HG SER 85 HG SER 85 -2.219 -9.166 11.997 598 H GLU 86 H GLU 86 -2.915 -8.882 16.157 599 HA GLU 86 HA GLU 86 -4.134 -11.413 16.698 600 HB2 GLU 86 HB2 GLU 86 -5.128 -8.572 17.015 601 HB3 GLU 86 HB3 GLU 86 -6.011 -9.994 17.571 602 HG2 GLU 86 HG2 GLU 86 -4.088 -10.634 18.986 603 HG3 GLU 86 HG3 GLU 86 -3.216 -9.203 18.442 604 HA PRO 87 HA PRO 87 -6.634 -12.094 13.082 605 HB2 PRO 87 HB2 PRO 87 -8.997 -12.456 14.874 606 HB3 PRO 87 HB3 PRO 87 -8.339 -13.548 13.640 607 HG2 PRO 87 HG2 PRO 87 -7.982 -14.071 16.196 608 HG3 PRO 87 HG3 PRO 87 -6.666 -14.327 15.034 609 HD2 PRO 87 HD2 PRO 87 -7.036 -12.072 16.990 610 HD3 PRO 87 HD3 PRO 87 -5.550 -12.943 16.544 611 H ALA 88 H ALA 88 -7.957 -10.954 11.684 612 HA ALA 88 HA ALA 88 -9.124 -8.443 12.728 613 HB1 ALA 88 HB1 ALA 88 -7.273 -8.141 11.119 614 HB2 ALA 88 HB2 ALA 88 -8.800 -7.535 10.476 615 HB3 ALA 88 HB3 ALA 88 -8.166 -9.087 9.928 616 H TYR 89 H TYR 89 -11.198 -7.883 12.205 617 HA TYR 89 HA TYR 89 -12.832 -9.956 10.865 618 HB2 TYR 89 HB2 TYR 89 -13.354 -9.570 13.266 619 HB3 TYR 89 HB3 TYR 89 -13.682 -7.876 12.906 620 HD1 TYR 89 HD1 TYR 89 -14.761 -11.365 12.166 621 HD2 TYR 89 HD2 TYR 89 -15.784 -7.197 11.992 622 HE1 TYR 89 HE1 TYR 89 -17.082 -11.961 11.528 623 HE2 TYR 89 HE2 TYR 89 -18.106 -7.794 11.356 624 HH TYR 89 HH TYR 89 -18.995 -10.970 10.417 625 H THR 90 H THR 90 -13.769 -9.426 8.998 626 HA THR 90 HA THR 90 -14.247 -6.581 8.365 627 HB THR 90 HB THR 90 -13.458 -6.972 6.058 628 HG1 THR 90 HG1 THR 90 -13.417 -9.003 5.554 629 HG21 THR 90 HG21 THR 90 -11.081 -6.966 6.545 630 HG22 THR 90 HG22 THR 90 -11.359 -7.748 8.102 631 HG23 THR 90 HG23 THR 90 -11.916 -6.096 7.831 632 HA PRO 91 HA PRO 91 -18.283 -7.821 7.002 633 HB2 PRO 91 HB2 PRO 91 -17.842 -6.381 4.424 634 HB3 PRO 91 HB3 PRO 91 -19.134 -6.177 5.621 635 HG2 PRO 91 HG2 PRO 91 -17.216 -4.382 5.416 636 HG3 PRO 91 HG3 PRO 91 -17.819 -4.875 7.011 637 HD2 PRO 91 HD2 PRO 91 -15.283 -5.704 5.621 638 HD3 PRO 91 HD3 PRO 91 -15.544 -5.292 7.332 639 HA PRO 92 HA PRO 92 -17.536 -11.370 4.344 640 HB2 PRO 92 HB2 PRO 92 -20.073 -12.174 3.776 641 HB3 PRO 92 HB3 PRO 92 -19.333 -12.399 5.373 642 HG2 PRO 92 HG2 PRO 92 -21.225 -10.284 4.447 643 HG3 PRO 92 HG3 PRO 92 -21.224 -11.211 5.959 644 HD2 PRO 92 HD2 PRO 92 -20.256 -8.673 5.820 645 HD3 PRO 92 HD3 PRO 92 -19.585 -9.886 6.933 646 HA PRO 93 HA PRO 93 -17.799 -9.812 0.154 647 HB2 PRO 93 HB2 PRO 93 -17.566 -12.081 -1.332 648 HB3 PRO 93 HB3 PRO 93 -16.206 -11.385 -0.428 649 HG2 PRO 93 HG2 PRO 93 -18.001 -13.653 0.307 650 HG3 PRO 93 HG3 PRO 93 -16.241 -13.518 0.454 651 HD2 PRO 93 HD2 PRO 93 -17.901 -13.131 2.574 652 HD3 PRO 93 HD3 PRO 93 -16.358 -12.262 2.403 653 H ALA 94 H ALA 94 -19.166 -9.701 -1.720 654 HA ALA 94 HA ALA 94 -21.111 -9.828 -2.928 655 HB1 ALA 94 HB1 ALA 94 -22.334 -11.791 -3.023 656 HB2 ALA 94 HB2 ALA 94 -22.177 -12.102 -1.296 657 HB3 ALA 94 HB3 ALA 94 -20.810 -12.394 -2.371 658 H ALA 95 H ALA 95 -23.520 -9.617 -2.621 659 HA ALA 95 HA ALA 95 -24.383 -8.816 0.039 660 HB1 ALA 95 HB1 ALA 95 -24.762 -6.715 -2.031 661 HB2 ALA 95 HB2 ALA 95 -23.140 -6.895 -1.360 662 HB3 ALA 95 HB3 ALA 95 -24.506 -6.556 -0.293 663 HA PRO 96 HA PRO 96 -28.296 -10.211 -1.519 664 HB2 PRO 96 HB2 PRO 96 -30.108 -8.511 -0.338 665 HB3 PRO 96 HB3 PRO 96 -29.292 -9.836 0.516 666 HG2 PRO 96 HG2 PRO 96 -28.642 -6.926 0.482 667 HG3 PRO 96 HG3 PRO 96 -28.651 -8.064 1.842 668 HD2 PRO 96 HD2 PRO 96 -26.346 -7.317 0.634 669 HD3 PRO 96 HD3 PRO 96 -26.572 -8.956 1.290 670 H VAL 97 H VAL 97 -27.579 -6.785 -1.871 671 HA VAL 97 HA VAL 97 -28.886 -6.793 -4.494 672 HB VAL 97 HB VAL 97 -29.493 -4.669 -2.408 673 HG11 VAL 97 HG11 VAL 97 -29.480 -3.696 -4.621 674 HG12 VAL 97 HG12 VAL 97 -31.166 -3.942 -4.162 675 HG13 VAL 97 HG13 VAL 97 -30.383 -5.060 -5.282 676 HG21 VAL 97 HG21 VAL 97 -31.213 -6.880 -3.582 677 HG22 VAL 97 HG22 VAL 97 -31.826 -5.561 -2.585 678 HG23 VAL 97 HG23 VAL 97 -30.701 -6.732 -1.901 679 H PHE 98 H PHE 98 -27.414 -4.423 -2.253 680 HA PHE 98 HA PHE 98 -25.127 -4.071 -4.022 681 HB2 PHE 98 HB2 PHE 98 -27.050 -2.562 -4.832 682 HB3 PHE 98 HB3 PHE 98 -26.808 -1.653 -3.342 683 HD1 PHE 98 HD1 PHE 98 -24.775 -3.106 -6.159 684 HD2 PHE 98 HD2 PHE 98 -25.322 0.163 -3.423 685 HE1 PHE 98 HE1 PHE 98 -22.900 -1.892 -7.234 686 HE2 PHE 98 HE2 PHE 98 -23.444 1.373 -4.497 687 HZ PHE 98 HZ PHE 98 -22.232 0.346 -6.402 688 H ASP 99 H ASP 99 -23.329 -3.493 -2.885 689 HA ASP 99 HA ASP 99 -23.675 -3.043 0.007 690 HB2 ASP 99 HB2 ASP 99 -21.343 -3.824 0.190 691 HB3 ASP 99 HB3 ASP 99 -22.369 -5.010 -0.608 692 H ARG 100 H ARG 100 -23.859 -0.911 -2.091 693 HA ARG 100 HA ARG 100 -23.169 1.248 -2.446 694 HB2 ARG 100 HB2 ARG 100 -22.163 0.830 0.379 695 HB3 ARG 100 HB3 ARG 100 -22.199 2.396 -0.433 696 HG2 ARG 100 HG2 ARG 100 -24.637 2.172 -0.759 697 HG3 ARG 100 HG3 ARG 100 -24.601 0.612 0.063 698 HD2 ARG 100 HD2 ARG 100 -23.746 1.704 2.103 699 HD3 ARG 100 HD3 ARG 100 -23.786 3.263 1.285 700 HE ARG 100 HE ARG 100 -26.351 2.093 1.124 701 HH11 ARG 100 HH11 ARG 100 -24.200 3.478 3.522 702 HH12 ARG 100 HH12 ARG 100 -25.495 3.993 4.551 703 HH21 ARG 100 HH21 ARG 100 -28.000 2.781 2.492 704 HH22 ARG 100 HH22 ARG 100 -27.628 3.601 3.971 705 H ASP 101 H ASP 101 -21.520 -0.724 -3.532 706 HA ASP 101 HA ASP 101 -18.761 0.185 -3.070 707 HB2 ASP 101 HB2 ASP 101 -19.340 -2.274 -3.173 708 HB3 ASP 101 HB3 ASP 101 -19.707 -2.051 -4.878 709 H GLU 102 H GLU 102 -20.509 2.051 -4.245 710 HA GLU 102 HA GLU 102 -20.458 2.139 -7.062 711 HB2 GLU 102 HB2 GLU 102 -21.867 3.590 -5.581 712 HB3 GLU 102 HB3 GLU 102 -20.415 4.497 -5.158 713 HG2 GLU 102 HG2 GLU 102 -20.072 5.065 -7.537 714 HG3 GLU 102 HG3 GLU 102 -21.518 4.156 -7.965 715 H VAL 103 H VAL 103 -18.188 3.361 -4.622 716 HA VAL 103 HA VAL 103 -16.097 3.480 -6.681 717 HB VAL 103 HB VAL 103 -16.977 5.776 -6.427 718 HG11 VAL 103 HG11 VAL 103 -17.796 5.574 -4.103 719 HG12 VAL 103 HG12 VAL 103 -16.731 6.967 -4.291 720 HG13 VAL 103 HG13 VAL 103 -16.132 5.495 -3.527 721 HG21 VAL 103 HG21 VAL 103 -14.562 5.404 -6.881 722 HG22 VAL 103 HG22 VAL 103 -14.246 5.431 -5.147 723 HG23 VAL 103 HG23 VAL 103 -14.840 6.880 -5.958 724 H ALA 104 H ALA 104 -14.088 2.858 -5.964 725 HA ALA 104 HA ALA 104 -13.407 2.678 -3.182 726 HB1 ALA 104 HB1 ALA 104 -14.992 0.660 -3.781 727 HB2 ALA 104 HB2 ALA 104 -13.558 0.404 -2.787 728 HB3 ALA 104 HB3 ALA 104 -13.526 -0.002 -4.504 729 H GLU 105 H GLU 105 -11.241 1.942 -2.841 730 HA GLU 105 HA GLU 105 -9.591 1.905 -5.301 731 HB2 GLU 105 HB2 GLU 105 -9.293 3.395 -2.728 732 HB3 GLU 105 HB3 GLU 105 -7.818 2.749 -3.441 733 HG2 GLU 105 HG2 GLU 105 -8.177 3.963 -5.486 734 HG3 GLU 105 HG3 GLU 105 -9.806 4.427 -4.991 735 H GLN 106 H GLN 106 -9.653 -0.341 -5.431 736 HA GLN 106 HA GLN 106 -8.139 -1.766 -3.320 737 HB2 GLN 106 HB2 GLN 106 -10.359 -2.789 -5.100 738 HB3 GLN 106 HB3 GLN 106 -9.372 -3.808 -4.054 739 HG2 GLN 106 HG2 GLN 106 -10.101 -2.498 -2.091 740 HG3 GLN 106 HG3 GLN 106 -11.092 -1.483 -3.139 741 HE21 GLN 106 HE21 GLN 106 -13.203 -2.105 -2.531 742 HE22 GLN 106 HE22 GLN 106 -13.770 -3.703 -2.588 743 H LEU 107 H LEU 107 -7.822 -0.562 -6.382 744 HA LEU 107 HA LEU 107 -6.278 -0.872 -8.038 745 HB2 LEU 107 HB2 LEU 107 -4.732 -1.529 -6.142 746 HB3 LEU 107 HB3 LEU 107 -5.171 -3.208 -6.460 747 HG LEU 107 HG LEU 107 -4.445 -2.830 -8.865 748 HD11 LEU 107 HD11 LEU 107 -4.485 -0.439 -9.045 749 HD12 LEU 107 HD12 LEU 107 -2.786 -0.904 -9.117 750 HD13 LEU 107 HD13 LEU 107 -3.458 -0.247 -7.625 751 HD21 LEU 107 HD21 LEU 107 -2.464 -2.556 -6.590 752 HD22 LEU 107 HD22 LEU 107 -1.984 -2.884 -8.255 753 HD23 LEU 107 HD23 LEU 107 -2.986 -4.042 -7.384 754 H VAL 108 H VAL 108 -6.939 -4.200 -6.878 755 HA VAL 108 HA VAL 108 -8.186 -4.773 -9.492 756 HB VAL 108 HB VAL 108 -7.191 -7.045 -9.410 757 HG11 VAL 108 HG11 VAL 108 -5.221 -4.743 -9.277 758 HG12 VAL 108 HG12 VAL 108 -6.074 -5.306 -10.714 759 HG13 VAL 108 HG13 VAL 108 -4.863 -6.334 -9.946 760 HG21 VAL 108 HG21 VAL 108 -5.700 -5.909 -7.017 761 HG22 VAL 108 HG22 VAL 108 -5.271 -7.413 -7.836 762 HG23 VAL 108 HG23 VAL 108 -6.821 -7.272 -7.005 763 H GLY 109 H GLY 109 -9.752 -6.514 -9.457 764 HA2 GLY 109 HA2 GLY 109 -11.405 -6.419 -7.096 765 HA3 GLY 109 HA3 GLY 109 -11.760 -7.284 -8.590 766 H VAL 110 H VAL 110 -11.608 -7.880 -5.519 767 HA VAL 110 HA VAL 110 -9.740 -10.069 -5.337 768 HB VAL 110 HB VAL 110 -10.800 -10.489 -3.134 769 HG11 VAL 110 HG11 VAL 110 -9.008 -8.737 -3.522 770 HG12 VAL 110 HG12 VAL 110 -10.012 -8.472 -2.095 771 HG13 VAL 110 HG13 VAL 110 -10.297 -7.535 -3.562 772 HG21 VAL 110 HG21 VAL 110 -13.119 -9.801 -3.816 773 HG22 VAL 110 HG22 VAL 110 -12.573 -8.124 -3.839 774 HG23 VAL 110 HG23 VAL 110 -12.579 -9.029 -2.324 775 H SER 111 H SER 111 -13.121 -9.702 -6.149 776 HA SER 111 HA SER 111 -13.236 -12.490 -7.010 777 HB2 SER 111 HB2 SER 111 -15.264 -12.989 -5.771 778 HB3 SER 111 HB3 SER 111 -14.001 -12.512 -4.640 779 HG SER 111 HG SER 111 -15.045 -10.701 -4.227 780 H ALA 112 H ALA 112 -15.191 -12.940 -8.277 781 HA ALA 112 HA ALA 112 -16.150 -10.507 -9.666 782 HB1 ALA 112 HB1 ALA 112 -15.055 -11.690 -11.323 783 HB2 ALA 112 HB2 ALA 112 -16.688 -12.344 -11.481 784 HB3 ALA 112 HB3 ALA 112 -15.452 -13.255 -10.613 785 H ALA 113 H ALA 113 -18.237 -10.040 -9.596 786 HA ALA 113 HA ALA 113 -20.262 -12.108 -9.346 787 HB1 ALA 113 HB1 ALA 113 -20.359 -9.907 -7.305 788 HB2 ALA 113 HB2 ALA 113 -19.422 -11.366 -6.983 789 HB3 ALA 113 HB3 ALA 113 -21.154 -11.479 -7.283 790 H SER 114 H SER 114 -22.379 -11.337 -9.846 791 HA SER 114 HA SER 114 -22.364 -9.005 -11.587 792 HB2 SER 114 HB2 SER 114 -24.567 -9.733 -12.262 793 HB3 SER 114 HB3 SER 114 -23.512 -11.142 -12.209 794 HG SER 114 HG SER 114 -25.461 -10.307 -10.332 795 H ALA 115 H ALA 115 -23.917 -7.273 -11.400 796 HA ALA 115 HA ALA 115 -25.340 -6.919 -8.897 797 HB1 ALA 115 HB1 ALA 115 -23.505 -5.928 -7.953 798 HB2 ALA 115 HB2 ALA 115 -24.075 -4.534 -8.872 799 HB3 ALA 115 HB3 ALA 115 -22.777 -5.545 -9.511 800 H ALA 116 H ALA 116 -26.797 -5.126 -8.983 801 HA ALA 116 HA ALA 116 -27.137 -3.932 -11.657 802 HB1 ALA 116 HB1 ALA 116 -29.477 -4.874 -10.014 803 HB2 ALA 116 HB2 ALA 116 -28.664 -5.927 -11.175 804 HB3 ALA 116 HB3 ALA 116 -29.437 -4.440 -11.723 805 H ALA 117 H ALA 117 -27.286 -3.591 -8.213 806 HA ALA 117 HA ALA 117 -27.565 -1.785 -6.834 807 HB1 ALA 117 HB1 ALA 117 -27.468 0.117 -9.137 808 HB2 ALA 117 HB2 ALA 117 -26.030 -0.838 -8.772 809 HB3 ALA 117 HB3 ALA 117 -26.712 0.235 -7.549 810 H SER 118 H SER 118 -29.444 -1.379 -5.916 811 HA SER 118 HA SER 118 -31.719 -0.513 -7.599 812 HB2 SER 118 HB2 SER 118 -31.738 -2.112 -5.024 813 HB3 SER 118 HB3 SER 118 -33.176 -1.526 -5.855 814 HG SER 118 HG SER 118 -31.453 -3.601 -6.481 815 H ALA 119 H ALA 119 -30.509 1.580 -7.223 816 HA ALA 119 HA ALA 119 -30.426 2.806 -4.686 817 HB1 ALA 119 HB1 ALA 119 -29.676 4.684 -5.791 818 HB2 ALA 119 HB2 ALA 119 -30.793 4.469 -7.138 819 HB3 ALA 119 HB3 ALA 119 -29.351 3.462 -7.021 820 H PHE 120 H PHE 120 -31.794 4.275 -3.686 821 HA PHE 120 HA PHE 120 -34.375 4.913 -4.870 822 HB2 PHE 120 HB2 PHE 120 -35.652 4.014 -2.956 823 HB3 PHE 120 HB3 PHE 120 -34.819 2.735 -3.836 824 HD1 PHE 120 HD1 PHE 120 -34.992 4.629 -0.696 825 HD2 PHE 120 HD2 PHE 120 -32.829 1.633 -2.881 826 HE1 PHE 120 HE1 PHE 120 -33.841 3.944 1.389 827 HE2 PHE 120 HE2 PHE 120 -31.679 0.943 -0.796 828 HZ PHE 120 HZ PHE 120 -32.184 2.098 1.340 829 H GLY 121 H GLY 121 -35.576 6.517 -3.552 830 HA2 GLY 121 HA2 GLY 121 -33.697 8.341 -2.238 831 HA3 GLY 121 HA3 GLY 121 -35.310 8.744 -2.820 832 H SER 122 H SER 122 -35.273 9.790 -0.607 833 HA SER 122 HA SER 122 -36.622 8.002 1.278 834 HB2 SER 122 HB2 SER 122 -34.283 7.951 2.010 835 HB3 SER 122 HB3 SER 122 -34.240 9.711 2.041 836 HG SER 122 HG SER 122 -34.827 8.274 4.032 837 H LEU 123 H LEU 123 -38.105 9.041 2.593 838 HA LEU 123 HA LEU 123 -39.138 11.529 1.643 839 HB2 LEU 123 HB2 LEU 123 -40.536 9.702 2.625 840 HB3 LEU 123 HB3 LEU 123 -39.823 10.043 4.198 841 HG LEU 123 HG LEU 123 -40.673 12.411 3.983 842 HD11 LEU 123 HD11 LEU 123 -42.563 12.715 2.320 843 HD12 LEU 123 HD12 LEU 123 -42.035 11.219 1.550 844 HD13 LEU 123 HD13 LEU 123 -40.959 12.615 1.597 845 HD21 LEU 123 HD21 LEU 123 -41.897 10.773 5.316 846 HD22 LEU 123 HD22 LEU 123 -42.704 10.161 3.872 847 HD23 LEU 123 HD23 LEU 123 -43.046 11.791 4.449 848 H SER 124 H SER 124 -38.594 13.532 2.213 849 HA SER 124 HA SER 124 -37.723 14.195 4.883 850 HB2 SER 124 HB2 SER 124 -35.846 14.562 2.531 851 HB3 SER 124 HB3 SER 124 -35.599 15.228 4.142 852 HG SER 124 HG SER 124 -34.673 13.026 3.449 853 H SER 125 H SER 125 -38.196 16.353 5.320 854 HA SER 125 HA SER 125 -39.401 17.843 3.083 855 HB2 SER 125 HB2 SER 125 -39.846 18.063 6.069 856 HB3 SER 125 HB3 SER 125 -40.582 19.121 4.868 857 HG SER 125 HG SER 125 -41.508 17.243 3.926 858 H ALA 126 H ALA 126 -36.945 17.908 5.553 859 HA ALA 126 HA ALA 126 -35.727 20.246 4.352 860 HB1 ALA 126 HB1 ALA 126 -36.651 21.691 5.822 861 HB2 ALA 126 HB2 ALA 126 -35.542 20.981 7.002 862 HB3 ALA 126 HB3 ALA 126 -37.203 20.392 6.882 863 H LEU 127 H LEU 127 -33.556 20.590 5.054 864 HA LEU 127 HA LEU 127 -32.387 18.465 6.701 865 HB2 LEU 127 HB2 LEU 127 -31.438 19.259 3.936 866 HB3 LEU 127 HB3 LEU 127 -30.494 18.280 5.056 867 HG LEU 127 HG LEU 127 -33.293 17.529 4.164 868 HD11 LEU 127 HD11 LEU 127 -30.645 16.504 3.099 869 HD12 LEU 127 HD12 LEU 127 -31.685 17.642 2.246 870 HD13 LEU 127 HD13 LEU 127 -32.253 16.006 2.575 871 HD21 LEU 127 HD21 LEU 127 -32.642 16.418 6.212 872 HD22 LEU 127 HD22 LEU 127 -31.037 16.064 5.573 873 HD23 LEU 127 HD23 LEU 127 -32.450 15.248 4.906 874 H LEU 128 H LEU 128 -30.567 19.062 7.859 875 HA LEU 128 HA LEU 128 -29.960 21.956 7.831 876 HB2 LEU 128 HB2 LEU 128 -29.983 19.877 10.015 877 HB3 LEU 128 HB3 LEU 128 -29.008 21.328 10.189 878 HG LEU 128 HG LEU 128 -31.195 21.611 11.277 879 HD11 LEU 128 HD11 LEU 128 -31.268 23.303 8.781 880 HD12 LEU 128 HD12 LEU 128 -30.048 23.540 10.035 881 HD13 LEU 128 HD13 LEU 128 -31.758 23.742 10.418 882 HD21 LEU 128 HD21 LEU 128 -32.489 21.370 8.553 883 HD22 LEU 128 HD22 LEU 128 -33.281 21.467 10.127 884 HD23 LEU 128 HD23 LEU 128 -32.386 20.014 9.677 885 H MET 129 H MET 129 -28.157 22.358 6.729 886 HA MET 129 HA MET 129 -25.769 20.721 7.287 887 HB2 MET 129 HB2 MET 129 -26.724 21.585 4.545 888 HB3 MET 129 HB3 MET 129 -25.142 20.881 4.881 889 HG2 MET 129 HG2 MET 129 -26.191 18.835 5.716 890 HG3 MET 129 HG3 MET 129 -27.793 19.539 5.494 891 HE1 MET 129 HE1 MET 129 -24.508 19.681 3.228 892 HE2 MET 129 HE2 MET 129 -24.791 18.206 2.303 893 HE3 MET 129 HE3 MET 129 -24.639 18.123 4.058 894 HA PRO 130 HA PRO 130 -23.842 24.705 7.769 895 HB2 PRO 130 HB2 PRO 130 -21.251 24.215 7.095 896 HB3 PRO 130 HB3 PRO 130 -21.979 23.608 8.597 897 HG2 PRO 130 HG2 PRO 130 -21.517 22.187 6.011 898 HG3 PRO 130 HG3 PRO 130 -21.240 21.626 7.671 899 HD2 PRO 130 HD2 PRO 130 -23.447 20.908 6.249 900 HD3 PRO 130 HD3 PRO 130 -23.478 21.108 8.014 901 H LYS 131 H LYS 131 -23.060 26.533 6.605 902 HA LYS 131 HA LYS 131 -23.327 26.292 3.671 903 HB2 LYS 131 HB2 LYS 131 -23.613 28.697 5.492 904 HB3 LYS 131 HB3 LYS 131 -23.745 28.742 3.732 905 HG2 LYS 131 HG2 LYS 131 -25.642 27.192 3.805 906 HG3 LYS 131 HG3 LYS 131 -25.491 27.057 5.555 907 HD2 LYS 131 HD2 LYS 131 -27.242 28.639 5.173 908 HD3 LYS 131 HD3 LYS 131 -25.836 29.584 5.656 909 HE2 LYS 131 HE2 LYS 131 -25.346 30.101 3.309 910 HE3 LYS 131 HE3 LYS 131 -26.696 29.095 2.786 911 HZ1 LYS 131 HZ1 LYS 131 -28.008 30.641 4.411 912 HZ2 LYS 131 HZ2 LYS 131 -27.679 31.135 2.819 913 HZ3 LYS 131 HZ3 LYS 131 -26.729 31.713 4.104 914 H ASP 132 H ASP 132 -21.703 26.849 2.341 915 HA ASP 132 HA ASP 132 -19.185 27.807 3.573 916 HB2 ASP 132 HB2 ASP 132 -19.571 26.114 1.092 917 HB3 ASP 132 HB3 ASP 132 -18.023 26.646 1.745 918 H GLY 133 H GLY 133 -18.178 29.551 2.735 919 HA2 GLY 133 HA2 GLY 133 -18.717 30.604 0.116 920 HA3 GLY 133 HA3 GLY 133 -19.484 31.554 1.385 921 H LEU 134 H LEU 134 -17.569 32.700 -0.221 922 HA LEU 134 HA LEU 134 -15.492 33.335 1.739 923 HB2 LEU 134 HB2 LEU 134 -14.537 31.540 0.295 924 HB3 LEU 134 HB3 LEU 134 -14.823 32.554 -1.113 925 HG LEU 134 HG LEU 134 -13.359 34.316 -0.056 926 HD11 LEU 134 HD11 LEU 134 -13.454 33.718 2.273 927 HD12 LEU 134 HD12 LEU 134 -11.794 33.448 1.747 928 HD13 LEU 134 HD13 LEU 134 -12.890 32.081 1.936 929 HD21 LEU 134 HD21 LEU 134 -12.522 32.708 -1.761 930 HD22 LEU 134 HD22 LEU 134 -12.051 31.610 -0.462 931 HD23 LEU 134 HD23 LEU 134 -11.265 33.181 -0.619 932 H GLU 135 H GLU 135 -15.491 35.480 1.934 933 HA GLU 135 HA GLU 135 -15.671 37.167 -0.457 934 HB2 GLU 135 HB2 GLU 135 -18.001 36.892 0.425 935 HB3 GLU 135 HB3 GLU 135 -17.462 37.596 1.948 936 HG2 GLU 135 HG2 GLU 135 -16.812 39.661 0.784 937 HG3 GLU 135 HG3 GLU 135 -17.301 38.959 -0.758 938 H HIS 136 H HIS 136 -14.229 38.776 -0.350 939 HA HIS 136 HA HIS 136 -13.438 39.913 2.222 940 HB2 HIS 136 HB2 HIS 136 -11.912 37.970 1.860 941 HB3 HIS 136 HB3 HIS 136 -11.396 38.696 0.341 942 HD2 HIS 136 HD2 HIS 136 -9.267 40.438 0.647 943 HE1 HIS 136 HE1 HIS 136 -9.636 41.104 4.800 944 HE2 HIS 136 HE2 HIS 136 -8.229 41.598 2.743 945 H HIS 137 H HIS 137 -13.241 42.051 2.016 946 HA HIS 137 HA HIS 137 -12.456 43.200 -0.583 947 HB2 HIS 137 HB2 HIS 137 -14.810 44.122 1.087 948 HB3 HIS 137 HB3 HIS 137 -14.192 44.945 -0.343 949 HD2 HIS 137 HD2 HIS 137 -16.717 42.208 0.495 950 HE1 HIS 137 HE1 HIS 137 -15.843 41.747 -3.608 951 HE2 HIS 137 HE2 HIS 137 -17.410 41.045 -1.737 952 H HIS 138 H HIS 138 -11.259 45.068 -0.463 953 HA HIS 138 HA HIS 138 -10.697 46.167 2.221 954 HB2 HIS 138 HB2 HIS 138 -8.911 44.551 1.451 955 HB3 HIS 138 HB3 HIS 138 -8.580 45.656 0.121 956 HD2 HIS 138 HD2 HIS 138 -7.858 45.350 3.931 957 HE1 HIS 138 HE1 HIS 138 -6.303 49.059 2.648 958 HE2 HIS 138 HE2 HIS 138 -6.395 47.412 4.580 959 H HIS 139 H HIS 139 -11.812 48.053 1.914 960 HA HIS 139 HA HIS 139 -10.852 49.821 -0.262 961 HB2 HIS 139 HB2 HIS 139 -13.657 49.640 0.862 962 HB3 HIS 139 HB3 HIS 139 -13.110 50.839 -0.308 963 HD2 HIS 139 HD2 HIS 139 -14.554 47.297 -0.314 964 HE1 HIS 139 HE1 HIS 139 -12.801 47.839 -4.115 965 HE2 HIS 139 HE2 HIS 139 -14.318 46.343 -2.733 966 H HIS 140 H HIS 140 -10.232 49.452 2.772 967 HA HIS 140 HA HIS 140 -10.416 52.330 3.421 968 HB2 HIS 140 HB2 HIS 140 -10.895 50.040 5.346 969 HB3 HIS 140 HB3 HIS 140 -10.798 51.743 5.794 970 HD2 HIS 140 HD2 HIS 140 -13.457 49.245 4.671 971 HE1 HIS 140 HE1 HIS 140 -15.093 53.068 3.943 972 HE2 HIS 140 HE2 HIS 140 -15.617 50.585 4.076 973 H HIS 141 H HIS 141 -8.668 53.209 4.479 974 HA HIS 141 HA HIS 141 -6.362 51.422 4.968 975 HB2 HIS 141 HB2 HIS 141 -4.869 53.202 4.101 976 HB3 HIS 141 HB3 HIS 141 -5.959 52.585 2.863 977 HD2 HIS 141 HD2 HIS 141 -7.720 54.497 1.795 978 HE1 HIS 141 HE1 HIS 141 -6.604 57.692 4.318 979 HE2 HIS 141 HE2 HIS 141 -7.979 57.050 2.280 Start of MODEL 4 1 H1 MET 1 HT1 MET 1 2.762 7.401 -14.490 2 H2 MET 1 HT2 MET 1 2.443 5.829 -15.053 3 H3 MET 1 HT3 MET 1 2.405 6.162 -13.388 4 HA MET 1 HA MET 1 0.208 5.990 -14.752 5 HB2 MET 1 HB2 MET 1 0.460 6.542 -12.321 6 HB3 MET 1 HB3 MET 1 0.732 8.227 -12.762 7 HG2 MET 1 HG2 MET 1 -1.493 8.323 -13.813 8 HG3 MET 1 HG3 MET 1 -1.768 6.630 -13.400 9 HE1 MET 1 HE1 MET 1 -0.099 9.646 -11.232 10 HE2 MET 1 HE2 MET 1 -1.649 10.307 -10.719 11 HE3 MET 1 HE3 MET 1 -1.291 10.152 -12.437 12 H SER 2 H SER 2 1.068 6.704 -16.943 13 HA SER 2 HA SER 2 0.997 8.111 -18.757 14 HB2 SER 2 HB2 SER 2 -1.188 9.405 -17.106 15 HB3 SER 2 HB3 SER 2 -0.920 9.668 -18.826 16 HG SER 2 HG SER 2 -2.506 8.033 -18.323 17 H ASP 3 H ASP 3 3.090 8.668 -17.151 18 HA ASP 3 HA ASP 3 3.402 11.557 -17.504 19 HB2 ASP 3 HB2 ASP 3 2.633 10.954 -15.097 20 HB3 ASP 3 HB3 ASP 3 4.271 10.336 -14.899 21 H GLN 4 H GLN 4 5.706 12.208 -17.043 22 HA GLN 4 HA GLN 4 7.538 10.132 -18.081 23 HB2 GLN 4 HB2 GLN 4 7.686 13.153 -18.303 24 HB3 GLN 4 HB3 GLN 4 8.896 12.035 -18.925 25 HG2 GLN 4 HG2 GLN 4 5.978 12.064 -19.758 26 HG3 GLN 4 HG3 GLN 4 7.293 12.778 -20.686 27 HE21 GLN 4 HE21 GLN 4 9.239 11.019 -20.938 28 HE22 GLN 4 HE22 GLN 4 8.712 9.490 -21.455 29 H SER 5 H SER 5 6.941 10.217 -15.331 30 HA SER 5 HA SER 5 9.610 10.634 -14.247 31 HB2 SER 5 HB2 SER 5 8.568 12.823 -13.874 32 HB3 SER 5 HB3 SER 5 7.197 12.049 -13.083 33 HG SER 5 HG SER 5 9.919 11.966 -12.260 34 H GLN 6 H GLN 6 10.018 9.410 -12.403 35 HA GLN 6 HA GLN 6 7.992 7.347 -11.816 36 HB2 GLN 6 HB2 GLN 6 10.287 6.646 -12.590 37 HB3 GLN 6 HB3 GLN 6 10.938 7.344 -11.107 38 HG2 GLN 6 HG2 GLN 6 9.551 5.833 -9.761 39 HG3 GLN 6 HG3 GLN 6 8.832 5.163 -11.224 40 HE21 GLN 6 HE21 GLN 6 10.669 3.941 -9.046 41 HE22 GLN 6 HE22 GLN 6 11.914 3.211 -9.940 42 H GLU 7 H GLU 7 6.716 8.285 -10.295 43 HA GLU 7 HA GLU 7 7.839 8.625 -7.640 44 HB2 GLU 7 HB2 GLU 7 6.706 10.898 -9.235 45 HB3 GLU 7 HB3 GLU 7 6.457 10.865 -7.496 46 HG2 GLU 7 HG2 GLU 7 9.149 10.764 -8.896 47 HG3 GLU 7 HG3 GLU 7 8.467 12.170 -8.095 48 HA PRO 8 HA PRO 8 2.789 9.048 -7.562 49 HB2 PRO 8 HB2 PRO 8 2.633 7.337 -10.027 50 HB3 PRO 8 HB3 PRO 8 1.441 8.483 -9.375 51 HG2 PRO 8 HG2 PRO 8 3.083 9.122 -11.392 52 HG3 PRO 8 HG3 PRO 8 2.542 10.305 -10.189 53 HD2 PRO 8 HD2 PRO 8 5.222 9.202 -10.600 54 HD3 PRO 8 HD3 PRO 8 4.728 10.610 -9.647 55 H THR 9 H THR 9 3.253 7.844 -5.765 56 HA THR 9 HA THR 9 4.082 5.177 -5.606 57 HB THR 9 HB THR 9 3.096 5.169 -3.339 58 HG1 THR 9 HG1 THR 9 1.676 6.647 -2.754 59 HG21 THR 9 HG21 THR 9 5.261 6.375 -3.879 60 HG22 THR 9 HG22 THR 9 4.431 6.942 -2.431 61 HG23 THR 9 HG23 THR 9 4.326 7.869 -3.930 62 H MET 10 H MET 10 2.703 3.324 -4.770 63 HA MET 10 HA MET 10 0.858 2.516 -6.677 64 HB2 MET 10 HB2 MET 10 0.239 0.730 -5.103 65 HB3 MET 10 HB3 MET 10 1.984 0.950 -5.176 66 HG2 MET 10 HG2 MET 10 1.872 2.342 -3.112 67 HG3 MET 10 HG3 MET 10 0.136 2.037 -3.026 68 HE1 MET 10 HE1 MET 10 3.616 -0.837 -2.344 69 HE2 MET 10 HE2 MET 10 3.642 0.852 -2.847 70 HE3 MET 10 HE3 MET 10 3.204 -0.398 -4.007 71 H GLU 11 H GLU 11 0.355 4.399 -3.806 72 HA GLU 11 HA GLU 11 -2.430 4.094 -3.467 73 HB2 GLU 11 HB2 GLU 11 -0.634 6.466 -2.922 74 HB3 GLU 11 HB3 GLU 11 -2.334 6.420 -2.462 75 HG2 GLU 11 HG2 GLU 11 -1.930 4.393 -1.124 76 HG3 GLU 11 HG3 GLU 11 -0.231 4.416 -1.593 77 H GLU 12 H GLU 12 -0.650 6.575 -5.318 78 HA GLU 12 HA GLU 12 -2.840 7.903 -6.394 79 HB2 GLU 12 HB2 GLU 12 -0.055 7.497 -7.493 80 HB3 GLU 12 HB3 GLU 12 -1.236 8.579 -8.229 81 HG2 GLU 12 HG2 GLU 12 -0.249 8.757 -5.364 82 HG3 GLU 12 HG3 GLU 12 0.285 9.790 -6.687 83 H ILE 13 H ILE 13 -1.100 5.059 -7.729 84 HA ILE 13 HA ILE 13 -2.416 4.962 -10.190 85 HB ILE 13 HB ILE 13 -1.124 2.812 -8.493 86 HG12 ILE 13 HG12 ILE 13 0.459 2.921 -10.562 87 HG13 ILE 13 HG13 ILE 13 -0.366 4.432 -10.934 88 HG21 ILE 13 HG21 ILE 13 -2.352 2.539 -11.254 89 HG22 ILE 13 HG22 ILE 13 -2.780 1.625 -9.807 90 HG23 ILE 13 HG23 ILE 13 -1.210 1.386 -10.570 91 HD11 ILE 13 HD11 ILE 13 0.836 3.905 -8.218 92 HD12 ILE 13 HD12 ILE 13 0.384 5.454 -8.929 93 HD13 ILE 13 HD13 ILE 13 1.788 4.579 -9.538 94 H LEU 14 H LEU 14 -3.342 3.348 -7.094 95 HA LEU 14 HA LEU 14 -5.635 2.055 -8.059 96 HB2 LEU 14 HB2 LEU 14 -4.799 3.106 -5.361 97 HB3 LEU 14 HB3 LEU 14 -6.451 2.538 -5.583 98 HG LEU 14 HG LEU 14 -5.393 0.404 -6.574 99 HD11 LEU 14 HD11 LEU 14 -2.996 1.475 -5.059 100 HD12 LEU 14 HD12 LEU 14 -3.104 1.377 -6.816 101 HD13 LEU 14 HD13 LEU 14 -3.118 -0.096 -5.849 102 HD21 LEU 14 HD21 LEU 14 -5.131 1.177 -3.657 103 HD22 LEU 14 HD22 LEU 14 -4.905 -0.473 -4.233 104 HD23 LEU 14 HD23 LEU 14 -6.467 0.321 -4.424 105 H ALA 15 H ALA 15 -5.061 5.327 -6.914 106 HA ALA 15 HA ALA 15 -7.715 6.308 -6.847 107 HB1 ALA 15 HB1 ALA 15 -6.772 8.382 -6.478 108 HB2 ALA 15 HB2 ALA 15 -5.452 8.104 -7.614 109 HB3 ALA 15 HB3 ALA 15 -5.420 7.344 -6.023 110 H SER 16 H SER 16 -5.304 6.111 -9.431 111 HA SER 16 HA SER 16 -6.602 7.674 -11.369 112 HB2 SER 16 HB2 SER 16 -4.280 6.913 -11.616 113 HB3 SER 16 HB3 SER 16 -4.833 5.246 -11.760 114 HG SER 16 HG SER 16 -4.687 7.164 -13.637 115 H ILE 17 H ILE 17 -6.872 4.216 -10.598 116 HA ILE 17 HA ILE 17 -8.599 3.491 -12.704 117 HB ILE 17 HB ILE 17 -8.302 2.338 -9.909 118 HG12 ILE 17 HG12 ILE 17 -7.323 1.280 -12.577 119 HG13 ILE 17 HG13 ILE 17 -6.341 2.328 -11.556 120 HG21 ILE 17 HG21 ILE 17 -9.363 0.283 -10.970 121 HG22 ILE 17 HG22 ILE 17 -9.817 1.302 -12.334 122 HG23 ILE 17 HG23 ILE 17 -10.474 1.631 -10.730 123 HD11 ILE 17 HD11 ILE 17 -5.949 -0.169 -11.249 124 HD12 ILE 17 HD12 ILE 17 -7.564 -0.250 -10.550 125 HD13 ILE 17 HD13 ILE 17 -6.315 0.725 -9.775 126 H ARG 18 H ARG 18 -9.273 4.709 -9.407 127 HA ARG 18 HA ARG 18 -12.021 4.568 -9.310 128 HB2 ARG 18 HB2 ARG 18 -10.333 5.514 -7.593 129 HB3 ARG 18 HB3 ARG 18 -10.532 7.044 -8.443 130 HG2 ARG 18 HG2 ARG 18 -12.115 7.115 -6.672 131 HG3 ARG 18 HG3 ARG 18 -13.060 6.720 -8.103 132 HD2 ARG 18 HD2 ARG 18 -13.069 4.362 -7.514 133 HD3 ARG 18 HD3 ARG 18 -11.973 4.659 -6.166 134 HE ARG 18 HE ARG 18 -14.828 5.195 -6.237 135 HH11 ARG 18 HH11 ARG 18 -11.786 5.870 -4.632 136 HH12 ARG 18 HH12 ARG 18 -12.546 6.377 -3.160 137 HH21 ARG 18 HH21 ARG 18 -15.773 5.866 -4.308 138 HH22 ARG 18 HH22 ARG 18 -14.785 6.377 -2.979 139 H ARG 19 H ARG 19 -13.725 6.091 -9.822 140 HA ARG 19 HA ARG 19 -13.132 8.184 -11.765 141 HB2 ARG 19 HB2 ARG 19 -14.781 7.334 -13.391 142 HB3 ARG 19 HB3 ARG 19 -13.444 6.207 -13.181 143 HG2 ARG 19 HG2 ARG 19 -14.840 4.895 -11.582 144 HG3 ARG 19 HG3 ARG 19 -16.185 5.991 -11.898 145 HD2 ARG 19 HD2 ARG 19 -16.430 4.015 -13.301 146 HD3 ARG 19 HD3 ARG 19 -16.048 5.402 -14.317 147 HE ARG 19 HE ARG 19 -13.668 4.028 -13.542 148 HH11 ARG 19 HH11 ARG 19 -16.396 3.793 -15.731 149 HH12 ARG 19 HH12 ARG 19 -15.529 2.846 -16.892 150 HH21 ARG 19 HH21 ARG 19 -12.580 2.798 -15.081 151 HH22 ARG 19 HH22 ARG 19 -13.387 2.287 -16.526 152 H ILE 20 H ILE 20 -15.132 9.468 -12.277 153 HA ILE 20 HA ILE 20 -17.057 9.410 -10.032 154 HB ILE 20 HB ILE 20 -15.364 11.169 -9.666 155 HG12 ILE 20 HG12 ILE 20 -16.999 13.138 -9.584 156 HG13 ILE 20 HG13 ILE 20 -18.176 12.065 -10.337 157 HG21 ILE 20 HG21 ILE 20 -14.888 11.544 -12.110 158 HG22 ILE 20 HG22 ILE 20 -15.104 13.028 -11.180 159 HG23 ILE 20 HG23 ILE 20 -16.406 12.435 -12.211 160 HD11 ILE 20 HD11 ILE 20 -16.695 11.299 -7.814 161 HD12 ILE 20 HD12 ILE 20 -18.155 10.568 -8.482 162 HD13 ILE 20 HD13 ILE 20 -18.222 12.182 -7.775 163 H ILE 21 H ILE 21 -19.148 9.912 -10.475 164 HA ILE 21 HA ILE 21 -20.034 9.631 -13.204 165 HB ILE 21 HB ILE 21 -21.610 10.203 -10.664 166 HG12 ILE 21 HG12 ILE 21 -21.308 7.579 -12.154 167 HG13 ILE 21 HG13 ILE 21 -20.264 8.024 -10.806 168 HG21 ILE 21 HG21 ILE 21 -23.523 9.287 -12.039 169 HG22 ILE 21 HG22 ILE 21 -22.471 9.353 -13.452 170 HG23 ILE 21 HG23 ILE 21 -22.915 10.841 -12.615 171 HD11 ILE 21 HD11 ILE 21 -22.260 8.272 -9.355 172 HD12 ILE 21 HD12 ILE 21 -22.140 6.641 -10.015 173 HD13 ILE 21 HD13 ILE 21 -23.288 7.789 -10.702 174 H SER 22 H SER 22 -20.778 11.187 -14.560 175 HA SER 22 HA SER 22 -20.631 13.992 -13.615 176 HB2 SER 22 HB2 SER 22 -18.986 13.529 -15.345 177 HB3 SER 22 HB3 SER 22 -20.226 12.839 -16.387 178 HG SER 22 HG SER 22 -19.852 15.517 -15.568 179 H GLU 23 H GLU 23 -22.523 14.944 -13.370 180 HA GLU 23 HA GLU 23 -24.997 13.853 -14.190 181 HB2 GLU 23 HB2 GLU 23 -24.661 15.434 -12.276 182 HB3 GLU 23 HB3 GLU 23 -24.413 16.730 -13.446 183 HG2 GLU 23 HG2 GLU 23 -26.663 16.321 -14.377 184 HG3 GLU 23 HG3 GLU 23 -26.914 15.026 -13.211 185 H ASP 24 H ASP 24 -22.955 16.406 -15.566 186 HA ASP 24 HA ASP 24 -24.415 16.156 -18.113 187 HB2 ASP 24 HB2 ASP 24 -25.288 18.132 -16.774 188 HB3 ASP 24 HB3 ASP 24 -23.669 18.823 -16.927 189 H ASP 25 H ASP 25 -22.917 15.632 -19.579 190 HA ASP 25 HA ASP 25 -20.154 16.504 -19.189 191 HB2 ASP 25 HB2 ASP 25 -21.351 14.637 -21.254 192 HB3 ASP 25 HB3 ASP 25 -19.631 14.961 -21.044 193 H ALA 26 H ALA 26 -22.869 16.941 -21.379 194 HA ALA 26 HA ALA 26 -21.438 18.425 -23.368 195 HB1 ALA 26 HB1 ALA 26 -24.326 17.899 -22.762 196 HB2 ALA 26 HB2 ALA 26 -23.398 17.501 -24.207 197 HB3 ALA 26 HB3 ALA 26 -23.899 19.165 -23.912 198 HA PRO 27 HA PRO 27 -21.202 22.480 -21.544 199 HB2 PRO 27 HB2 PRO 27 -22.420 23.595 -24.036 200 HB3 PRO 27 HB3 PRO 27 -20.890 24.017 -23.239 201 HG2 PRO 27 HG2 PRO 27 -20.883 22.603 -25.463 202 HG3 PRO 27 HG3 PRO 27 -19.774 22.200 -24.137 203 HD2 PRO 27 HD2 PRO 27 -22.334 20.833 -24.928 204 HD3 PRO 27 HD3 PRO 27 -20.788 20.118 -24.409 205 H ALA 28 H ALA 28 -22.475 23.837 -20.328 206 HA ALA 28 HA ALA 28 -25.187 23.194 -19.873 207 HB1 ALA 28 HB1 ALA 28 -23.937 25.838 -19.144 208 HB2 ALA 28 HB2 ALA 28 -23.512 24.352 -18.298 209 HB3 ALA 28 HB3 ALA 28 -25.176 24.934 -18.277 210 H GLU 29 H GLU 29 -27.100 24.253 -20.419 211 HA GLU 29 HA GLU 29 -26.937 26.457 -22.352 212 HB2 GLU 29 HB2 GLU 29 -28.569 23.927 -22.748 213 HB3 GLU 29 HB3 GLU 29 -28.666 25.363 -23.764 214 HG2 GLU 29 HG2 GLU 29 -26.167 23.695 -23.336 215 HG3 GLU 29 HG3 GLU 29 -27.203 23.615 -24.757 216 HA PRO 30 HA PRO 30 -30.216 26.734 -18.984 217 HB2 PRO 30 HB2 PRO 30 -29.231 28.730 -17.466 218 HB3 PRO 30 HB3 PRO 30 -28.710 27.052 -17.250 219 HG2 PRO 30 HG2 PRO 30 -27.353 29.283 -18.692 220 HG3 PRO 30 HG3 PRO 30 -26.670 28.071 -17.591 221 HD2 PRO 30 HD2 PRO 30 -26.519 27.863 -20.321 222 HD3 PRO 30 HD3 PRO 30 -26.530 26.457 -19.234 223 H ALA 31 H ALA 31 -31.823 28.440 -18.734 224 HA ALA 31 HA ALA 31 -31.913 30.265 -20.996 225 HB1 ALA 31 HB1 ALA 31 -34.175 30.321 -20.651 226 HB2 ALA 31 HB2 ALA 31 -34.005 30.316 -18.890 227 HB3 ALA 31 HB3 ALA 31 -33.841 28.811 -19.800 228 H ALA 32 H ALA 32 -32.075 30.396 -17.470 229 HA ALA 32 HA ALA 32 -30.660 32.885 -17.391 230 HB1 ALA 32 HB1 ALA 32 -33.295 33.234 -16.127 231 HB2 ALA 32 HB2 ALA 32 -33.332 33.112 -17.890 232 HB3 ALA 32 HB3 ALA 32 -32.350 34.358 -17.109 233 H GLU 33 H GLU 33 -29.696 33.176 -15.430 234 HA GLU 33 HA GLU 33 -30.734 31.883 -13.039 235 HB2 GLU 33 HB2 GLU 33 -29.368 30.132 -14.248 236 HB3 GLU 33 HB3 GLU 33 -27.962 31.168 -14.011 237 HG2 GLU 33 HG2 GLU 33 -28.325 31.106 -11.568 238 HG3 GLU 33 HG3 GLU 33 -29.728 30.067 -11.804 239 H ALA 34 H ALA 34 -29.865 32.704 -11.131 240 HA ALA 34 HA ALA 34 -27.952 34.939 -11.408 241 HB1 ALA 34 HB1 ALA 34 -29.212 36.295 -9.904 242 HB2 ALA 34 HB2 ALA 34 -30.274 34.953 -9.474 243 HB3 ALA 34 HB3 ALA 34 -30.374 35.681 -11.078 244 H ALA 35 H ALA 35 -26.189 34.532 -10.315 245 HA ALA 35 HA ALA 35 -26.210 33.646 -7.591 246 HB1 ALA 35 HB1 ALA 35 -24.634 31.617 -8.807 247 HB2 ALA 35 HB2 ALA 35 -26.185 31.648 -9.653 248 HB3 ALA 35 HB3 ALA 35 -26.136 31.428 -7.902 249 HA PRO 36 HA PRO 36 -22.168 35.498 -7.699 250 HB2 PRO 36 HB2 PRO 36 -20.605 33.951 -6.081 251 HB3 PRO 36 HB3 PRO 36 -21.889 35.004 -5.455 252 HG2 PRO 36 HG2 PRO 36 -21.940 32.064 -5.966 253 HG3 PRO 36 HG3 PRO 36 -22.561 32.978 -4.579 254 HD2 PRO 36 HD2 PRO 36 -24.189 32.104 -6.568 255 HD3 PRO 36 HD3 PRO 36 -24.497 33.619 -5.691 256 HA PRO 37 HA PRO 37 -19.711 33.538 -10.857 257 HB2 PRO 37 HB2 PRO 37 -17.157 34.402 -10.349 258 HB3 PRO 37 HB3 PRO 37 -18.413 35.428 -11.068 259 HG2 PRO 37 HG2 PRO 37 -17.482 35.284 -8.239 260 HG3 PRO 37 HG3 PRO 37 -17.865 36.703 -9.229 261 HD2 PRO 37 HD2 PRO 37 -19.611 35.736 -7.397 262 HD3 PRO 37 HD3 PRO 37 -20.160 36.472 -8.919 263 HA PRO 38 HA PRO 38 -18.124 29.790 -8.990 264 HB2 PRO 38 HB2 PRO 38 -16.864 28.605 -11.082 265 HB3 PRO 38 HB3 PRO 38 -18.633 28.722 -10.972 266 HG2 PRO 38 HG2 PRO 38 -16.719 30.415 -12.514 267 HG3 PRO 38 HG3 PRO 38 -18.281 29.742 -13.013 268 HD2 PRO 38 HD2 PRO 38 -17.998 32.329 -12.204 269 HD3 PRO 38 HD3 PRO 38 -19.494 31.405 -11.948 270 HA PRO 39 HA PRO 39 -13.926 30.679 -7.655 271 HB2 PRO 39 HB2 PRO 39 -13.505 27.738 -7.420 272 HB3 PRO 39 HB3 PRO 39 -13.333 29.004 -6.189 273 HG2 PRO 39 HG2 PRO 39 -15.381 27.337 -6.131 274 HG3 PRO 39 HG3 PRO 39 -15.593 29.054 -5.734 275 HD2 PRO 39 HD2 PRO 39 -16.294 27.610 -8.279 276 HD3 PRO 39 HD3 PRO 39 -17.211 28.856 -7.400 277 HA PRO 40 HA PRO 40 -11.443 30.091 -11.350 278 HB2 PRO 40 HB2 PRO 40 -8.899 30.382 -10.361 279 HB3 PRO 40 HB3 PRO 40 -10.004 31.739 -10.653 280 HG2 PRO 40 HG2 PRO 40 -9.380 30.329 -8.101 281 HG3 PRO 40 HG3 PRO 40 -9.564 32.065 -8.417 282 HD2 PRO 40 HD2 PRO 40 -11.547 30.615 -7.283 283 HD3 PRO 40 HD3 PRO 40 -11.890 31.964 -8.389 284 H GLU 41 H GLU 41 -11.043 28.074 -8.566 285 HA GLU 41 HA GLU 41 -9.778 25.980 -10.232 286 HB2 GLU 41 HB2 GLU 41 -8.750 25.112 -8.102 287 HB3 GLU 41 HB3 GLU 41 -8.124 26.669 -8.625 288 HG2 GLU 41 HG2 GLU 41 -9.629 27.810 -7.020 289 HG3 GLU 41 HG3 GLU 41 -10.239 26.248 -6.483 290 HA PRO 42 HA PRO 42 -13.938 24.524 -8.591 291 HB2 PRO 42 HB2 PRO 42 -14.954 23.620 -10.948 292 HB3 PRO 42 HB3 PRO 42 -15.100 25.310 -10.426 293 HG2 PRO 42 HG2 PRO 42 -13.157 24.082 -12.331 294 HG3 PRO 42 HG3 PRO 42 -14.068 25.597 -12.471 295 HD2 PRO 42 HD2 PRO 42 -11.461 25.547 -11.703 296 HD3 PRO 42 HD3 PRO 42 -12.604 26.765 -11.096 297 H GLU 43 H GLU 43 -14.629 22.371 -8.272 298 HA GLU 43 HA GLU 43 -12.852 20.247 -9.310 299 HB2 GLU 43 HB2 GLU 43 -13.869 20.556 -6.471 300 HB3 GLU 43 HB3 GLU 43 -13.012 19.144 -7.088 301 HG2 GLU 43 HG2 GLU 43 -11.062 20.549 -7.631 302 HG3 GLU 43 HG3 GLU 43 -11.916 21.971 -7.031 303 HA PRO 44 HA PRO 44 -16.510 18.032 -10.512 304 HB2 PRO 44 HB2 PRO 44 -15.460 15.649 -9.042 305 HB3 PRO 44 HB3 PRO 44 -15.993 15.789 -10.729 306 HG2 PRO 44 HG2 PRO 44 -13.425 15.643 -10.170 307 HG3 PRO 44 HG3 PRO 44 -14.006 16.772 -11.411 308 HD2 PRO 44 HD2 PRO 44 -13.155 17.356 -8.586 309 HD3 PRO 44 HD3 PRO 44 -12.838 18.283 -10.071 310 H GLU 45 H GLU 45 -18.544 17.718 -9.724 311 HA GLU 45 HA GLU 45 -19.092 18.315 -6.987 312 HB2 GLU 45 HB2 GLU 45 -20.866 17.363 -9.244 313 HB3 GLU 45 HB3 GLU 45 -21.466 17.831 -7.653 314 HG2 GLU 45 HG2 GLU 45 -20.465 20.070 -7.930 315 HG3 GLU 45 HG3 GLU 45 -19.868 19.605 -9.523 316 HA PRO 46 HA PRO 46 -19.079 14.189 -5.293 317 HB2 PRO 46 HB2 PRO 46 -20.861 14.381 -3.252 318 HB3 PRO 46 HB3 PRO 46 -19.270 15.171 -3.208 319 HG2 PRO 46 HG2 PRO 46 -21.939 16.331 -3.870 320 HG3 PRO 46 HG3 PRO 46 -20.647 16.993 -2.852 321 HD2 PRO 46 HD2 PRO 46 -21.027 17.803 -5.424 322 HD3 PRO 46 HD3 PRO 46 -19.419 17.760 -4.666 323 H VAL 47 H VAL 47 -20.388 12.251 -4.986 324 HA VAL 47 HA VAL 47 -22.998 12.326 -6.380 325 HB VAL 47 HB VAL 47 -22.464 10.106 -7.352 326 HG11 VAL 47 HG11 VAL 47 -20.665 10.952 -8.937 327 HG12 VAL 47 HG12 VAL 47 -20.571 12.397 -7.929 328 HG13 VAL 47 HG13 VAL 47 -22.074 12.000 -8.766 329 HG21 VAL 47 HG21 VAL 47 -19.690 10.624 -6.218 330 HG22 VAL 47 HG22 VAL 47 -20.129 9.293 -7.290 331 HG23 VAL 47 HG23 VAL 47 -20.806 9.375 -5.661 332 H SER 48 H SER 48 -24.469 10.606 -5.810 333 HA SER 48 HA SER 48 -24.748 10.249 -3.036 334 HB2 SER 48 HB2 SER 48 -26.652 10.169 -4.570 335 HB3 SER 48 HB3 SER 48 -26.019 8.701 -5.305 336 HG SER 48 HG SER 48 -26.185 7.726 -3.218 337 H PHE 49 H PHE 49 -23.606 8.014 -5.560 338 HA PHE 49 HA PHE 49 -22.598 6.224 -3.425 339 HB2 PHE 49 HB2 PHE 49 -23.534 5.550 -6.225 340 HB3 PHE 49 HB3 PHE 49 -22.761 4.403 -5.127 341 HD1 PHE 49 HD1 PHE 49 -25.808 6.318 -5.850 342 HD2 PHE 49 HD2 PHE 49 -23.885 3.687 -3.052 343 HE1 PHE 49 HE1 PHE 49 -27.991 5.887 -4.754 344 HE2 PHE 49 HE2 PHE 49 -26.067 3.257 -1.956 345 HZ PHE 49 HZ PHE 49 -28.120 4.357 -2.809 346 H ASP 50 H ASP 50 -20.481 6.014 -3.283 347 HA ASP 50 HA ASP 50 -18.798 6.856 -5.565 348 HB2 ASP 50 HB2 ASP 50 -17.048 7.336 -3.903 349 HB3 ASP 50 HB3 ASP 50 -18.512 8.251 -3.569 350 H ASP 51 H ASP 51 -19.133 4.706 -6.452 351 HA ASP 51 HA ASP 51 -16.985 2.930 -5.803 352 HB2 ASP 51 HB2 ASP 51 -18.374 0.971 -5.231 353 HB3 ASP 51 HB3 ASP 51 -18.516 2.247 -4.030 354 H GLU 52 H GLU 52 -17.160 0.871 -7.176 355 HA GLU 52 HA GLU 52 -18.832 1.075 -9.545 356 HB2 GLU 52 HB2 GLU 52 -15.802 1.197 -9.704 357 HB3 GLU 52 HB3 GLU 52 -16.865 0.913 -11.078 358 HG2 GLU 52 HG2 GLU 52 -16.569 3.202 -11.255 359 HG3 GLU 52 HG3 GLU 52 -18.015 3.162 -10.259 360 H VAL 53 H VAL 53 -19.691 -0.934 -9.255 361 HA VAL 53 HA VAL 53 -17.834 -3.146 -8.696 362 HB VAL 53 HB VAL 53 -20.869 -3.128 -8.474 363 HG11 VAL 53 HG11 VAL 53 -18.727 -5.142 -7.749 364 HG12 VAL 53 HG12 VAL 53 -20.125 -5.381 -8.796 365 HG13 VAL 53 HG13 VAL 53 -20.347 -5.200 -7.057 366 HG21 VAL 53 HG21 VAL 53 -18.719 -2.898 -6.337 367 HG22 VAL 53 HG22 VAL 53 -20.444 -3.088 -6.021 368 HG23 VAL 53 HG23 VAL 53 -19.848 -1.628 -6.810 369 H LEU 54 H LEU 54 -17.340 -2.544 -11.098 370 HA LEU 54 HA LEU 54 -17.299 -3.199 -13.281 371 HB2 LEU 54 HB2 LEU 54 -18.746 -5.574 -12.088 372 HB3 LEU 54 HB3 LEU 54 -18.264 -5.498 -13.782 373 HG LEU 54 HG LEU 54 -16.308 -5.082 -11.504 374 HD11 LEU 54 HD11 LEU 54 -17.227 -7.330 -11.295 375 HD12 LEU 54 HD12 LEU 54 -15.601 -7.437 -11.969 376 HD13 LEU 54 HD13 LEU 54 -17.006 -7.615 -13.022 377 HD21 LEU 54 HD21 LEU 54 -15.483 -4.211 -13.595 378 HD22 LEU 54 HD22 LEU 54 -16.055 -5.627 -14.478 379 HD23 LEU 54 HD23 LEU 54 -14.699 -5.773 -13.361 380 H GLU 55 H GLU 55 -18.735 -1.257 -13.386 381 HA GLU 55 HA GLU 55 -21.461 -1.927 -14.309 382 HB2 GLU 55 HB2 GLU 55 -21.986 0.462 -13.925 383 HB3 GLU 55 HB3 GLU 55 -21.411 -0.327 -12.459 384 HG2 GLU 55 HG2 GLU 55 -19.145 0.591 -12.857 385 HG3 GLU 55 HG3 GLU 55 -19.728 1.389 -14.313 386 H LEU 56 H LEU 56 -19.312 -2.468 -16.027 387 HA LEU 56 HA LEU 56 -18.751 -0.382 -17.869 388 HB2 LEU 56 HB2 LEU 56 -18.686 -3.394 -18.153 389 HB3 LEU 56 HB3 LEU 56 -18.124 -2.287 -19.403 390 HG LEU 56 HG LEU 56 -17.074 -2.225 -16.560 391 HD11 LEU 56 HD11 LEU 56 -16.022 -3.676 -19.006 392 HD12 LEU 56 HD12 LEU 56 -16.522 -4.399 -17.478 393 HD13 LEU 56 HD13 LEU 56 -15.074 -3.397 -17.547 394 HD21 LEU 56 HD21 LEU 56 -16.658 -0.164 -17.748 395 HD22 LEU 56 HD22 LEU 56 -16.169 -1.034 -19.201 396 HD23 LEU 56 HD23 LEU 56 -15.149 -1.075 -17.763 397 H THR 57 H THR 57 -19.801 0.329 -19.645 398 HA THR 57 HA THR 57 -22.394 -0.939 -20.314 399 HB THR 57 HB THR 57 -23.136 1.321 -21.022 400 HG1 THR 57 HG1 THR 57 -21.488 2.582 -21.380 401 HG21 THR 57 HG21 THR 57 -23.484 2.183 -18.786 402 HG22 THR 57 HG22 THR 57 -22.099 1.277 -18.177 403 HG23 THR 57 HG23 THR 57 -23.546 0.422 -18.714 404 H ASP 58 H ASP 58 -19.476 -1.105 -21.480 405 HA ASP 58 HA ASP 58 -19.639 -0.053 -24.118 406 HB2 ASP 58 HB2 ASP 58 -17.897 -2.235 -22.949 407 HB3 ASP 58 HB3 ASP 58 -17.691 -1.555 -24.559 408 HA PRO 59 HA PRO 59 -22.365 -3.234 -25.716 409 HB2 PRO 59 HB2 PRO 59 -21.986 -2.939 -28.405 410 HB3 PRO 59 HB3 PRO 59 -22.941 -1.804 -27.429 411 HG2 PRO 59 HG2 PRO 59 -20.120 -1.575 -28.371 412 HG3 PRO 59 HG3 PRO 59 -21.402 -0.351 -28.339 413 HD2 PRO 59 HD2 PRO 59 -19.451 -0.450 -26.448 414 HD3 PRO 59 HD3 PRO 59 -21.098 0.109 -26.083 415 H ILE 60 H ILE 60 -18.967 -3.147 -26.525 416 HA ILE 60 HA ILE 60 -18.976 -6.072 -26.799 417 HB ILE 60 HB ILE 60 -19.046 -5.145 -29.088 418 HG12 ILE 60 HG12 ILE 60 -16.852 -6.200 -29.895 419 HG13 ILE 60 HG13 ILE 60 -16.474 -6.469 -28.193 420 HG21 ILE 60 HG21 ILE 60 -17.886 -2.984 -28.486 421 HG22 ILE 60 HG22 ILE 60 -17.285 -3.751 -29.956 422 HG23 ILE 60 HG23 ILE 60 -16.368 -3.880 -28.456 423 HD11 ILE 60 HD11 ILE 60 -17.581 -8.433 -29.322 424 HD12 ILE 60 HD12 ILE 60 -19.022 -7.437 -29.515 425 HD13 ILE 60 HD13 ILE 60 -18.440 -7.843 -27.900 426 H ALA 61 H ALA 61 -17.186 -7.094 -26.021 427 HA ALA 61 HA ALA 61 -14.999 -5.432 -24.933 428 HB1 ALA 61 HB1 ALA 61 -16.678 -6.175 -23.168 429 HB2 ALA 61 HB2 ALA 61 -15.005 -6.649 -22.876 430 HB3 ALA 61 HB3 ALA 61 -16.160 -7.828 -23.497 431 HA PRO 62 HA PRO 62 -13.449 -8.853 -27.782 432 HB2 PRO 62 HB2 PRO 62 -11.312 -6.801 -28.146 433 HB3 PRO 62 HB3 PRO 62 -12.149 -7.789 -29.360 434 HG2 PRO 62 HG2 PRO 62 -12.726 -5.231 -29.117 435 HG3 PRO 62 HG3 PRO 62 -14.017 -6.420 -29.377 436 HD2 PRO 62 HD2 PRO 62 -13.204 -5.059 -26.819 437 HD3 PRO 62 HD3 PRO 62 -14.835 -5.396 -27.442 438 H GLU 63 H GLU 63 -11.919 -10.368 -27.306 439 HA GLU 63 HA GLU 63 -9.878 -9.747 -25.270 440 HB2 GLU 63 HB2 GLU 63 -10.334 -11.899 -24.145 441 HB3 GLU 63 HB3 GLU 63 -11.737 -10.835 -24.093 442 HG2 GLU 63 HG2 GLU 63 -12.738 -12.040 -25.997 443 HG3 GLU 63 HG3 GLU 63 -11.326 -13.090 -26.081 444 HA PRO 64 HA PRO 64 -7.187 -11.921 -28.057 445 HB2 PRO 64 HB2 PRO 64 -5.362 -13.106 -26.415 446 HB3 PRO 64 HB3 PRO 64 -5.405 -11.354 -26.709 447 HG2 PRO 64 HG2 PRO 64 -6.472 -12.912 -24.399 448 HG3 PRO 64 HG3 PRO 64 -5.583 -11.378 -24.411 449 HD2 PRO 64 HD2 PRO 64 -8.286 -11.485 -24.127 450 HD3 PRO 64 HD3 PRO 64 -7.467 -10.130 -24.933 451 H GLU 65 H GLU 65 -7.001 -13.851 -29.092 452 HA GLU 65 HA GLU 65 -8.775 -15.960 -28.496 453 HB2 GLU 65 HB2 GLU 65 -6.381 -15.814 -30.334 454 HB3 GLU 65 HB3 GLU 65 -7.450 -17.215 -30.250 455 HG2 GLU 65 HG2 GLU 65 -9.357 -15.882 -30.908 456 HG3 GLU 65 HG3 GLU 65 -8.423 -14.397 -30.792 457 H LEU 66 H LEU 66 -5.296 -15.587 -27.931 458 HA LEU 66 HA LEU 66 -5.143 -18.204 -26.636 459 HB2 LEU 66 HB2 LEU 66 -3.063 -16.107 -27.290 460 HB3 LEU 66 HB3 LEU 66 -2.702 -17.535 -26.328 461 HG LEU 66 HG LEU 66 -3.580 -18.937 -28.253 462 HD11 LEU 66 HD11 LEU 66 -4.900 -17.458 -29.544 463 HD12 LEU 66 HD12 LEU 66 -3.442 -17.667 -30.511 464 HD13 LEU 66 HD13 LEU 66 -3.658 -16.208 -29.544 465 HD21 LEU 66 HD21 LEU 66 -1.206 -18.753 -27.945 466 HD22 LEU 66 HD22 LEU 66 -1.185 -17.122 -28.621 467 HD23 LEU 66 HD23 LEU 66 -1.509 -18.506 -29.665 468 HA PRO 67 HA PRO 67 -5.679 -16.791 -22.459 469 HB2 PRO 67 HB2 PRO 67 -3.133 -18.182 -21.738 470 HB3 PRO 67 HB3 PRO 67 -4.748 -18.350 -21.024 471 HG2 PRO 67 HG2 PRO 67 -3.802 -20.233 -22.600 472 HG3 PRO 67 HG3 PRO 67 -5.498 -19.731 -22.727 473 HD2 PRO 67 HD2 PRO 67 -3.186 -19.020 -24.515 474 HD3 PRO 67 HD3 PRO 67 -4.864 -19.427 -24.953 475 HA PRO 68 HA PRO 68 -2.895 -13.243 -22.326 476 HB2 PRO 68 HB2 PRO 68 -3.675 -12.050 -20.018 477 HB3 PRO 68 HB3 PRO 68 -4.670 -12.027 -21.486 478 HG2 PRO 68 HG2 PRO 68 -4.911 -13.741 -19.063 479 HG3 PRO 68 HG3 PRO 68 -6.178 -12.957 -20.022 480 HD2 PRO 68 HD2 PRO 68 -5.531 -15.615 -20.270 481 HD3 PRO 68 HD3 PRO 68 -6.228 -14.649 -21.590 482 H LEU 69 H LEU 69 -0.790 -13.426 -21.899 483 HA LEU 69 HA LEU 69 0.328 -15.029 -19.849 484 HB2 LEU 69 HB2 LEU 69 1.514 -12.878 -21.612 485 HB3 LEU 69 HB3 LEU 69 2.469 -13.848 -20.493 486 HG LEU 69 HG LEU 69 0.687 -15.071 -22.617 487 HD11 LEU 69 HD11 LEU 69 2.308 -13.840 -23.853 488 HD12 LEU 69 HD12 LEU 69 2.943 -15.484 -23.781 489 HD13 LEU 69 HD13 LEU 69 3.594 -14.238 -22.715 490 HD21 LEU 69 HD21 LEU 69 2.904 -16.106 -20.820 491 HD22 LEU 69 HD22 LEU 69 2.306 -17.007 -22.213 492 HD23 LEU 69 HD23 LEU 69 1.224 -16.641 -20.870 493 H GLU 70 H GLU 70 -0.343 -11.582 -20.122 494 HA GLU 70 HA GLU 70 1.020 -10.492 -18.000 495 HB2 GLU 70 HB2 GLU 70 -0.343 -9.191 -19.588 496 HB3 GLU 70 HB3 GLU 70 -1.812 -9.866 -18.890 497 HG2 GLU 70 HG2 GLU 70 -1.388 -7.610 -18.005 498 HG3 GLU 70 HG3 GLU 70 -1.274 -8.803 -16.721 499 H THR 71 H THR 71 0.413 -9.985 -15.824 500 HA THR 71 HA THR 71 -1.041 -12.181 -14.517 501 HB THR 71 HB THR 71 0.716 -10.006 -13.328 502 HG1 THR 71 HG1 THR 71 1.965 -11.371 -14.528 503 HG21 THR 71 HG21 THR 71 -0.422 -12.557 -12.138 504 HG22 THR 71 HG22 THR 71 -0.906 -10.914 -11.714 505 HG23 THR 71 HG23 THR 71 0.720 -11.481 -11.332 506 H VAL 72 H VAL 72 -3.032 -11.881 -13.738 507 HA VAL 72 HA VAL 72 -4.630 -9.691 -14.245 508 HB VAL 72 HB VAL 72 -6.167 -10.567 -12.503 509 HG11 VAL 72 HG11 VAL 72 -6.345 -12.885 -13.481 510 HG12 VAL 72 HG12 VAL 72 -4.823 -12.582 -14.321 511 HG13 VAL 72 HG13 VAL 72 -6.240 -11.598 -14.682 512 HG21 VAL 72 HG21 VAL 72 -5.471 -12.649 -11.290 513 HG22 VAL 72 HG22 VAL 72 -4.551 -11.230 -10.794 514 HG23 VAL 72 HG23 VAL 72 -3.829 -12.409 -11.888 515 H GLY 73 H GLY 73 -5.279 -7.869 -13.157 516 HA2 GLY 73 HA2 GLY 73 -3.375 -6.567 -11.517 517 HA3 GLY 73 HA3 GLY 73 -5.010 -5.998 -11.848 518 H ASP 74 H ASP 74 -3.311 -6.172 -9.349 519 HA ASP 74 HA ASP 74 -5.437 -6.945 -7.563 520 HB2 ASP 74 HB2 ASP 74 -4.133 -9.096 -8.202 521 HB3 ASP 74 HB3 ASP 74 -2.852 -8.432 -7.183 522 H ILE 75 H ILE 75 -4.836 -6.552 -5.283 523 HA ILE 75 HA ILE 75 -2.837 -4.385 -5.094 524 HB ILE 75 HB ILE 75 -5.248 -4.850 -3.322 525 HG12 ILE 75 HG12 ILE 75 -5.981 -4.180 -5.572 526 HG13 ILE 75 HG13 ILE 75 -6.214 -2.849 -4.449 527 HG21 ILE 75 HG21 ILE 75 -3.459 -3.692 -2.146 528 HG22 ILE 75 HG22 ILE 75 -4.744 -2.544 -2.517 529 HG23 ILE 75 HG23 ILE 75 -3.269 -2.559 -3.482 530 HD11 ILE 75 HD11 ILE 75 -5.132 -1.580 -6.016 531 HD12 ILE 75 HD12 ILE 75 -4.503 -3.004 -6.839 532 HD13 ILE 75 HD13 ILE 75 -3.658 -2.359 -5.436 533 H ASP 76 H ASP 76 -3.947 -7.409 -3.651 534 HA ASP 76 HA ASP 76 -1.389 -7.650 -2.269 535 HB2 ASP 76 HB2 ASP 76 -2.843 -6.538 -0.613 536 HB3 ASP 76 HB3 ASP 76 -4.014 -7.844 -0.770 537 H VAL 77 H VAL 77 -1.019 -9.318 -3.760 538 HA VAL 77 HA VAL 77 -2.272 -11.862 -3.011 539 HB VAL 77 HB VAL 77 -3.589 -11.022 -4.920 540 HG11 VAL 77 HG11 VAL 77 -1.713 -9.695 -5.946 541 HG12 VAL 77 HG12 VAL 77 -2.601 -10.692 -7.099 542 HG13 VAL 77 HG13 VAL 77 -1.022 -11.214 -6.514 543 HG21 VAL 77 HG21 VAL 77 -3.261 -13.016 -6.413 544 HG22 VAL 77 HG22 VAL 77 -3.371 -13.426 -4.701 545 HG23 VAL 77 HG23 VAL 77 -1.802 -13.399 -5.502 546 H TYR 78 H TYR 78 -0.958 -13.577 -3.078 547 HA TYR 78 HA TYR 78 1.782 -13.208 -4.153 548 HB2 TYR 78 HB2 TYR 78 0.911 -14.712 -1.670 549 HB3 TYR 78 HB3 TYR 78 2.543 -14.734 -2.335 550 HD1 TYR 78 HD1 TYR 78 0.024 -12.741 -0.559 551 HD2 TYR 78 HD2 TYR 78 3.951 -12.713 -2.302 552 HE1 TYR 78 HE1 TYR 78 0.540 -10.627 0.633 553 HE2 TYR 78 HE2 TYR 78 4.466 -10.600 -1.109 554 HH TYR 78 HH TYR 78 2.539 -9.399 1.413 555 H SER 79 H SER 79 2.535 -14.753 -5.493 556 HA SER 79 HA SER 79 1.015 -17.278 -5.734 557 HB2 SER 79 HB2 SER 79 1.956 -15.516 -8.006 558 HB3 SER 79 HB3 SER 79 1.280 -17.129 -8.198 559 HG SER 79 HG SER 79 -0.653 -16.410 -7.462 560 HA PRO 80 HA PRO 80 5.056 -19.160 -5.712 561 HB2 PRO 80 HB2 PRO 80 4.635 -21.495 -7.018 562 HB3 PRO 80 HB3 PRO 80 3.947 -21.174 -5.413 563 HG2 PRO 80 HG2 PRO 80 2.651 -20.981 -8.095 564 HG3 PRO 80 HG3 PRO 80 2.026 -21.684 -6.593 565 HD2 PRO 80 HD2 PRO 80 1.331 -19.185 -7.442 566 HD3 PRO 80 HD3 PRO 80 1.414 -19.626 -5.722 567 HA PRO 81 HA PRO 81 7.173 -18.235 -9.531 568 HB2 PRO 81 HB2 PRO 81 9.173 -20.091 -9.674 569 HB3 PRO 81 HB3 PRO 81 9.192 -18.733 -8.531 570 HG2 PRO 81 HG2 PRO 81 8.416 -21.578 -8.074 571 HG3 PRO 81 HG3 PRO 81 9.397 -20.502 -7.063 572 HD2 PRO 81 HD2 PRO 81 6.786 -20.993 -6.513 573 HD3 PRO 81 HD3 PRO 81 7.540 -19.418 -6.173 574 H GLU 82 H GLU 82 7.467 -18.877 -11.732 575 HA GLU 82 HA GLU 82 6.343 -21.492 -12.496 576 HB2 GLU 82 HB2 GLU 82 4.571 -19.715 -12.639 577 HB3 GLU 82 HB3 GLU 82 5.571 -18.886 -13.831 578 HG2 GLU 82 HG2 GLU 82 5.515 -20.888 -15.277 579 HG3 GLU 82 HG3 GLU 82 4.512 -21.716 -14.087 580 HA PRO 83 HA PRO 83 10.299 -20.606 -14.786 581 HB2 PRO 83 HB2 PRO 83 11.280 -23.144 -14.747 582 HB3 PRO 83 HB3 PRO 83 11.487 -22.017 -13.390 583 HG2 PRO 83 HG2 PRO 83 9.505 -24.223 -13.728 584 HG3 PRO 83 HG3 PRO 83 10.461 -23.776 -12.304 585 HD2 PRO 83 HD2 PRO 83 7.851 -23.059 -12.579 586 HD3 PRO 83 HD3 PRO 83 9.029 -22.050 -11.710 587 H GLU 84 H GLU 84 10.786 -21.007 -16.955 588 HA GLU 84 HA GLU 84 8.647 -22.137 -18.555 589 HB2 GLU 84 HB2 GLU 84 11.319 -20.939 -19.336 590 HB3 GLU 84 HB3 GLU 84 10.060 -21.422 -20.473 591 HG2 GLU 84 HG2 GLU 84 9.722 -19.352 -18.278 592 HG3 GLU 84 HG3 GLU 84 9.988 -18.985 -19.980 593 H SER 85 H SER 85 12.019 -22.877 -17.802 594 HA SER 85 HA SER 85 11.696 -25.678 -18.046 595 HB2 SER 85 HB2 SER 85 13.010 -26.113 -20.042 596 HB3 SER 85 HB3 SER 85 11.649 -25.081 -20.476 597 HG SER 85 HG SER 85 12.995 -23.521 -20.926 598 H GLU 86 H GLU 86 13.762 -26.820 -17.629 599 HA GLU 86 HA GLU 86 15.926 -25.052 -16.686 600 HB2 GLU 86 HB2 GLU 86 14.418 -25.740 -14.783 601 HB3 GLU 86 HB3 GLU 86 14.888 -27.412 -15.098 602 HG2 GLU 86 HG2 GLU 86 17.252 -26.827 -14.737 603 HG3 GLU 86 HG3 GLU 86 16.798 -25.150 -14.444 604 HA PRO 87 HA PRO 87 17.461 -28.805 -19.091 605 HB2 PRO 87 HB2 PRO 87 18.506 -27.602 -21.265 606 HB3 PRO 87 HB3 PRO 87 16.774 -27.982 -21.150 607 HG2 PRO 87 HG2 PRO 87 18.173 -25.390 -20.700 608 HG3 PRO 87 HG3 PRO 87 16.667 -25.716 -21.575 609 HD2 PRO 87 HD2 PRO 87 16.736 -24.773 -18.993 610 HD3 PRO 87 HD3 PRO 87 15.398 -25.744 -19.644 611 H ALA 88 H ALA 88 19.645 -29.470 -19.353 612 HA ALA 88 HA ALA 88 21.504 -28.371 -17.541 613 HB1 ALA 88 HB1 ALA 88 23.116 -29.946 -18.605 614 HB2 ALA 88 HB2 ALA 88 21.904 -30.298 -19.837 615 HB3 ALA 88 HB3 ALA 88 21.594 -30.713 -18.150 616 H TYR 89 H TYR 89 21.144 -28.024 -21.037 617 HA TYR 89 HA TYR 89 23.579 -26.753 -21.609 618 HB2 TYR 89 HB2 TYR 89 20.880 -26.559 -22.952 619 HB3 TYR 89 HB3 TYR 89 22.357 -25.859 -23.616 620 HD1 TYR 89 HD1 TYR 89 20.551 -28.970 -22.868 621 HD2 TYR 89 HD2 TYR 89 24.207 -27.290 -24.371 622 HE1 TYR 89 HE1 TYR 89 21.184 -31.181 -23.798 623 HE2 TYR 89 HE2 TYR 89 24.840 -29.500 -25.304 624 HH TYR 89 HH TYR 89 24.362 -31.791 -25.091 625 H THR 90 H THR 90 20.484 -25.411 -20.524 626 HA THR 90 HA THR 90 21.323 -22.671 -20.784 627 HB THR 90 HB THR 90 18.990 -23.954 -19.323 628 HG1 THR 90 HG1 THR 90 19.100 -22.512 -21.757 629 HG21 THR 90 HG21 THR 90 19.358 -21.039 -20.069 630 HG22 THR 90 HG22 THR 90 19.593 -21.675 -18.442 631 HG23 THR 90 HG23 THR 90 18.000 -21.746 -19.193 632 HA PRO 91 HA PRO 91 23.738 -22.296 -17.041 633 HB2 PRO 91 HB2 PRO 91 22.353 -19.695 -16.566 634 HB3 PRO 91 HB3 PRO 91 24.089 -20.051 -16.651 635 HG2 PRO 91 HG2 PRO 91 22.893 -18.823 -18.649 636 HG3 PRO 91 HG3 PRO 91 24.100 -20.085 -18.967 637 HD2 PRO 91 HD2 PRO 91 21.107 -20.262 -19.116 638 HD3 PRO 91 HD3 PRO 91 22.326 -20.947 -20.213 639 HA PRO 92 HA PRO 92 21.367 -23.793 -13.582 640 HB2 PRO 92 HB2 PRO 92 22.837 -21.809 -11.889 641 HB3 PRO 92 HB3 PRO 92 22.597 -23.548 -11.634 642 HG2 PRO 92 HG2 PRO 92 24.921 -22.613 -12.490 643 HG3 PRO 92 HG3 PRO 92 24.257 -24.130 -13.120 644 HD2 PRO 92 HD2 PRO 92 24.414 -21.456 -14.439 645 HD3 PRO 92 HD3 PRO 92 24.499 -23.077 -15.161 646 HA PRO 93 HA PRO 93 17.844 -21.234 -12.678 647 HB2 PRO 93 HB2 PRO 93 18.504 -21.337 -9.752 648 HB3 PRO 93 HB3 PRO 93 16.956 -21.639 -10.568 649 HG2 PRO 93 HG2 PRO 93 18.388 -23.662 -9.705 650 HG3 PRO 93 HG3 PRO 93 17.608 -23.745 -11.297 651 HD2 PRO 93 HD2 PRO 93 20.500 -23.286 -10.639 652 HD3 PRO 93 HD3 PRO 93 19.779 -24.200 -11.984 653 H ALA 94 H ALA 94 17.502 -19.109 -12.792 654 HA ALA 94 HA ALA 94 19.581 -17.220 -12.467 655 HB1 ALA 94 HB1 ALA 94 17.542 -15.589 -12.729 656 HB2 ALA 94 HB2 ALA 94 16.660 -17.068 -13.109 657 HB3 ALA 94 HB3 ALA 94 18.047 -16.592 -14.089 658 H ALA 95 H ALA 95 17.033 -18.320 -10.332 659 HA ALA 95 HA ALA 95 16.444 -17.720 -8.202 660 HB1 ALA 95 HB1 ALA 95 18.815 -16.837 -7.069 661 HB2 ALA 95 HB2 ALA 95 19.363 -17.791 -8.454 662 HB3 ALA 95 HB3 ALA 95 18.318 -18.521 -7.230 663 HA PRO 96 HA PRO 96 16.642 -13.050 -9.215 664 HB2 PRO 96 HB2 PRO 96 14.074 -12.640 -10.022 665 HB3 PRO 96 HB3 PRO 96 15.375 -13.096 -11.143 666 HG2 PRO 96 HG2 PRO 96 13.275 -14.803 -9.889 667 HG3 PRO 96 HG3 PRO 96 13.879 -14.799 -11.556 668 HD2 PRO 96 HD2 PRO 96 14.697 -16.631 -9.708 669 HD3 PRO 96 HD3 PRO 96 15.746 -16.066 -11.029 670 H VAL 97 H VAL 97 14.352 -15.133 -7.592 671 HA VAL 97 HA VAL 97 14.201 -13.272 -5.348 672 HB VAL 97 HB VAL 97 12.294 -12.636 -6.774 673 HG11 VAL 97 HG11 VAL 97 12.012 -14.886 -7.848 674 HG12 VAL 97 HG12 VAL 97 10.498 -14.187 -7.270 675 HG13 VAL 97 HG13 VAL 97 11.292 -15.463 -6.348 676 HG21 VAL 97 HG21 VAL 97 12.183 -12.705 -4.204 677 HG22 VAL 97 HG22 VAL 97 11.214 -14.165 -4.398 678 HG23 VAL 97 HG23 VAL 97 10.646 -12.633 -5.064 679 H PHE 98 H PHE 98 14.109 -14.283 -3.419 680 HA PHE 98 HA PHE 98 13.148 -17.001 -3.151 681 HB2 PHE 98 HB2 PHE 98 15.518 -17.239 -3.981 682 HB3 PHE 98 HB3 PHE 98 16.051 -16.423 -2.509 683 HD1 PHE 98 HD1 PHE 98 14.323 -19.429 -3.834 684 HD2 PHE 98 HD2 PHE 98 16.073 -17.555 -0.388 685 HE1 PHE 98 HE1 PHE 98 14.202 -21.579 -2.603 686 HE2 PHE 98 HE2 PHE 98 15.948 -19.702 0.843 687 HZ PHE 98 HZ PHE 98 15.014 -21.714 -0.263 688 H ASP 99 H ASP 99 11.691 -15.823 -1.783 689 HA ASP 99 HA ASP 99 10.900 -15.070 0.235 690 HB2 ASP 99 HB2 ASP 99 13.453 -16.298 1.311 691 HB3 ASP 99 HB3 ASP 99 12.029 -15.864 2.257 692 H ARG 100 H ARG 100 11.406 -13.564 2.099 693 HA ARG 100 HA ARG 100 12.051 -11.446 2.738 694 HB2 ARG 100 HB2 ARG 100 14.737 -12.455 1.741 695 HB3 ARG 100 HB3 ARG 100 14.496 -11.060 2.789 696 HG2 ARG 100 HG2 ARG 100 13.549 -13.844 3.520 697 HG3 ARG 100 HG3 ARG 100 15.133 -13.223 3.977 698 HD2 ARG 100 HD2 ARG 100 14.032 -11.326 5.142 699 HD3 ARG 100 HD3 ARG 100 12.458 -11.995 4.718 700 HE ARG 100 HE ARG 100 12.749 -13.636 6.354 701 HH11 ARG 100 HH11 ARG 100 15.751 -11.887 5.883 702 HH12 ARG 100 HH12 ARG 100 16.507 -12.582 7.277 703 HH21 ARG 100 HH21 ARG 100 13.771 -14.516 8.152 704 HH22 ARG 100 HH22 ARG 100 15.393 -14.060 8.551 705 H ASP 101 H ASP 101 10.749 -11.400 0.384 706 HA ASP 101 HA ASP 101 12.126 -9.265 -1.106 707 HB2 ASP 101 HB2 ASP 101 12.337 -11.463 -2.332 708 HB3 ASP 101 HB3 ASP 101 10.582 -11.509 -2.428 709 H GLU 102 H GLU 102 10.845 -7.584 -0.504 710 HA GLU 102 HA GLU 102 8.039 -7.822 -0.043 711 HB2 GLU 102 HB2 GLU 102 8.084 -5.370 0.175 712 HB3 GLU 102 HB3 GLU 102 9.386 -6.118 1.096 713 HG2 GLU 102 HG2 GLU 102 10.941 -5.658 -0.813 714 HG3 GLU 102 HG3 GLU 102 9.635 -4.813 -1.634 715 H VAL 103 H VAL 103 6.372 -7.627 -1.380 716 HA VAL 103 HA VAL 103 6.849 -7.356 -4.225 717 HB VAL 103 HB VAL 103 4.418 -7.813 -4.436 718 HG11 VAL 103 HG11 VAL 103 5.837 -9.679 -2.517 719 HG12 VAL 103 HG12 VAL 103 6.084 -9.652 -4.262 720 HG13 VAL 103 HG13 VAL 103 4.513 -10.104 -3.603 721 HG21 VAL 103 HG21 VAL 103 3.811 -6.669 -2.247 722 HG22 VAL 103 HG22 VAL 103 4.433 -8.095 -1.416 723 HG23 VAL 103 HG23 VAL 103 3.048 -8.239 -2.500 724 H ALA 104 H ALA 104 5.158 -6.012 -5.474 725 HA ALA 104 HA ALA 104 4.539 -3.455 -4.184 726 HB1 ALA 104 HB1 ALA 104 5.910 -3.372 -6.846 727 HB2 ALA 104 HB2 ALA 104 6.881 -3.501 -5.381 728 HB3 ALA 104 HB3 ALA 104 5.802 -2.125 -5.603 729 H GLU 105 H GLU 105 2.946 -2.240 -5.281 730 HA GLU 105 HA GLU 105 0.818 -3.602 -6.350 731 HB2 GLU 105 HB2 GLU 105 0.753 -1.267 -5.511 732 HB3 GLU 105 HB3 GLU 105 1.584 -0.737 -6.972 733 HG2 GLU 105 HG2 GLU 105 -0.834 -0.380 -7.204 734 HG3 GLU 105 HG3 GLU 105 -0.293 -1.608 -8.342 735 H GLN 106 H GLN 106 0.394 -4.582 -8.182 736 HA GLN 106 HA GLN 106 2.227 -4.670 -10.368 737 HB2 GLN 106 HB2 GLN 106 -0.606 -5.685 -10.052 738 HB3 GLN 106 HB3 GLN 106 0.389 -5.990 -11.473 739 HG2 GLN 106 HG2 GLN 106 1.149 -6.753 -8.636 740 HG3 GLN 106 HG3 GLN 106 0.479 -7.863 -9.829 741 HE21 GLN 106 HE21 GLN 106 3.337 -7.294 -8.459 742 HE22 GLN 106 HE22 GLN 106 4.387 -7.511 -9.775 743 H LEU 107 H LEU 107 -0.857 -3.059 -9.786 744 HA LEU 107 HA LEU 107 -1.399 -2.107 -12.362 745 HB2 LEU 107 HB2 LEU 107 -2.008 -0.800 -9.680 746 HB3 LEU 107 HB3 LEU 107 -2.601 -0.218 -11.234 747 HG LEU 107 HG LEU 107 -3.036 -3.079 -10.350 748 HD11 LEU 107 HD11 LEU 107 -4.578 -0.587 -9.636 749 HD12 LEU 107 HD12 LEU 107 -4.151 -1.959 -8.619 750 HD13 LEU 107 HD13 LEU 107 -5.427 -2.122 -9.820 751 HD21 LEU 107 HD21 LEU 107 -5.009 -2.774 -11.941 752 HD22 LEU 107 HD22 LEU 107 -3.418 -2.729 -12.701 753 HD23 LEU 107 HD23 LEU 107 -4.294 -1.229 -12.399 754 H VAL 108 H VAL 108 -0.475 -0.659 -13.651 755 HA VAL 108 HA VAL 108 1.251 0.686 -14.421 756 HB VAL 108 HB VAL 108 -0.373 2.189 -12.378 757 HG11 VAL 108 HG11 VAL 108 1.973 3.230 -13.932 758 HG12 VAL 108 HG12 VAL 108 1.481 3.560 -12.271 759 HG13 VAL 108 HG13 VAL 108 0.598 4.292 -13.604 760 HG21 VAL 108 HG21 VAL 108 -1.297 3.237 -14.432 761 HG22 VAL 108 HG22 VAL 108 -1.474 1.482 -14.442 762 HG23 VAL 108 HG23 VAL 108 -0.208 2.246 -15.404 763 H GLY 109 H GLY 109 3.138 -0.443 -13.806 764 HA2 GLY 109 HA2 GLY 109 5.085 0.936 -12.423 765 HA3 GLY 109 HA3 GLY 109 4.367 -0.146 -11.235 766 H VAL 110 H VAL 110 6.832 -0.721 -11.481 767 HA VAL 110 HA VAL 110 8.424 -2.267 -12.071 768 HB VAL 110 HB VAL 110 6.003 -3.930 -12.850 769 HG11 VAL 110 HG11 VAL 110 8.040 -4.954 -13.658 770 HG12 VAL 110 HG12 VAL 110 7.553 -5.821 -12.202 771 HG13 VAL 110 HG13 VAL 110 8.862 -4.641 -12.130 772 HG21 VAL 110 HG21 VAL 110 6.220 -4.838 -10.527 773 HG22 VAL 110 HG22 VAL 110 5.778 -3.130 -10.549 774 HG23 VAL 110 HG23 VAL 110 7.438 -3.607 -10.192 775 H SER 111 H SER 111 9.259 -0.966 -13.765 776 HA SER 111 HA SER 111 8.308 -0.977 -16.427 777 HB2 SER 111 HB2 SER 111 9.819 0.758 -15.630 778 HB3 SER 111 HB3 SER 111 11.078 -0.436 -15.329 779 HG SER 111 HG SER 111 10.097 0.594 -17.736 780 H ALA 112 H ALA 112 8.815 -2.208 -18.187 781 HA ALA 112 HA ALA 112 10.852 -4.272 -18.051 782 HB1 ALA 112 HB1 ALA 112 9.524 -6.133 -17.998 783 HB2 ALA 112 HB2 ALA 112 8.179 -5.329 -18.809 784 HB3 ALA 112 HB3 ALA 112 8.466 -5.053 -17.092 785 H ALA 113 H ALA 113 11.397 -5.113 -20.091 786 HA ALA 113 HA ALA 113 9.926 -4.254 -22.446 787 HB1 ALA 113 HB1 ALA 113 12.722 -3.257 -21.864 788 HB2 ALA 113 HB2 ALA 113 11.271 -2.282 -22.090 789 HB3 ALA 113 HB3 ALA 113 11.955 -3.175 -23.448 790 H SER 114 H SER 114 10.533 -5.351 -24.339 791 HA SER 114 HA SER 114 11.236 -7.139 -25.581 792 HB2 SER 114 HB2 SER 114 13.608 -6.569 -23.858 793 HB3 SER 114 HB3 SER 114 13.594 -8.058 -24.799 794 HG SER 114 HG SER 114 14.115 -5.599 -25.623 795 H ALA 115 H ALA 115 11.030 -9.339 -25.645 796 HA ALA 115 HA ALA 115 11.156 -10.944 -23.232 797 HB1 ALA 115 HB1 ALA 115 8.949 -10.434 -22.798 798 HB2 ALA 115 HB2 ALA 115 8.720 -11.777 -23.919 799 HB3 ALA 115 HB3 ALA 115 8.579 -10.115 -24.492 800 H ALA 116 H ALA 116 11.184 -13.196 -23.699 801 HA ALA 116 HA ALA 116 11.054 -13.976 -26.515 802 HB1 ALA 116 HB1 ALA 116 13.470 -14.689 -24.856 803 HB2 ALA 116 HB2 ALA 116 13.430 -13.283 -25.922 804 HB3 ALA 116 HB3 ALA 116 13.238 -14.902 -26.591 805 H ALA 117 H ALA 117 9.756 -14.541 -23.718 806 HA ALA 117 HA ALA 117 9.977 -17.483 -23.826 807 HB1 ALA 117 HB1 ALA 117 8.798 -16.118 -21.456 808 HB2 ALA 117 HB2 ALA 117 10.542 -16.001 -21.680 809 HB3 ALA 117 HB3 ALA 117 9.776 -17.583 -21.541 810 H SER 118 H SER 118 8.264 -15.811 -25.540 811 HA SER 118 HA SER 118 5.682 -17.030 -24.861 812 HB2 SER 118 HB2 SER 118 6.035 -14.139 -25.701 813 HB3 SER 118 HB3 SER 118 4.500 -14.965 -25.448 814 HG SER 118 HG SER 118 6.455 -14.172 -23.593 815 H ALA 119 H ALA 119 4.695 -17.886 -26.621 816 HA ALA 119 HA ALA 119 6.154 -18.136 -29.027 817 HB1 ALA 119 HB1 ALA 119 3.216 -18.690 -28.520 818 HB2 ALA 119 HB2 ALA 119 4.532 -19.840 -28.285 819 HB3 ALA 119 HB3 ALA 119 4.144 -19.264 -29.906 820 H PHE 120 H PHE 120 3.403 -16.140 -28.079 821 HA PHE 120 HA PHE 120 3.848 -14.453 -30.467 822 HB2 PHE 120 HB2 PHE 120 1.170 -15.256 -29.296 823 HB3 PHE 120 HB3 PHE 120 1.401 -14.064 -30.576 824 HD1 PHE 120 HD1 PHE 120 1.386 -17.624 -29.729 825 HD2 PHE 120 HD2 PHE 120 2.245 -14.751 -32.803 826 HE1 PHE 120 HE1 PHE 120 1.416 -19.441 -31.417 827 HE2 PHE 120 HE2 PHE 120 2.273 -16.566 -34.493 828 HZ PHE 120 HZ PHE 120 1.859 -18.910 -33.800 829 H GLY 121 H GLY 121 3.661 -12.255 -30.158 830 HA2 GLY 121 HA2 GLY 121 3.924 -11.319 -27.426 831 HA3 GLY 121 HA3 GLY 121 4.074 -10.349 -28.888 832 H SER 122 H SER 122 2.712 -9.352 -26.727 833 HA SER 122 HA SER 122 -0.082 -9.331 -27.700 834 HB2 SER 122 HB2 SER 122 0.836 -9.278 -24.816 835 HB3 SER 122 HB3 SER 122 -0.825 -9.053 -25.356 836 HG SER 122 HG SER 122 0.254 -11.300 -24.783 837 H LEU 123 H LEU 123 -1.125 -7.341 -27.650 838 HA LEU 123 HA LEU 123 0.433 -5.012 -26.745 839 HB2 LEU 123 HB2 LEU 123 0.763 -5.399 -29.222 840 HB3 LEU 123 HB3 LEU 123 -0.963 -5.111 -29.430 841 HG LEU 123 HG LEU 123 -0.628 -2.879 -28.266 842 HD11 LEU 123 HD11 LEU 123 2.267 -3.701 -28.618 843 HD12 LEU 123 HD12 LEU 123 1.460 -3.215 -27.127 844 HD13 LEU 123 HD13 LEU 123 1.770 -2.024 -28.390 845 HD21 LEU 123 HD21 LEU 123 -0.775 -3.183 -30.756 846 HD22 LEU 123 HD22 LEU 123 0.984 -3.276 -30.804 847 HD23 LEU 123 HD23 LEU 123 0.196 -1.790 -30.278 848 H SER 124 H SER 124 -1.232 -5.461 -25.002 849 HA SER 124 HA SER 124 -3.519 -3.705 -25.444 850 HB2 SER 124 HB2 SER 124 -3.793 -6.528 -24.372 851 HB3 SER 124 HB3 SER 124 -5.067 -5.312 -24.371 852 HG SER 124 HG SER 124 -4.866 -6.917 -26.211 853 H SER 125 H SER 125 -3.960 -2.509 -23.655 854 HA SER 125 HA SER 125 -2.319 -3.104 -21.275 855 HB2 SER 125 HB2 SER 125 -2.369 -0.712 -20.814 856 HB3 SER 125 HB3 SER 125 -1.768 -0.995 -22.443 857 HG SER 125 HG SER 125 -3.623 -0.255 -23.270 858 H ALA 126 H ALA 126 -5.538 -2.493 -22.458 859 HA ALA 126 HA ALA 126 -6.814 -1.894 -19.985 860 HB1 ALA 126 HB1 ALA 126 -8.808 -2.030 -21.159 861 HB2 ALA 126 HB2 ALA 126 -8.240 -3.363 -22.168 862 HB3 ALA 126 HB3 ALA 126 -7.676 -1.720 -22.474 863 H LEU 127 H LEU 127 -6.403 -4.838 -21.854 864 HA LEU 127 HA LEU 127 -7.130 -7.011 -21.383 865 HB2 LEU 127 HB2 LEU 127 -4.594 -6.419 -20.810 866 HB3 LEU 127 HB3 LEU 127 -5.106 -6.888 -19.188 867 HG LEU 127 HG LEU 127 -5.668 -8.636 -21.594 868 HD11 LEU 127 HD11 LEU 127 -3.214 -8.597 -19.815 869 HD12 LEU 127 HD12 LEU 127 -3.261 -8.370 -21.563 870 HD13 LEU 127 HD13 LEU 127 -3.642 -9.946 -20.868 871 HD21 LEU 127 HD21 LEU 127 -6.951 -9.164 -19.602 872 HD22 LEU 127 HD22 LEU 127 -5.501 -9.099 -18.600 873 HD23 LEU 127 HD23 LEU 127 -5.696 -10.390 -19.786 874 H LEU 128 H LEU 128 -9.164 -7.147 -20.571 875 HA LEU 128 HA LEU 128 -9.403 -7.304 -17.621 876 HB2 LEU 128 HB2 LEU 128 -11.373 -6.261 -19.669 877 HB3 LEU 128 HB3 LEU 128 -11.773 -6.553 -17.974 878 HG LEU 128 HG LEU 128 -9.449 -4.790 -18.778 879 HD11 LEU 128 HD11 LEU 128 -11.305 -3.734 -19.808 880 HD12 LEU 128 HD12 LEU 128 -11.079 -2.890 -18.273 881 HD13 LEU 128 HD13 LEU 128 -12.368 -4.084 -18.442 882 HD21 LEU 128 HD21 LEU 128 -9.428 -5.525 -16.461 883 HD22 LEU 128 HD22 LEU 128 -11.130 -5.107 -16.269 884 HD23 LEU 128 HD23 LEU 128 -9.929 -3.835 -16.492 885 H MET 129 H MET 129 -10.168 -9.181 -16.843 886 HA MET 129 HA MET 129 -11.881 -10.881 -18.481 887 HB2 MET 129 HB2 MET 129 -9.492 -11.526 -18.991 888 HB3 MET 129 HB3 MET 129 -9.329 -12.001 -17.299 889 HG2 MET 129 HG2 MET 129 -11.255 -13.553 -17.577 890 HG3 MET 129 HG3 MET 129 -11.328 -13.123 -19.288 891 HE1 MET 129 HE1 MET 129 -8.261 -12.957 -20.283 892 HE2 MET 129 HE2 MET 129 -9.799 -13.493 -20.952 893 HE3 MET 129 HE3 MET 129 -8.410 -14.578 -20.976 894 HA PRO 130 HA PRO 130 -12.761 -10.852 -13.850 895 HB2 PRO 130 HB2 PRO 130 -15.322 -9.958 -13.930 896 HB3 PRO 130 HB3 PRO 130 -13.931 -8.854 -13.923 897 HG2 PRO 130 HG2 PRO 130 -15.598 -9.778 -16.221 898 HG3 PRO 130 HG3 PRO 130 -15.000 -8.151 -15.845 899 HD2 PRO 130 HD2 PRO 130 -13.788 -9.770 -17.678 900 HD3 PRO 130 HD3 PRO 130 -12.893 -8.575 -16.712 901 H LYS 131 H LYS 131 -13.933 -12.424 -12.716 902 HA LYS 131 HA LYS 131 -15.803 -14.130 -14.202 903 HB2 LYS 131 HB2 LYS 131 -13.539 -15.146 -14.439 904 HB3 LYS 131 HB3 LYS 131 -13.416 -15.222 -12.684 905 HG2 LYS 131 HG2 LYS 131 -15.393 -16.685 -12.593 906 HG3 LYS 131 HG3 LYS 131 -15.554 -16.590 -14.348 907 HD2 LYS 131 HD2 LYS 131 -13.324 -17.612 -14.612 908 HD3 LYS 131 HD3 LYS 131 -13.162 -17.711 -12.858 909 HE2 LYS 131 HE2 LYS 131 -15.142 -19.173 -12.748 910 HE3 LYS 131 HE3 LYS 131 -15.321 -19.068 -14.499 911 HZ1 LYS 131 HZ1 LYS 131 -14.113 -21.077 -13.628 912 HZ2 LYS 131 HZ2 LYS 131 -12.841 -20.037 -13.199 913 HZ3 LYS 131 HZ3 LYS 131 -13.301 -20.196 -14.829 914 H ASP 132 H ASP 132 -17.474 -13.382 -12.921 915 HA ASP 132 HA ASP 132 -18.861 -13.221 -11.094 916 HB2 ASP 132 HB2 ASP 132 -17.251 -15.606 -10.151 917 HB3 ASP 132 HB3 ASP 132 -18.830 -15.116 -9.544 918 H GLY 133 H GLY 133 -18.795 -13.214 -8.535 919 HA2 GLY 133 HA2 GLY 133 -17.005 -11.116 -7.763 920 HA3 GLY 133 HA3 GLY 133 -18.099 -11.993 -6.692 921 H LEU 134 H LEU 134 -17.260 -14.549 -7.001 922 HA LEU 134 HA LEU 134 -14.420 -14.570 -6.172 923 HB2 LEU 134 HB2 LEU 134 -16.731 -15.976 -4.813 924 HB3 LEU 134 HB3 LEU 134 -15.033 -16.277 -4.452 925 HG LEU 134 HG LEU 134 -16.298 -13.526 -4.277 926 HD11 LEU 134 HD11 LEU 134 -17.370 -15.104 -2.686 927 HD12 LEU 134 HD12 LEU 134 -16.398 -13.893 -1.852 928 HD13 LEU 134 HD13 LEU 134 -15.778 -15.530 -2.060 929 HD21 LEU 134 HD21 LEU 134 -13.683 -14.738 -3.323 930 HD22 LEU 134 HD22 LEU 134 -14.277 -13.172 -2.770 931 HD23 LEU 134 HD23 LEU 134 -13.893 -13.417 -4.473 932 H GLU 135 H GLU 135 -13.375 -16.647 -6.344 933 HA GLU 135 HA GLU 135 -13.791 -17.919 -8.822 934 HB2 GLU 135 HB2 GLU 135 -11.624 -17.827 -7.566 935 HB3 GLU 135 HB3 GLU 135 -12.279 -19.014 -6.440 936 HG2 GLU 135 HG2 GLU 135 -12.604 -20.606 -8.299 937 HG3 GLU 135 HG3 GLU 135 -11.955 -19.421 -9.430 938 H HIS 136 H HIS 136 -14.739 -18.807 -5.525 939 HA HIS 136 HA HIS 136 -16.191 -20.375 -4.698 940 HB2 HIS 136 HB2 HIS 136 -17.327 -20.246 -7.507 941 HB3 HIS 136 HB3 HIS 136 -18.115 -21.013 -6.129 942 HD2 HIS 136 HD2 HIS 136 -18.393 -18.962 -3.871 943 HE1 HIS 136 HE1 HIS 136 -19.025 -15.888 -6.697 944 HE2 HIS 136 HE2 HIS 136 -19.249 -16.522 -4.247 945 H HIS 137 H HIS 137 -13.679 -21.281 -5.609 946 HA HIS 137 HA HIS 137 -13.788 -23.590 -7.233 947 HB2 HIS 137 HB2 HIS 137 -11.709 -22.317 -6.520 948 HB3 HIS 137 HB3 HIS 137 -11.854 -23.118 -4.955 949 HD2 HIS 137 HD2 HIS 137 -10.628 -23.916 -8.552 950 HE1 HIS 137 HE1 HIS 137 -10.448 -27.515 -6.350 951 HE2 HIS 137 HE2 HIS 137 -9.799 -26.392 -8.532 952 H HIS 138 H HIS 138 -14.157 -25.714 -6.783 953 HA HIS 138 HA HIS 138 -15.334 -26.318 -4.145 954 HB2 HIS 138 HB2 HIS 138 -15.628 -27.675 -6.834 955 HB3 HIS 138 HB3 HIS 138 -16.320 -28.293 -5.336 956 HD2 HIS 138 HD2 HIS 138 -18.662 -26.993 -4.500 957 HE1 HIS 138 HE1 HIS 138 -18.711 -24.035 -7.513 958 HE2 HIS 138 HE2 HIS 138 -20.022 -25.047 -5.590 959 H HIS 139 H HIS 139 -14.680 -28.084 -2.955 960 HA HIS 139 HA HIS 139 -12.220 -29.464 -3.867 961 HB2 HIS 139 HB2 HIS 139 -12.891 -28.555 -1.055 962 HB3 HIS 139 HB3 HIS 139 -11.479 -29.504 -1.508 963 HD2 HIS 139 HD2 HIS 139 -12.460 -25.827 -1.208 964 HE1 HIS 139 HE1 HIS 139 -9.043 -25.906 -3.685 965 HE2 HIS 139 HE2 HIS 139 -10.589 -24.404 -2.345 966 H HIS 140 H HIS 140 -12.160 -31.632 -3.631 967 HA HIS 140 HA HIS 140 -13.970 -33.039 -1.870 968 HB2 HIS 140 HB2 HIS 140 -15.068 -34.350 -3.650 969 HB3 HIS 140 HB3 HIS 140 -15.463 -32.640 -3.768 970 HD2 HIS 140 HD2 HIS 140 -14.618 -31.396 -6.147 971 HE1 HIS 140 HE1 HIS 140 -12.642 -34.744 -7.792 972 HE2 HIS 140 HE2 HIS 140 -13.430 -32.375 -8.256 973 H HIS 141 H HIS 141 -13.641 -35.417 -1.988 974 HA HIS 141 HA HIS 141 -10.796 -35.988 -2.427 975 HB2 HIS 141 HB2 HIS 141 -12.989 -37.436 -0.928 976 HB3 HIS 141 HB3 HIS 141 -11.377 -38.114 -1.168 977 HD2 HIS 141 HD2 HIS 141 -9.409 -37.069 0.529 978 HE1 HIS 141 HE1 HIS 141 -11.795 -34.090 2.334 979 HE2 HIS 141 HE2 HIS 141 -9.539 -35.252 2.401 Start of MODEL 5 1 H1 MET 1 HT1 MET 1 1.713 10.497 -11.978 2 H2 MET 1 HT2 MET 1 0.950 9.800 -10.631 3 H3 MET 1 HT3 MET 1 1.727 11.303 -10.487 4 HA MET 1 HA MET 1 -0.463 10.996 -12.419 5 HB2 MET 1 HB2 MET 1 -1.114 10.067 -10.104 6 HB3 MET 1 HB3 MET 1 -0.921 11.719 -9.515 7 HG2 MET 1 HG2 MET 1 -2.594 12.521 -11.112 8 HG3 MET 1 HG3 MET 1 -2.749 10.902 -11.793 9 HE1 MET 1 HE1 MET 1 -6.041 11.786 -9.857 10 HE2 MET 1 HE2 MET 1 -5.532 10.818 -11.240 11 HE3 MET 1 HE3 MET 1 -4.999 12.490 -11.102 12 H SER 2 H SER 2 1.892 12.503 -12.557 13 HA SER 2 HA SER 2 0.819 15.240 -12.330 14 HB2 SER 2 HB2 SER 2 3.554 14.330 -11.436 15 HB3 SER 2 HB3 SER 2 3.113 16.019 -11.667 16 HG SER 2 HG SER 2 1.520 15.759 -10.095 17 H ASP 3 H ASP 3 1.357 16.610 -13.984 18 HA ASP 3 HA ASP 3 2.005 15.500 -16.492 19 HB2 ASP 3 HB2 ASP 3 1.858 18.349 -15.517 20 HB3 ASP 3 HB3 ASP 3 2.177 17.933 -17.198 21 H GLN 4 H GLN 4 3.993 17.363 -14.202 22 HA GLN 4 HA GLN 4 6.347 16.840 -15.930 23 HB2 GLN 4 HB2 GLN 4 5.925 19.060 -13.913 24 HB3 GLN 4 HB3 GLN 4 7.395 18.799 -14.849 25 HG2 GLN 4 HG2 GLN 4 4.653 19.334 -16.037 26 HG3 GLN 4 HG3 GLN 4 5.925 20.538 -15.861 27 HE21 GLN 4 HE21 GLN 4 8.171 19.603 -16.859 28 HE22 GLN 4 HE22 GLN 4 8.000 18.919 -18.404 29 H SER 5 H SER 5 5.649 17.462 -12.487 30 HA SER 5 HA SER 5 7.905 16.431 -11.343 31 HB2 SER 5 HB2 SER 5 6.138 17.549 -10.065 32 HB3 SER 5 HB3 SER 5 5.082 16.158 -10.288 33 HG SER 5 HG SER 5 6.099 15.939 -8.321 34 H GLN 6 H GLN 6 5.114 14.597 -12.513 35 HA GLN 6 HA GLN 6 4.780 12.357 -12.866 36 HB2 GLN 6 HB2 GLN 6 7.807 12.403 -12.858 37 HB3 GLN 6 HB3 GLN 6 6.866 10.952 -13.203 38 HG2 GLN 6 HG2 GLN 6 5.812 12.000 -15.102 39 HG3 GLN 6 HG3 GLN 6 6.508 13.564 -14.692 40 HE21 GLN 6 HE21 GLN 6 6.871 11.941 -17.196 41 HE22 GLN 6 HE22 GLN 6 8.546 11.703 -17.341 42 H GLU 7 H GLU 7 3.724 11.759 -11.078 43 HA GLU 7 HA GLU 7 5.321 10.543 -8.907 44 HB2 GLU 7 HB2 GLU 7 4.378 12.778 -8.234 45 HB3 GLU 7 HB3 GLU 7 2.764 12.107 -8.474 46 HG2 GLU 7 HG2 GLU 7 3.161 10.404 -6.785 47 HG3 GLU 7 HG3 GLU 7 4.840 10.908 -6.618 48 HA PRO 8 HA PRO 8 2.056 7.574 -10.384 49 HB2 PRO 8 HB2 PRO 8 3.579 5.608 -11.394 50 HB3 PRO 8 HB3 PRO 8 3.276 7.095 -12.320 51 HG2 PRO 8 HG2 PRO 8 5.694 6.278 -10.786 52 HG3 PRO 8 HG3 PRO 8 5.571 7.130 -12.333 53 HD2 PRO 8 HD2 PRO 8 6.008 8.354 -9.855 54 HD3 PRO 8 HD3 PRO 8 5.442 9.181 -11.321 55 H THR 9 H THR 9 2.237 7.787 -7.838 56 HA THR 9 HA THR 9 3.638 5.641 -6.500 57 HB THR 9 HB THR 9 2.554 6.508 -4.464 58 HG1 THR 9 HG1 THR 9 1.258 8.209 -6.318 59 HG21 THR 9 HG21 THR 9 3.420 8.925 -4.704 60 HG22 THR 9 HG22 THR 9 3.861 8.471 -6.350 61 HG23 THR 9 HG23 THR 9 4.576 7.621 -4.977 62 H MET 10 H MET 10 2.598 4.074 -5.170 63 HA MET 10 HA MET 10 0.756 2.479 -6.520 64 HB2 MET 10 HB2 MET 10 1.544 2.536 -3.605 65 HB3 MET 10 HB3 MET 10 0.529 1.278 -4.309 66 HG2 MET 10 HG2 MET 10 2.290 0.659 -5.865 67 HG3 MET 10 HG3 MET 10 3.290 2.006 -5.325 68 HE1 MET 10 HE1 MET 10 2.269 -1.902 -3.231 69 HE2 MET 10 HE2 MET 10 1.569 -1.179 -4.679 70 HE3 MET 10 HE3 MET 10 1.073 -0.604 -3.088 71 H GLU 11 H GLU 11 0.177 4.788 -3.865 72 HA GLU 11 HA GLU 11 -2.591 4.171 -3.537 73 HB2 GLU 11 HB2 GLU 11 -0.995 6.666 -2.913 74 HB3 GLU 11 HB3 GLU 11 -2.699 6.481 -2.502 75 HG2 GLU 11 HG2 GLU 11 -1.586 5.795 -0.540 76 HG3 GLU 11 HG3 GLU 11 -1.978 4.278 -1.340 77 H GLU 12 H GLU 12 -0.945 6.788 -5.219 78 HA GLU 12 HA GLU 12 -3.131 8.048 -6.370 79 HB2 GLU 12 HB2 GLU 12 -0.308 7.765 -7.406 80 HB3 GLU 12 HB3 GLU 12 -1.511 8.806 -8.171 81 HG2 GLU 12 HG2 GLU 12 -1.812 10.040 -6.070 82 HG3 GLU 12 HG3 GLU 12 -0.663 8.978 -5.261 83 H ILE 13 H ILE 13 -1.158 5.440 -7.888 84 HA ILE 13 HA ILE 13 -2.610 5.251 -10.262 85 HB ILE 13 HB ILE 13 -1.085 3.127 -8.711 86 HG12 ILE 13 HG12 ILE 13 -0.275 4.679 -11.190 87 HG13 ILE 13 HG13 ILE 13 0.093 5.243 -9.561 88 HG21 ILE 13 HG21 ILE 13 -0.948 1.993 -10.984 89 HG22 ILE 13 HG22 ILE 13 -2.194 3.111 -11.544 90 HG23 ILE 13 HG23 ILE 13 -2.554 1.963 -10.254 91 HD11 ILE 13 HD11 ILE 13 2.013 4.012 -10.395 92 HD12 ILE 13 HD12 ILE 13 0.996 2.636 -10.821 93 HD13 ILE 13 HD13 ILE 13 1.249 3.054 -9.127 94 H LEU 14 H LEU 14 -3.088 3.585 -7.143 95 HA LEU 14 HA LEU 14 -5.237 1.927 -7.860 96 HB2 LEU 14 HB2 LEU 14 -3.972 1.841 -5.694 97 HB3 LEU 14 HB3 LEU 14 -4.805 3.307 -5.191 98 HG LEU 14 HG LEU 14 -6.452 0.950 -6.114 99 HD11 LEU 14 HD11 LEU 14 -5.057 -0.161 -4.533 100 HD12 LEU 14 HD12 LEU 14 -6.517 0.259 -3.640 101 HD13 LEU 14 HD13 LEU 14 -5.055 1.224 -3.444 102 HD21 LEU 14 HD21 LEU 14 -7.793 2.844 -5.655 103 HD22 LEU 14 HD22 LEU 14 -6.808 3.326 -4.277 104 HD23 LEU 14 HD23 LEU 14 -7.883 1.936 -4.150 105 H ALA 15 H ALA 15 -5.181 5.262 -6.631 106 HA ALA 15 HA ALA 15 -7.972 5.664 -6.506 107 HB1 ALA 15 HB1 ALA 15 -5.622 7.530 -6.767 108 HB2 ALA 15 HB2 ALA 15 -6.650 7.244 -5.363 109 HB3 ALA 15 HB3 ALA 15 -7.280 8.135 -6.749 110 H SER 16 H SER 16 -5.624 6.155 -9.105 111 HA SER 16 HA SER 16 -7.306 7.477 -10.939 112 HB2 SER 16 HB2 SER 16 -4.876 7.368 -11.227 113 HB3 SER 16 HB3 SER 16 -4.969 5.625 -11.470 114 HG SER 16 HG SER 16 -5.054 7.331 -13.335 115 H ILE 17 H ILE 17 -6.546 4.005 -10.604 116 HA ILE 17 HA ILE 17 -8.282 3.182 -12.709 117 HB ILE 17 HB ILE 17 -7.940 0.898 -11.836 118 HG12 ILE 17 HG12 ILE 17 -6.260 2.183 -9.664 119 HG13 ILE 17 HG13 ILE 17 -7.924 1.668 -9.391 120 HG21 ILE 17 HG21 ILE 17 -6.257 2.010 -13.299 121 HG22 ILE 17 HG22 ILE 17 -5.522 0.840 -12.203 122 HG23 ILE 17 HG23 ILE 17 -5.407 2.566 -11.858 123 HD11 ILE 17 HD11 ILE 17 -7.166 -0.628 -10.310 124 HD12 ILE 17 HD12 ILE 17 -6.619 -0.184 -8.693 125 HD13 ILE 17 HD13 ILE 17 -5.522 -0.035 -10.067 126 H ARG 18 H ARG 18 -8.854 3.945 -9.368 127 HA ARG 18 HA ARG 18 -11.416 2.548 -9.323 128 HB2 ARG 18 HB2 ARG 18 -9.735 2.811 -7.337 129 HB3 ARG 18 HB3 ARG 18 -10.440 4.416 -7.169 130 HG2 ARG 18 HG2 ARG 18 -11.704 3.004 -5.715 131 HG3 ARG 18 HG3 ARG 18 -12.723 3.258 -7.131 132 HD2 ARG 18 HD2 ARG 18 -12.146 1.095 -8.028 133 HD3 ARG 18 HD3 ARG 18 -10.896 0.864 -6.812 134 HE ARG 18 HE ARG 18 -13.315 1.240 -5.455 135 HH11 ARG 18 HH11 ARG 18 -11.899 -1.096 -7.653 136 HH12 ARG 18 HH12 ARG 18 -12.833 -2.417 -7.034 137 HH21 ARG 18 HH21 ARG 18 -14.512 -0.507 -4.687 138 HH22 ARG 18 HH22 ARG 18 -14.300 -2.085 -5.370 139 H ARG 19 H ARG 19 -11.286 4.426 -11.336 140 HA ARG 19 HA ARG 19 -13.341 6.344 -10.478 141 HB2 ARG 19 HB2 ARG 19 -11.057 7.457 -10.549 142 HB3 ARG 19 HB3 ARG 19 -11.049 7.139 -12.283 143 HG2 ARG 19 HG2 ARG 19 -11.901 9.354 -12.056 144 HG3 ARG 19 HG3 ARG 19 -13.310 8.343 -12.365 145 HD2 ARG 19 HD2 ARG 19 -13.882 8.307 -10.013 146 HD3 ARG 19 HD3 ARG 19 -12.381 9.127 -9.590 147 HE ARG 19 HE ARG 19 -13.755 10.771 -11.394 148 HH11 ARG 19 HH11 ARG 19 -14.207 9.519 -8.152 149 HH12 ARG 19 HH12 ARG 19 -15.147 10.876 -7.633 150 HH21 ARG 19 HH21 ARG 19 -14.979 12.519 -10.676 151 HH22 ARG 19 HH22 ARG 19 -15.580 12.560 -9.053 152 H ILE 20 H ILE 20 -14.896 6.755 -12.021 153 HA ILE 20 HA ILE 20 -16.180 6.467 -13.903 154 HB ILE 20 HB ILE 20 -13.680 5.535 -15.336 155 HG12 ILE 20 HG12 ILE 20 -13.176 7.723 -14.339 156 HG13 ILE 20 HG13 ILE 20 -13.370 7.889 -16.075 157 HG21 ILE 20 HG21 ILE 20 -14.937 6.570 -17.300 158 HG22 ILE 20 HG22 ILE 20 -16.341 6.642 -16.238 159 HG23 ILE 20 HG23 ILE 20 -15.617 5.085 -16.638 160 HD11 ILE 20 HD11 ILE 20 -14.506 9.736 -14.911 161 HD12 ILE 20 HD12 ILE 20 -15.463 8.582 -13.982 162 HD13 ILE 20 HD13 ILE 20 -15.691 8.714 -15.725 163 H ILE 21 H ILE 21 -17.582 4.875 -14.060 164 HA ILE 21 HA ILE 21 -16.644 2.111 -14.379 165 HB ILE 21 HB ILE 21 -17.048 2.460 -11.962 166 HG12 ILE 21 HG12 ILE 21 -19.292 0.771 -13.092 167 HG13 ILE 21 HG13 ILE 21 -17.603 0.281 -13.222 168 HG21 ILE 21 HG21 ILE 21 -18.746 4.250 -12.163 169 HG22 ILE 21 HG22 ILE 21 -19.318 2.928 -11.146 170 HG23 ILE 21 HG23 ILE 21 -19.898 3.077 -12.803 171 HD11 ILE 21 HD11 ILE 21 -19.099 0.858 -10.646 172 HD12 ILE 21 HD12 ILE 21 -17.387 0.445 -10.750 173 HD13 ILE 21 HD13 ILE 21 -18.608 -0.733 -11.231 174 H SER 22 H SER 22 -18.174 0.709 -15.374 175 HA SER 22 HA SER 22 -20.678 1.847 -16.355 176 HB2 SER 22 HB2 SER 22 -20.163 1.449 -18.695 177 HB3 SER 22 HB3 SER 22 -18.964 2.546 -18.015 178 HG SER 22 HG SER 22 -18.267 0.597 -19.320 179 H GLU 23 H GLU 23 -22.020 0.257 -17.434 180 HA GLU 23 HA GLU 23 -21.287 -2.553 -17.199 181 HB2 GLU 23 HB2 GLU 23 -22.180 -1.861 -14.937 182 HB3 GLU 23 HB3 GLU 23 -23.718 -1.518 -15.727 183 HG2 GLU 23 HG2 GLU 23 -23.833 -3.848 -16.529 184 HG3 GLU 23 HG3 GLU 23 -22.295 -4.196 -15.742 185 H ASP 24 H ASP 24 -22.324 -3.784 -18.699 186 HA ASP 24 HA ASP 24 -23.560 -4.283 -20.569 187 HB2 ASP 24 HB2 ASP 24 -25.348 -3.753 -18.631 188 HB3 ASP 24 HB3 ASP 24 -25.769 -2.459 -19.755 189 H ASP 25 H ASP 25 -22.387 -3.336 -22.190 190 HA ASP 25 HA ASP 25 -22.901 -0.505 -22.807 191 HB2 ASP 25 HB2 ASP 25 -20.826 -2.402 -23.929 192 HB3 ASP 25 HB3 ASP 25 -20.962 -0.686 -24.309 193 H ALA 26 H ALA 26 -23.042 -3.742 -24.238 194 HA ALA 26 HA ALA 26 -24.206 -2.738 -26.704 195 HB1 ALA 26 HB1 ALA 26 -23.500 -5.499 -25.718 196 HB2 ALA 26 HB2 ALA 26 -22.695 -4.559 -26.976 197 HB3 ALA 26 HB3 ALA 26 -24.309 -5.211 -27.258 198 HA PRO 27 HA PRO 27 -28.320 -3.215 -24.757 199 HB2 PRO 27 HB2 PRO 27 -29.841 -2.452 -26.905 200 HB3 PRO 27 HB3 PRO 27 -29.038 -1.302 -25.818 201 HG2 PRO 27 HG2 PRO 27 -28.180 -2.282 -28.499 202 HG3 PRO 27 HG3 PRO 27 -28.132 -0.641 -27.827 203 HD2 PRO 27 HD2 PRO 27 -25.922 -2.213 -27.932 204 HD3 PRO 27 HD3 PRO 27 -26.187 -1.044 -26.620 205 H ALA 28 H ALA 28 -27.222 -4.635 -27.744 206 HA ALA 28 HA ALA 28 -29.404 -6.418 -28.196 207 HB1 ALA 28 HB1 ALA 28 -27.481 -5.647 -29.798 208 HB2 ALA 28 HB2 ALA 28 -28.133 -7.279 -29.942 209 HB3 ALA 28 HB3 ALA 28 -26.607 -7.010 -29.099 210 H GLU 29 H GLU 29 -29.318 -8.757 -28.015 211 HA GLU 29 HA GLU 29 -27.467 -9.855 -26.040 212 HB2 GLU 29 HB2 GLU 29 -29.516 -8.999 -24.814 213 HB3 GLU 29 HB3 GLU 29 -30.463 -10.179 -25.722 214 HG2 GLU 29 HG2 GLU 29 -29.067 -11.998 -24.831 215 HG3 GLU 29 HG3 GLU 29 -28.102 -10.829 -23.936 216 HA PRO 30 HA PRO 30 -28.569 -12.392 -29.907 217 HB2 PRO 30 HB2 PRO 30 -25.625 -12.840 -29.693 218 HB3 PRO 30 HB3 PRO 30 -26.617 -12.584 -31.142 219 HG2 PRO 30 HG2 PRO 30 -25.092 -10.649 -30.249 220 HG3 PRO 30 HG3 PRO 30 -26.747 -10.291 -30.780 221 HD2 PRO 30 HD2 PRO 30 -25.693 -10.575 -27.975 222 HD3 PRO 30 HD3 PRO 30 -26.825 -9.373 -28.636 223 H ALA 31 H ALA 31 -26.611 -13.008 -27.045 224 HA ALA 31 HA ALA 31 -27.359 -15.866 -27.129 225 HB1 ALA 31 HB1 ALA 31 -25.035 -15.914 -27.155 226 HB2 ALA 31 HB2 ALA 31 -25.362 -15.966 -25.423 227 HB3 ALA 31 HB3 ALA 31 -24.891 -14.448 -26.185 228 H ALA 32 H ALA 32 -28.298 -16.756 -25.353 229 HA ALA 32 HA ALA 32 -28.599 -15.168 -22.925 230 HB1 ALA 32 HB1 ALA 32 -31.083 -16.308 -24.164 231 HB2 ALA 32 HB2 ALA 32 -30.493 -14.718 -24.662 232 HB3 ALA 32 HB3 ALA 32 -30.924 -15.013 -22.975 233 H GLU 33 H GLU 33 -29.638 -16.447 -21.169 234 HA GLU 33 HA GLU 33 -29.273 -19.362 -21.539 235 HB2 GLU 33 HB2 GLU 33 -28.323 -17.617 -19.263 236 HB3 GLU 33 HB3 GLU 33 -28.461 -19.370 -19.130 237 HG2 GLU 33 HG2 GLU 33 -26.198 -18.945 -19.767 238 HG3 GLU 33 HG3 GLU 33 -27.012 -19.520 -21.220 239 H ALA 34 H ALA 34 -31.470 -19.775 -21.738 240 HA ALA 34 HA ALA 34 -32.936 -20.078 -19.324 241 HB1 ALA 34 HB1 ALA 34 -33.681 -17.824 -21.182 242 HB2 ALA 34 HB2 ALA 34 -33.547 -17.799 -19.423 243 HB3 ALA 34 HB3 ALA 34 -34.896 -18.633 -20.195 244 H ALA 35 H ALA 35 -34.757 -21.438 -19.646 245 HA ALA 35 HA ALA 35 -35.581 -22.135 -22.328 246 HB1 ALA 35 HB1 ALA 35 -34.572 -24.526 -20.917 247 HB2 ALA 35 HB2 ALA 35 -33.330 -23.407 -21.480 248 HB3 ALA 35 HB3 ALA 35 -34.483 -24.095 -22.626 249 HA PRO 36 HA PRO 36 -39.345 -23.306 -20.265 250 HB2 PRO 36 HB2 PRO 36 -39.479 -25.766 -21.942 251 HB3 PRO 36 HB3 PRO 36 -40.651 -24.444 -21.785 252 HG2 PRO 36 HG2 PRO 36 -39.176 -24.691 -23.965 253 HG3 PRO 36 HG3 PRO 36 -39.524 -23.093 -23.277 254 HD2 PRO 36 HD2 PRO 36 -36.999 -24.716 -23.083 255 HD3 PRO 36 HD3 PRO 36 -37.197 -22.966 -23.340 256 HA PRO 37 HA PRO 37 -38.158 -26.293 -17.150 257 HB2 PRO 37 HB2 PRO 37 -40.586 -27.115 -16.171 258 HB3 PRO 37 HB3 PRO 37 -39.862 -25.540 -15.791 259 HG2 PRO 37 HG2 PRO 37 -41.958 -26.220 -17.802 260 HG3 PRO 37 HG3 PRO 37 -41.878 -24.853 -16.679 261 HD2 PRO 37 HD2 PRO 37 -41.216 -24.581 -19.289 262 HD3 PRO 37 HD3 PRO 37 -40.385 -23.664 -18.012 263 HA PRO 38 HA PRO 38 -38.352 -30.270 -19.188 264 HB2 PRO 38 HB2 PRO 38 -37.698 -31.990 -17.183 265 HB3 PRO 38 HB3 PRO 38 -36.519 -30.899 -17.935 266 HG2 PRO 38 HG2 PRO 38 -38.011 -30.588 -15.369 267 HG3 PRO 38 HG3 PRO 38 -36.300 -30.276 -15.724 268 HD2 PRO 38 HD2 PRO 38 -38.144 -28.278 -15.606 269 HD3 PRO 38 HD3 PRO 38 -36.736 -28.210 -16.690 270 HA PRO 39 HA PRO 39 -42.448 -31.975 -18.607 271 HB2 PRO 39 HB2 PRO 39 -41.299 -34.667 -19.190 272 HB3 PRO 39 HB3 PRO 39 -42.634 -33.814 -19.990 273 HG2 PRO 39 HG2 PRO 39 -40.290 -34.037 -21.177 274 HG3 PRO 39 HG3 PRO 39 -41.213 -32.525 -21.276 275 HD2 PRO 39 HD2 PRO 39 -38.829 -33.165 -19.557 276 HD3 PRO 39 HD3 PRO 39 -39.206 -31.673 -20.450 277 HA PRO 40 HA PRO 40 -42.332 -33.602 -14.414 278 HB2 PRO 40 HB2 PRO 40 -44.887 -34.495 -14.101 279 HB3 PRO 40 HB3 PRO 40 -44.468 -32.770 -14.127 280 HG2 PRO 40 HG2 PRO 40 -45.558 -34.482 -16.315 281 HG3 PRO 40 HG3 PRO 40 -46.027 -32.844 -15.830 282 HD2 PRO 40 HD2 PRO 40 -44.395 -33.305 -17.953 283 HD3 PRO 40 HD3 PRO 40 -44.239 -31.855 -16.937 284 H GLU 41 H GLU 41 -42.192 -35.554 -13.255 285 HA GLU 41 HA GLU 41 -42.578 -38.044 -14.799 286 HB2 GLU 41 HB2 GLU 41 -40.187 -37.361 -13.061 287 HB3 GLU 41 HB3 GLU 41 -40.483 -38.927 -13.814 288 HG2 GLU 41 HG2 GLU 41 -39.090 -37.969 -15.401 289 HG3 GLU 41 HG3 GLU 41 -40.655 -37.474 -16.033 290 HA PRO 42 HA PRO 42 -44.759 -38.201 -10.646 291 HB2 PRO 42 HB2 PRO 42 -46.888 -39.699 -11.554 292 HB3 PRO 42 HB3 PRO 42 -46.847 -37.926 -11.556 293 HG2 PRO 42 HG2 PRO 42 -46.313 -39.832 -13.783 294 HG3 PRO 42 HG3 PRO 42 -47.214 -38.306 -13.795 295 HD2 PRO 42 HD2 PRO 42 -44.686 -38.450 -14.735 296 HD3 PRO 42 HD3 PRO 42 -45.284 -37.003 -13.888 297 H GLU 43 H GLU 43 -43.884 -40.634 -13.008 298 HA GLU 43 HA GLU 43 -44.341 -42.964 -11.502 299 HB2 GLU 43 HB2 GLU 43 -43.811 -42.876 -13.954 300 HB3 GLU 43 HB3 GLU 43 -42.136 -42.531 -13.526 301 HG2 GLU 43 HG2 GLU 43 -42.020 -44.644 -12.258 302 HG3 GLU 43 HG3 GLU 43 -43.693 -44.993 -12.684 303 HA PRO 44 HA PRO 44 -41.108 -42.352 -8.411 304 HB2 PRO 44 HB2 PRO 44 -41.002 -44.841 -7.313 305 HB3 PRO 44 HB3 PRO 44 -42.329 -43.705 -6.990 306 HG2 PRO 44 HG2 PRO 44 -42.227 -46.004 -8.890 307 HG3 PRO 44 HG3 PRO 44 -43.523 -45.513 -7.784 308 HD2 PRO 44 HD2 PRO 44 -43.590 -44.921 -10.437 309 HD3 PRO 44 HD3 PRO 44 -44.301 -43.852 -9.207 310 H GLU 45 H GLU 45 -38.901 -42.714 -8.168 311 HA GLU 45 HA GLU 45 -37.527 -43.828 -10.431 312 HB2 GLU 45 HB2 GLU 45 -35.486 -43.102 -9.258 313 HB3 GLU 45 HB3 GLU 45 -36.692 -41.820 -9.279 314 HG2 GLU 45 HG2 GLU 45 -37.362 -42.404 -6.979 315 HG3 GLU 45 HG3 GLU 45 -36.182 -43.709 -6.958 316 HA PRO 46 HA PRO 46 -36.798 -47.940 -8.886 317 HB2 PRO 46 HB2 PRO 46 -34.324 -48.559 -9.838 318 HB3 PRO 46 HB3 PRO 46 -35.748 -48.428 -10.890 319 HG2 PRO 46 HG2 PRO 46 -33.582 -46.439 -10.385 320 HG3 PRO 46 HG3 PRO 46 -34.347 -46.909 -11.915 321 HD2 PRO 46 HD2 PRO 46 -35.041 -44.639 -10.586 322 HD3 PRO 46 HD3 PRO 46 -36.202 -45.561 -11.561 323 H VAL 47 H VAL 47 -35.712 -49.153 -7.264 324 HA VAL 47 HA VAL 47 -33.626 -47.743 -5.731 325 HB VAL 47 HB VAL 47 -35.802 -47.268 -4.662 326 HG11 VAL 47 HG11 VAL 47 -36.950 -49.350 -5.437 327 HG12 VAL 47 HG12 VAL 47 -37.161 -49.044 -3.714 328 HG13 VAL 47 HG13 VAL 47 -36.010 -50.265 -4.258 329 HG21 VAL 47 HG21 VAL 47 -33.729 -47.562 -3.289 330 HG22 VAL 47 HG22 VAL 47 -34.174 -49.251 -3.042 331 HG23 VAL 47 HG23 VAL 47 -35.203 -47.967 -2.408 332 H SER 48 H SER 48 -32.021 -49.008 -5.020 333 HA SER 48 HA SER 48 -31.776 -51.687 -5.954 334 HB2 SER 48 HB2 SER 48 -29.816 -50.268 -5.676 335 HB3 SER 48 HB3 SER 48 -30.130 -50.127 -3.950 336 HG SER 48 HG SER 48 -29.014 -52.182 -5.401 337 H PHE 49 H PHE 49 -31.930 -53.622 -4.883 338 HA PHE 49 HA PHE 49 -33.740 -53.820 -2.701 339 HB2 PHE 49 HB2 PHE 49 -31.850 -55.818 -3.958 340 HB3 PHE 49 HB3 PHE 49 -32.974 -56.236 -2.663 341 HD1 PHE 49 HD1 PHE 49 -32.643 -55.277 -6.193 342 HD2 PHE 49 HD2 PHE 49 -35.402 -56.179 -3.028 343 HE1 PHE 49 HE1 PHE 49 -34.471 -55.507 -7.853 344 HE2 PHE 49 HE2 PHE 49 -37.231 -56.412 -4.687 345 HZ PHE 49 HZ PHE 49 -36.765 -56.075 -7.100 346 H ASP 50 H ASP 50 -30.222 -54.089 -2.951 347 HA ASP 50 HA ASP 50 -29.962 -54.331 -0.040 348 HB2 ASP 50 HB2 ASP 50 -27.596 -54.754 -0.482 349 HB3 ASP 50 HB3 ASP 50 -28.597 -55.802 -1.484 350 H ASP 51 H ASP 51 -27.831 -53.012 0.708 351 HA ASP 51 HA ASP 51 -27.110 -50.937 1.385 352 HB2 ASP 51 HB2 ASP 51 -26.199 -51.114 -0.966 353 HB3 ASP 51 HB3 ASP 51 -27.579 -50.157 -1.499 354 H GLU 52 H GLU 52 -29.456 -51.107 2.379 355 HA GLU 52 HA GLU 52 -30.787 -48.553 1.791 356 HB2 GLU 52 HB2 GLU 52 -32.189 -51.193 2.312 357 HB3 GLU 52 HB3 GLU 52 -32.983 -49.622 2.193 358 HG2 GLU 52 HG2 GLU 52 -32.134 -49.383 -0.122 359 HG3 GLU 52 HG3 GLU 52 -31.384 -50.973 -0.002 360 H VAL 53 H VAL 53 -30.603 -47.370 3.556 361 HA VAL 53 HA VAL 53 -30.823 -48.715 6.167 362 HB VAL 53 HB VAL 53 -29.151 -47.116 7.072 363 HG11 VAL 53 HG11 VAL 53 -28.316 -48.860 4.743 364 HG12 VAL 53 HG12 VAL 53 -28.351 -49.296 6.452 365 HG13 VAL 53 HG13 VAL 53 -27.169 -48.128 5.864 366 HG21 VAL 53 HG21 VAL 53 -29.540 -45.391 5.232 367 HG22 VAL 53 HG22 VAL 53 -28.563 -46.416 4.181 368 HG23 VAL 53 HG23 VAL 53 -27.850 -45.703 5.628 369 H LEU 54 H LEU 54 -31.493 -47.215 7.944 370 HA LEU 54 HA LEU 54 -33.515 -45.330 6.947 371 HB2 LEU 54 HB2 LEU 54 -33.095 -46.853 9.504 372 HB3 LEU 54 HB3 LEU 54 -34.057 -45.379 9.534 373 HG LEU 54 HG LEU 54 -35.381 -46.386 7.574 374 HD11 LEU 54 HD11 LEU 54 -35.314 -48.924 7.579 375 HD12 LEU 54 HD12 LEU 54 -33.826 -48.808 8.520 376 HD13 LEU 54 HD13 LEU 54 -33.890 -48.146 6.886 377 HD21 LEU 54 HD21 LEU 54 -35.489 -47.864 10.222 378 HD22 LEU 54 HD22 LEU 54 -36.814 -47.662 9.075 379 HD23 LEU 54 HD23 LEU 54 -36.182 -46.266 9.946 380 H GLU 55 H GLU 55 -33.219 -43.205 7.049 381 HA GLU 55 HA GLU 55 -31.360 -42.083 9.032 382 HB2 GLU 55 HB2 GLU 55 -31.325 -41.424 6.075 383 HB3 GLU 55 HB3 GLU 55 -30.389 -40.593 7.313 384 HG2 GLU 55 HG2 GLU 55 -30.173 -43.548 6.656 385 HG3 GLU 55 HG3 GLU 55 -29.042 -42.312 6.122 386 H LEU 56 H LEU 56 -32.521 -40.721 10.191 387 HA LEU 56 HA LEU 56 -34.415 -38.915 8.813 388 HB2 LEU 56 HB2 LEU 56 -34.832 -40.473 11.367 389 HB3 LEU 56 HB3 LEU 56 -35.838 -39.098 10.908 390 HG LEU 56 HG LEU 56 -35.405 -41.500 9.108 391 HD11 LEU 56 HD11 LEU 56 -37.642 -40.938 11.081 392 HD12 LEU 56 HD12 LEU 56 -36.477 -42.259 11.175 393 HD13 LEU 56 HD13 LEU 56 -37.665 -42.222 9.872 394 HD21 LEU 56 HD21 LEU 56 -37.591 -40.610 8.146 395 HD22 LEU 56 HD22 LEU 56 -36.190 -39.572 7.891 396 HD23 LEU 56 HD23 LEU 56 -37.359 -39.180 9.150 397 H THR 57 H THR 57 -34.346 -36.818 9.426 398 HA THR 57 HA THR 57 -32.982 -36.027 11.876 399 HB THR 57 HB THR 57 -31.132 -36.217 10.281 400 HG1 THR 57 HG1 THR 57 -30.969 -34.566 11.744 401 HG21 THR 57 HG21 THR 57 -31.064 -34.698 8.303 402 HG22 THR 57 HG22 THR 57 -32.741 -34.255 8.619 403 HG23 THR 57 HG23 THR 57 -32.336 -35.914 8.178 404 H ASP 58 H ASP 58 -33.263 -33.776 12.392 405 HA ASP 58 HA ASP 58 -35.851 -32.784 11.656 406 HB2 ASP 58 HB2 ASP 58 -35.391 -31.000 13.245 407 HB3 ASP 58 HB3 ASP 58 -34.920 -32.541 13.949 408 HA PRO 59 HA PRO 59 -34.789 -30.152 8.283 409 HB2 PRO 59 HB2 PRO 59 -36.120 -27.845 9.633 410 HB3 PRO 59 HB3 PRO 59 -36.434 -28.547 8.031 411 HG2 PRO 59 HG2 PRO 59 -38.115 -28.960 10.027 412 HG3 PRO 59 HG3 PRO 59 -37.719 -30.266 8.893 413 HD2 PRO 59 HD2 PRO 59 -36.697 -29.828 11.689 414 HD3 PRO 59 HD3 PRO 59 -37.185 -31.344 10.895 415 H ILE 60 H ILE 60 -33.178 -28.752 7.637 416 HA ILE 60 HA ILE 60 -31.619 -27.442 9.787 417 HB ILE 60 HB ILE 60 -30.583 -28.427 7.107 418 HG12 ILE 60 HG12 ILE 60 -29.336 -30.071 8.788 419 HG13 ILE 60 HG13 ILE 60 -30.715 -29.734 9.832 420 HG21 ILE 60 HG21 ILE 60 -28.365 -28.121 8.332 421 HG22 ILE 60 HG22 ILE 60 -29.269 -27.251 9.570 422 HG23 ILE 60 HG23 ILE 60 -29.219 -26.633 7.918 423 HD11 ILE 60 HD11 ILE 60 -32.235 -30.731 8.350 424 HD12 ILE 60 HD12 ILE 60 -30.820 -31.767 8.184 425 HD13 ILE 60 HD13 ILE 60 -31.164 -30.544 6.962 426 H ALA 61 H ALA 61 -31.466 -25.308 9.715 427 HA ALA 61 HA ALA 61 -32.039 -23.911 7.166 428 HB1 ALA 61 HB1 ALA 61 -33.795 -23.832 9.123 429 HB2 ALA 61 HB2 ALA 61 -33.399 -22.363 8.233 430 HB3 ALA 61 HB3 ALA 61 -32.675 -22.658 9.813 431 HA PRO 62 HA PRO 62 -28.127 -21.894 7.851 432 HB2 PRO 62 HB2 PRO 62 -28.428 -19.551 6.515 433 HB3 PRO 62 HB3 PRO 62 -28.297 -21.112 5.679 434 HG2 PRO 62 HG2 PRO 62 -30.736 -19.516 6.326 435 HG3 PRO 62 HG3 PRO 62 -30.302 -20.349 4.824 436 HD2 PRO 62 HD2 PRO 62 -32.023 -21.428 6.636 437 HD3 PRO 62 HD3 PRO 62 -30.960 -22.426 5.621 438 H GLU 63 H GLU 63 -27.070 -20.183 8.984 439 HA GLU 63 HA GLU 63 -28.824 -18.485 10.660 440 HB2 GLU 63 HB2 GLU 63 -26.347 -20.000 11.531 441 HB3 GLU 63 HB3 GLU 63 -27.201 -18.815 12.519 442 HG2 GLU 63 HG2 GLU 63 -29.251 -20.181 12.395 443 HG3 GLU 63 HG3 GLU 63 -28.403 -21.366 11.405 444 HA PRO 64 HA PRO 64 -26.192 -15.210 9.200 445 HB2 PRO 64 HB2 PRO 64 -26.310 -13.388 11.221 446 HB3 PRO 64 HB3 PRO 64 -27.675 -13.706 10.130 447 HG2 PRO 64 HG2 PRO 64 -27.189 -14.722 12.891 448 HG3 PRO 64 HG3 PRO 64 -28.685 -14.113 12.161 449 HD2 PRO 64 HD2 PRO 64 -28.176 -16.776 12.434 450 HD3 PRO 64 HD3 PRO 64 -29.141 -16.121 11.093 451 H GLU 65 H GLU 65 -24.066 -14.708 9.178 452 HA GLU 65 HA GLU 65 -22.392 -14.578 11.474 453 HB2 GLU 65 HB2 GLU 65 -20.946 -16.526 10.980 454 HB3 GLU 65 HB3 GLU 65 -22.577 -17.019 11.424 455 HG2 GLU 65 HG2 GLU 65 -23.146 -17.267 9.021 456 HG3 GLU 65 HG3 GLU 65 -21.501 -16.808 8.594 457 H LEU 66 H LEU 66 -20.353 -13.709 10.988 458 HA LEU 66 HA LEU 66 -20.088 -12.735 8.227 459 HB2 LEU 66 HB2 LEU 66 -20.161 -11.207 10.327 460 HB3 LEU 66 HB3 LEU 66 -18.514 -11.763 10.605 461 HG LEU 66 HG LEU 66 -19.415 -10.542 7.981 462 HD11 LEU 66 HD11 LEU 66 -18.500 -8.436 8.743 463 HD12 LEU 66 HD12 LEU 66 -17.942 -9.167 10.248 464 HD13 LEU 66 HD13 LEU 66 -19.670 -8.978 9.947 465 HD21 LEU 66 HD21 LEU 66 -17.394 -11.736 7.645 466 HD22 LEU 66 HD22 LEU 66 -16.752 -11.272 9.220 467 HD23 LEU 66 HD23 LEU 66 -16.858 -10.081 7.921 468 HA PRO 67 HA PRO 67 -16.742 -15.833 8.014 469 HB2 PRO 67 HB2 PRO 67 -15.791 -15.244 5.519 470 HB3 PRO 67 HB3 PRO 67 -17.267 -16.191 5.798 471 HG2 PRO 67 HG2 PRO 67 -16.976 -13.298 5.123 472 HG3 PRO 67 HG3 PRO 67 -18.114 -14.496 4.479 473 HD2 PRO 67 HD2 PRO 67 -18.850 -12.711 6.380 474 HD3 PRO 67 HD3 PRO 67 -19.523 -14.356 6.323 475 HA PRO 68 HA PRO 68 -13.219 -13.387 9.266 476 HB2 PRO 68 HB2 PRO 68 -11.117 -15.066 8.715 477 HB3 PRO 68 HB3 PRO 68 -12.204 -15.274 10.101 478 HG2 PRO 68 HG2 PRO 68 -12.207 -16.668 7.470 479 HG3 PRO 68 HG3 PRO 68 -12.490 -17.319 9.095 480 HD2 PRO 68 HD2 PRO 68 -14.525 -16.779 7.367 481 HD3 PRO 68 HD3 PRO 68 -14.706 -16.641 9.128 482 H LEU 69 H LEU 69 -12.809 -11.637 8.064 483 HA LEU 69 HA LEU 69 -11.052 -11.887 5.735 484 HB2 LEU 69 HB2 LEU 69 -13.743 -10.498 5.697 485 HB3 LEU 69 HB3 LEU 69 -12.483 -10.197 4.503 486 HG LEU 69 HG LEU 69 -13.568 -12.968 5.083 487 HD11 LEU 69 HD11 LEU 69 -15.409 -11.605 4.257 488 HD12 LEU 69 HD12 LEU 69 -14.851 -12.654 2.952 489 HD13 LEU 69 HD13 LEU 69 -14.393 -10.950 2.973 490 HD21 LEU 69 HD21 LEU 69 -12.619 -13.346 2.751 491 HD22 LEU 69 HD22 LEU 69 -11.413 -13.029 3.997 492 HD23 LEU 69 HD23 LEU 69 -11.879 -11.751 2.875 493 H GLU 70 H GLU 70 -9.555 -10.263 5.661 494 HA GLU 70 HA GLU 70 -9.213 -8.573 7.896 495 HB2 GLU 70 HB2 GLU 70 -7.390 -7.540 6.593 496 HB3 GLU 70 HB3 GLU 70 -7.324 -9.301 6.519 497 HG2 GLU 70 HG2 GLU 70 -8.523 -9.204 4.320 498 HG3 GLU 70 HG3 GLU 70 -8.427 -7.444 4.387 499 H THR 71 H THR 71 -10.718 -8.058 4.760 500 HA THR 71 HA THR 71 -11.758 -6.230 3.809 501 HB THR 71 HB THR 71 -12.775 -5.811 6.622 502 HG1 THR 71 HG1 THR 71 -13.765 -7.606 4.672 503 HG21 THR 71 HG21 THR 71 -14.876 -5.281 5.301 504 HG22 THR 71 HG22 THR 71 -13.880 -5.331 3.846 505 HG23 THR 71 HG23 THR 71 -13.557 -4.129 5.095 506 H VAL 72 H VAL 72 -9.703 -5.105 3.474 507 HA VAL 72 HA VAL 72 -9.586 -2.598 5.035 508 HB VAL 72 HB VAL 72 -7.117 -2.618 4.823 509 HG11 VAL 72 HG11 VAL 72 -8.329 -5.049 6.171 510 HG12 VAL 72 HG12 VAL 72 -8.147 -3.445 6.880 511 HG13 VAL 72 HG13 VAL 72 -6.720 -4.408 6.504 512 HG21 VAL 72 HG21 VAL 72 -7.536 -5.452 3.804 513 HG22 VAL 72 HG22 VAL 72 -5.979 -4.713 4.173 514 HG23 VAL 72 HG23 VAL 72 -6.953 -4.098 2.837 515 H GLY 73 H GLY 73 -8.711 -0.781 3.905 516 HA2 GLY 73 HA2 GLY 73 -8.424 -0.980 1.000 517 HA3 GLY 73 HA3 GLY 73 -9.758 0.002 1.598 518 H ASP 74 H ASP 74 -6.583 -0.333 3.114 519 HA ASP 74 HA ASP 74 -5.890 2.417 2.316 520 HB2 ASP 74 HB2 ASP 74 -6.924 2.533 4.552 521 HB3 ASP 74 HB3 ASP 74 -5.756 1.350 5.147 522 H ILE 75 H ILE 75 -4.146 1.984 1.081 523 HA ILE 75 HA ILE 75 -2.290 -0.111 1.510 524 HB ILE 75 HB ILE 75 -2.066 2.477 -0.070 525 HG12 ILE 75 HG12 ILE 75 -2.472 -0.364 -1.049 526 HG13 ILE 75 HG13 ILE 75 -3.823 0.705 -0.678 527 HG21 ILE 75 HG21 ILE 75 -0.186 1.317 -1.254 528 HG22 ILE 75 HG22 ILE 75 -0.272 0.017 -0.063 529 HG23 ILE 75 HG23 ILE 75 0.190 1.643 0.440 530 HD11 ILE 75 HD11 ILE 75 -3.050 0.649 -3.126 531 HD12 ILE 75 HD12 ILE 75 -1.615 1.518 -2.580 532 HD13 ILE 75 HD13 ILE 75 -3.211 2.243 -2.390 533 H ASP 76 H ASP 76 -2.266 3.343 2.342 534 HA ASP 76 HA ASP 76 -1.123 4.541 3.931 535 HB2 ASP 76 HB2 ASP 76 -1.667 2.418 5.345 536 HB3 ASP 76 HB3 ASP 76 0.021 1.999 5.075 537 H VAL 77 H VAL 77 0.860 5.561 3.918 538 HA VAL 77 HA VAL 77 2.791 4.513 2.000 539 HB VAL 77 HB VAL 77 2.950 7.124 3.533 540 HG11 VAL 77 HG11 VAL 77 4.683 7.696 2.127 541 HG12 VAL 77 HG12 VAL 77 4.064 6.746 0.776 542 HG13 VAL 77 HG13 VAL 77 4.914 5.951 2.095 543 HG21 VAL 77 HG21 VAL 77 1.543 6.449 0.929 544 HG22 VAL 77 HG22 VAL 77 2.029 8.093 1.343 545 HG23 VAL 77 HG23 VAL 77 0.863 7.239 2.353 546 H TYR 78 H TYR 78 3.082 5.928 5.295 547 HA TYR 78 HA TYR 78 4.598 3.737 6.290 548 HB2 TYR 78 HB2 TYR 78 6.792 4.833 6.542 549 HB3 TYR 78 HB3 TYR 78 6.365 4.592 4.852 550 HD1 TYR 78 HD1 TYR 78 6.444 7.117 7.593 551 HD2 TYR 78 HD2 TYR 78 6.182 6.448 3.364 552 HE1 TYR 78 HE1 TYR 78 6.740 9.546 7.188 553 HE2 TYR 78 HE2 TYR 78 6.467 8.874 2.957 554 HH TYR 78 HH TYR 78 7.711 10.881 4.641 555 H SER 79 H SER 79 2.513 6.022 6.975 556 HA SER 79 HA SER 79 3.096 6.004 9.770 557 HB2 SER 79 HB2 SER 79 3.036 8.724 9.636 558 HB3 SER 79 HB3 SER 79 4.504 7.767 9.779 559 HG SER 79 HG SER 79 3.997 9.425 7.905 560 HA PRO 80 HA PRO 80 -0.943 8.564 9.244 561 HB2 PRO 80 HB2 PRO 80 -1.877 9.065 6.711 562 HB3 PRO 80 HB3 PRO 80 -0.858 10.189 7.629 563 HG2 PRO 80 HG2 PRO 80 -0.098 8.268 5.482 564 HG3 PRO 80 HG3 PRO 80 0.454 9.930 5.759 565 HD2 PRO 80 HD2 PRO 80 1.959 7.783 6.458 566 HD3 PRO 80 HD3 PRO 80 1.986 9.299 7.384 567 HA PRO 81 HA PRO 81 -2.765 4.439 8.386 568 HB2 PRO 81 HB2 PRO 81 -4.901 4.602 10.078 569 HB3 PRO 81 HB3 PRO 81 -3.258 4.219 10.629 570 HG2 PRO 81 HG2 PRO 81 -4.731 6.808 10.724 571 HG3 PRO 81 HG3 PRO 81 -3.688 6.056 11.945 572 HD2 PRO 81 HD2 PRO 81 -2.821 8.061 10.313 573 HD3 PRO 81 HD3 PRO 81 -1.740 6.796 10.936 574 H GLU 82 H GLU 82 -4.581 7.476 8.452 575 HA GLU 82 HA GLU 82 -6.848 6.518 7.015 576 HB2 GLU 82 HB2 GLU 82 -5.794 9.310 7.493 577 HB3 GLU 82 HB3 GLU 82 -7.329 8.965 6.697 578 HG2 GLU 82 HG2 GLU 82 -8.086 7.726 8.693 579 HG3 GLU 82 HG3 GLU 82 -6.559 8.084 9.494 580 HA PRO 83 HA PRO 83 -5.172 6.637 2.874 581 HB2 PRO 83 HB2 PRO 83 -7.401 6.966 1.363 582 HB3 PRO 83 HB3 PRO 83 -7.054 5.453 2.223 583 HG2 PRO 83 HG2 PRO 83 -8.867 7.693 3.000 584 HG3 PRO 83 HG3 PRO 83 -9.145 5.944 3.075 585 HD2 PRO 83 HD2 PRO 83 -8.424 7.398 5.264 586 HD3 PRO 83 HD3 PRO 83 -7.953 5.698 5.049 587 H GLU 84 H GLU 84 -4.673 8.054 1.133 588 HA GLU 84 HA GLU 84 -5.477 10.880 1.528 589 HB2 GLU 84 HB2 GLU 84 -3.120 10.470 2.198 590 HB3 GLU 84 HB3 GLU 84 -2.788 9.836 0.589 591 HG2 GLU 84 HG2 GLU 84 -2.071 12.170 0.705 592 HG3 GLU 84 HG3 GLU 84 -3.439 12.030 -0.390 593 H SER 85 H SER 85 -6.548 11.699 -0.151 594 HA SER 85 HA SER 85 -5.879 10.872 -2.882 595 HB2 SER 85 HB2 SER 85 -8.200 10.410 -3.450 596 HB3 SER 85 HB3 SER 85 -7.702 9.362 -2.123 597 HG SER 85 HG SER 85 -8.838 10.600 -0.717 598 H GLU 86 H GLU 86 -6.985 12.256 -4.502 599 HA GLU 86 HA GLU 86 -7.608 14.945 -3.445 600 HB2 GLU 86 HB2 GLU 86 -6.422 15.880 -5.470 601 HB3 GLU 86 HB3 GLU 86 -5.369 15.119 -4.286 602 HG2 GLU 86 HG2 GLU 86 -5.315 13.061 -5.653 603 HG3 GLU 86 HG3 GLU 86 -6.370 13.814 -6.842 604 HA PRO 87 HA PRO 87 -10.995 13.446 -6.316 605 HB2 PRO 87 HB2 PRO 87 -13.094 14.270 -4.772 606 HB3 PRO 87 HB3 PRO 87 -12.317 12.686 -4.582 607 HG2 PRO 87 HG2 PRO 87 -11.920 15.188 -3.005 608 HG3 PRO 87 HG3 PRO 87 -12.073 13.512 -2.444 609 HD2 PRO 87 HD2 PRO 87 -9.662 14.736 -2.653 610 HD3 PRO 87 HD3 PRO 87 -9.865 12.994 -2.947 611 H ALA 88 H ALA 88 -12.359 14.709 -7.642 612 HA ALA 88 HA ALA 88 -12.649 17.558 -7.189 613 HB1 ALA 88 HB1 ALA 88 -11.264 16.799 -9.740 614 HB2 ALA 88 HB2 ALA 88 -10.319 17.061 -8.274 615 HB3 ALA 88 HB3 ALA 88 -11.319 18.361 -8.920 616 H TYR 89 H TYR 89 -13.997 18.583 -8.824 617 HA TYR 89 HA TYR 89 -16.227 17.008 -9.563 618 HB2 TYR 89 HB2 TYR 89 -15.344 19.769 -10.425 619 HB3 TYR 89 HB3 TYR 89 -16.890 19.052 -10.881 620 HD1 TYR 89 HD1 TYR 89 -14.888 20.431 -8.123 621 HD2 TYR 89 HD2 TYR 89 -18.629 18.616 -9.207 622 HE1 TYR 89 HE1 TYR 89 -15.849 21.111 -5.942 623 HE2 TYR 89 HE2 TYR 89 -19.589 19.296 -7.024 624 HH TYR 89 HH TYR 89 -18.839 19.892 -4.791 625 H THR 90 H THR 90 -13.417 18.165 -11.373 626 HA THR 90 HA THR 90 -14.200 16.405 -13.611 627 HB THR 90 HB THR 90 -14.459 18.731 -14.308 628 HG1 THR 90 HG1 THR 90 -13.540 18.283 -16.133 629 HG21 THR 90 HG21 THR 90 -11.527 19.068 -13.606 630 HG22 THR 90 HG22 THR 90 -12.864 19.719 -12.659 631 HG23 THR 90 HG23 THR 90 -12.586 20.293 -14.304 632 HA PRO 91 HA PRO 91 -10.231 14.557 -12.564 633 HB2 PRO 91 HB2 PRO 91 -9.850 12.948 -14.735 634 HB3 PRO 91 HB3 PRO 91 -11.003 12.567 -13.441 635 HG2 PRO 91 HG2 PRO 91 -11.503 13.793 -16.116 636 HG3 PRO 91 HG3 PRO 91 -12.411 12.527 -15.269 637 HD2 PRO 91 HD2 PRO 91 -13.240 15.112 -15.298 638 HD3 PRO 91 HD3 PRO 91 -13.524 14.044 -13.906 639 HA PRO 92 HA PRO 92 -7.314 17.132 -14.803 640 HB2 PRO 92 HB2 PRO 92 -4.941 16.002 -14.135 641 HB3 PRO 92 HB3 PRO 92 -5.921 16.907 -12.964 642 HG2 PRO 92 HG2 PRO 92 -5.693 13.958 -13.358 643 HG3 PRO 92 HG3 PRO 92 -5.704 14.895 -11.853 644 HD2 PRO 92 HD2 PRO 92 -7.919 13.604 -12.788 645 HD3 PRO 92 HD3 PRO 92 -8.013 15.105 -11.838 646 HA PRO 93 HA PRO 93 -6.416 15.083 -18.675 647 HB2 PRO 93 HB2 PRO 93 -4.312 16.504 -19.660 648 HB3 PRO 93 HB3 PRO 93 -5.961 17.156 -19.590 649 HG2 PRO 93 HG2 PRO 93 -3.671 17.610 -17.732 650 HG3 PRO 93 HG3 PRO 93 -4.832 18.776 -18.396 651 HD2 PRO 93 HD2 PRO 93 -5.071 17.776 -15.879 652 HD3 PRO 93 HD3 PRO 93 -6.485 18.207 -16.866 653 H ALA 94 H ALA 94 -4.955 13.629 -19.720 654 HA ALA 94 HA ALA 94 -2.740 12.698 -17.994 655 HB1 ALA 94 HB1 ALA 94 -4.644 11.222 -19.804 656 HB2 ALA 94 HB2 ALA 94 -4.319 10.945 -18.092 657 HB3 ALA 94 HB3 ALA 94 -3.111 10.509 -19.302 658 H ALA 95 H ALA 95 -0.759 12.592 -18.778 659 HA ALA 95 HA ALA 95 -0.299 12.703 -21.665 660 HB1 ALA 95 HB1 ALA 95 1.324 14.608 -20.062 661 HB2 ALA 95 HB2 ALA 95 -0.372 15.035 -20.316 662 HB3 ALA 95 HB3 ALA 95 0.689 14.761 -21.704 663 HA PRO 96 HA PRO 96 2.485 9.761 -19.191 664 HB2 PRO 96 HB2 PRO 96 2.141 8.260 -21.756 665 HB3 PRO 96 HB3 PRO 96 2.120 7.659 -20.086 666 HG2 PRO 96 HG2 PRO 96 -0.130 7.886 -21.425 667 HG3 PRO 96 HG3 PRO 96 -0.056 8.372 -19.719 668 HD2 PRO 96 HD2 PRO 96 -0.045 10.112 -22.173 669 HD3 PRO 96 HD3 PRO 96 -0.890 10.354 -20.627 670 H VAL 97 H VAL 97 4.666 9.847 -19.316 671 HA VAL 97 HA VAL 97 5.912 10.675 -21.873 672 HB VAL 97 HB VAL 97 6.775 11.496 -19.079 673 HG11 VAL 97 HG11 VAL 97 8.256 13.074 -20.383 674 HG12 VAL 97 HG12 VAL 97 7.809 12.193 -21.843 675 HG13 VAL 97 HG13 VAL 97 8.688 11.373 -20.553 676 HG21 VAL 97 HG21 VAL 97 4.738 12.675 -19.672 677 HG22 VAL 97 HG22 VAL 97 5.356 13.020 -21.287 678 HG23 VAL 97 HG23 VAL 97 6.091 13.788 -19.880 679 H PHE 98 H PHE 98 6.090 8.697 -18.977 680 HA PHE 98 HA PHE 98 8.703 7.692 -19.233 681 HB2 PHE 98 HB2 PHE 98 6.204 6.473 -18.047 682 HB3 PHE 98 HB3 PHE 98 7.802 5.735 -17.918 683 HD1 PHE 98 HD1 PHE 98 5.643 8.487 -16.822 684 HD2 PHE 98 HD2 PHE 98 9.606 6.841 -16.649 685 HE1 PHE 98 HE1 PHE 98 6.172 9.966 -14.903 686 HE2 PHE 98 HE2 PHE 98 10.137 8.319 -14.730 687 HZ PHE 98 HZ PHE 98 8.419 9.882 -13.855 688 H ASP 99 H ASP 99 9.563 5.949 -20.251 689 HA ASP 99 HA ASP 99 8.088 4.941 -22.570 690 HB2 ASP 99 HB2 ASP 99 10.413 5.818 -22.822 691 HB3 ASP 99 HB3 ASP 99 10.986 4.495 -21.810 692 H ARG 100 H ARG 100 6.643 3.732 -21.032 693 HA ARG 100 HA ARG 100 5.922 1.806 -20.040 694 HB2 ARG 100 HB2 ARG 100 7.897 0.925 -22.105 695 HB3 ARG 100 HB3 ARG 100 7.306 -0.284 -20.969 696 HG2 ARG 100 HG2 ARG 100 5.789 -0.398 -22.786 697 HG3 ARG 100 HG3 ARG 100 4.942 0.555 -21.571 698 HD2 ARG 100 HD2 ARG 100 4.714 1.647 -23.736 699 HD3 ARG 100 HD3 ARG 100 5.739 2.633 -22.701 700 HE ARG 100 HE ARG 100 7.332 0.840 -24.229 701 HH11 ARG 100 HH11 ARG 100 5.441 3.772 -24.570 702 HH12 ARG 100 HH12 ARG 100 6.370 4.350 -25.914 703 HH21 ARG 100 HH21 ARG 100 8.514 1.631 -25.972 704 HH22 ARG 100 HH22 ARG 100 8.095 3.146 -26.699 705 H ASP 101 H ASP 101 8.489 3.249 -18.917 706 HA ASP 101 HA ASP 101 9.985 1.204 -17.598 707 HB2 ASP 101 HB2 ASP 101 10.858 3.489 -18.000 708 HB3 ASP 101 HB3 ASP 101 9.675 4.122 -16.857 709 H GLU 102 H GLU 102 7.491 3.475 -16.482 710 HA GLU 102 HA GLU 102 6.998 1.712 -14.151 711 HB2 GLU 102 HB2 GLU 102 6.626 4.687 -14.508 712 HB3 GLU 102 HB3 GLU 102 5.959 3.794 -13.143 713 HG2 GLU 102 HG2 GLU 102 8.160 3.086 -12.442 714 HG3 GLU 102 HG3 GLU 102 8.891 3.740 -13.902 715 H VAL 103 H VAL 103 5.526 0.328 -15.118 716 HA VAL 103 HA VAL 103 2.834 1.438 -15.418 717 HB VAL 103 HB VAL 103 2.415 0.094 -17.464 718 HG11 VAL 103 HG11 VAL 103 3.072 2.507 -17.570 719 HG12 VAL 103 HG12 VAL 103 3.550 1.597 -19.004 720 HG13 VAL 103 HG13 VAL 103 4.749 2.002 -17.776 721 HG21 VAL 103 HG21 VAL 103 4.284 -1.550 -17.075 722 HG22 VAL 103 HG22 VAL 103 5.429 -0.284 -17.526 723 HG23 VAL 103 HG23 VAL 103 4.265 -0.881 -18.708 724 H ALA 104 H ALA 104 1.151 -0.130 -15.022 725 HA ALA 104 HA ALA 104 0.252 -1.832 -13.789 726 HB1 ALA 104 HB1 ALA 104 0.693 -3.147 -15.723 727 HB2 ALA 104 HB2 ALA 104 1.243 -4.109 -14.352 728 HB3 ALA 104 HB3 ALA 104 2.414 -3.246 -15.351 729 H GLU 105 H GLU 105 1.360 -0.463 -11.974 730 HA GLU 105 HA GLU 105 3.665 -1.337 -10.670 731 HB2 GLU 105 HB2 GLU 105 2.795 -0.178 -8.679 732 HB3 GLU 105 HB3 GLU 105 2.584 0.789 -10.131 733 HG2 GLU 105 HG2 GLU 105 0.470 1.030 -9.240 734 HG3 GLU 105 HG3 GLU 105 0.198 -0.443 -10.164 735 H GLN 106 H GLN 106 0.282 -2.406 -10.202 736 HA GLN 106 HA GLN 106 0.988 -5.048 -9.508 737 HB2 GLN 106 HB2 GLN 106 1.807 -3.852 -7.427 738 HB3 GLN 106 HB3 GLN 106 0.131 -3.412 -7.108 739 HG2 GLN 106 HG2 GLN 106 -0.500 -5.786 -7.060 740 HG3 GLN 106 HG3 GLN 106 1.161 -6.247 -7.426 741 HE21 GLN 106 HE21 GLN 106 1.713 -7.270 -5.440 742 HE22 GLN 106 HE22 GLN 106 1.703 -6.465 -3.946 743 H LEU 107 H LEU 107 -1.311 -2.416 -9.180 744 HA LEU 107 HA LEU 107 -3.641 -4.078 -8.832 745 HB2 LEU 107 HB2 LEU 107 -3.255 -1.154 -9.521 746 HB3 LEU 107 HB3 LEU 107 -4.846 -1.901 -9.376 747 HG LEU 107 HG LEU 107 -2.772 -2.088 -7.181 748 HD11 LEU 107 HD11 LEU 107 -5.065 -0.115 -7.275 749 HD12 LEU 107 HD12 LEU 107 -3.434 0.309 -7.795 750 HD13 LEU 107 HD13 LEU 107 -3.729 -0.177 -6.128 751 HD21 LEU 107 HD21 LEU 107 -4.524 -3.721 -6.948 752 HD22 LEU 107 HD22 LEU 107 -5.765 -2.539 -7.362 753 HD23 LEU 107 HD23 LEU 107 -4.910 -2.417 -5.825 754 H VAL 108 H VAL 108 -2.259 -2.239 -11.471 755 HA VAL 108 HA VAL 108 -3.993 -3.658 -13.400 756 HB VAL 108 HB VAL 108 -4.198 -1.204 -13.370 757 HG11 VAL 108 HG11 VAL 108 -1.609 -1.002 -12.793 758 HG12 VAL 108 HG12 VAL 108 -2.453 0.277 -13.654 759 HG13 VAL 108 HG13 VAL 108 -1.458 -0.874 -14.545 760 HG21 VAL 108 HG21 VAL 108 -4.114 -0.887 -15.737 761 HG22 VAL 108 HG22 VAL 108 -4.427 -2.605 -15.492 762 HG23 VAL 108 HG23 VAL 108 -2.806 -2.055 -15.920 763 H GLY 109 H GLY 109 -3.064 -4.260 -15.471 764 HA2 GLY 109 HA2 GLY 109 -0.751 -4.417 -16.614 765 HA3 GLY 109 HA3 GLY 109 -0.317 -5.287 -15.149 766 H VAL 110 H VAL 110 -3.539 -5.641 -16.452 767 HA VAL 110 HA VAL 110 -2.867 -8.369 -17.379 768 HB VAL 110 HB VAL 110 -5.468 -7.336 -16.190 769 HG11 VAL 110 HG11 VAL 110 -6.086 -9.773 -16.204 770 HG12 VAL 110 HG12 VAL 110 -4.647 -10.086 -17.173 771 HG13 VAL 110 HG13 VAL 110 -5.939 -9.073 -17.816 772 HG21 VAL 110 HG21 VAL 110 -3.796 -7.590 -14.455 773 HG22 VAL 110 HG22 VAL 110 -3.295 -9.154 -15.101 774 HG23 VAL 110 HG23 VAL 110 -4.886 -8.972 -14.359 775 H SER 111 H SER 111 -3.401 -8.891 -19.440 776 HA SER 111 HA SER 111 -4.090 -6.872 -21.310 777 HB2 SER 111 HB2 SER 111 -4.093 -9.888 -21.545 778 HB3 SER 111 HB3 SER 111 -4.329 -8.790 -22.902 779 HG SER 111 HG SER 111 -2.140 -9.406 -22.667 780 H ALA 112 H ALA 112 -5.933 -9.499 -19.810 781 HA ALA 112 HA ALA 112 -8.410 -8.069 -19.996 782 HB1 ALA 112 HB1 ALA 112 -8.659 -8.699 -22.217 783 HB2 ALA 112 HB2 ALA 112 -9.441 -10.045 -21.389 784 HB3 ALA 112 HB3 ALA 112 -7.792 -10.218 -21.992 785 H ALA 113 H ALA 113 -10.188 -9.260 -19.009 786 HA ALA 113 HA ALA 113 -9.523 -11.754 -17.640 787 HB1 ALA 113 HB1 ALA 113 -10.617 -9.524 -15.962 788 HB2 ALA 113 HB2 ALA 113 -8.877 -9.638 -16.232 789 HB3 ALA 113 HB3 ALA 113 -9.739 -10.970 -15.463 790 H SER 114 H SER 114 -11.319 -12.964 -17.081 791 HA SER 114 HA SER 114 -13.992 -11.865 -17.235 792 HB2 SER 114 HB2 SER 114 -14.752 -13.234 -19.087 793 HB3 SER 114 HB3 SER 114 -13.405 -12.236 -19.627 794 HG SER 114 HG SER 114 -13.600 -14.970 -19.321 795 H ALA 115 H ALA 115 -15.651 -13.534 -16.790 796 HA ALA 115 HA ALA 115 -14.720 -16.050 -15.657 797 HB1 ALA 115 HB1 ALA 115 -14.506 -14.990 -13.625 798 HB2 ALA 115 HB2 ALA 115 -16.232 -15.356 -13.570 799 HB3 ALA 115 HB3 ALA 115 -15.685 -13.743 -14.030 800 H ALA 116 H ALA 116 -16.451 -17.532 -15.273 801 HA ALA 116 HA ALA 116 -19.101 -16.708 -16.226 802 HB1 ALA 116 HB1 ALA 116 -17.843 -19.239 -17.271 803 HB2 ALA 116 HB2 ALA 116 -17.648 -17.700 -18.109 804 HB3 ALA 116 HB3 ALA 116 -19.259 -18.380 -17.880 805 H ALA 117 H ALA 117 -17.922 -17.469 -13.605 806 HA ALA 117 HA ALA 117 -18.494 -20.040 -12.751 807 HB1 ALA 117 HB1 ALA 117 -19.003 -17.524 -11.151 808 HB2 ALA 117 HB2 ALA 117 -17.413 -18.248 -11.383 809 HB3 ALA 117 HB3 ALA 117 -18.669 -19.134 -10.517 810 H SER 118 H SER 118 -20.250 -21.210 -12.497 811 HA SER 118 HA SER 118 -22.830 -20.081 -11.864 812 HB2 SER 118 HB2 SER 118 -22.798 -19.734 -14.296 813 HB3 SER 118 HB3 SER 118 -22.408 -21.434 -14.542 814 HG SER 118 HG SER 118 -24.775 -20.418 -14.402 815 H ALA 119 H ALA 119 -24.231 -21.616 -11.032 816 HA ALA 119 HA ALA 119 -23.012 -24.239 -10.524 817 HB1 ALA 119 HB1 ALA 119 -25.364 -22.855 -9.205 818 HB2 ALA 119 HB2 ALA 119 -23.733 -22.989 -8.548 819 HB3 ALA 119 HB3 ALA 119 -24.728 -24.433 -8.742 820 H PHE 120 H PHE 120 -23.986 -26.146 -11.114 821 HA PHE 120 HA PHE 120 -26.674 -26.265 -12.116 822 HB2 PHE 120 HB2 PHE 120 -26.109 -26.954 -14.422 823 HB3 PHE 120 HB3 PHE 120 -25.617 -25.292 -14.096 824 HD1 PHE 120 HD1 PHE 120 -24.458 -28.738 -14.690 825 HD2 PHE 120 HD2 PHE 120 -23.247 -24.698 -13.877 826 HE1 PHE 120 HE1 PHE 120 -22.126 -29.310 -15.313 827 HE2 PHE 120 HE2 PHE 120 -20.917 -25.270 -14.501 828 HZ PHE 120 HZ PHE 120 -20.355 -27.576 -15.220 829 H GLY 121 H GLY 121 -27.321 -28.440 -12.719 830 HA2 GLY 121 HA2 GLY 121 -25.472 -30.623 -12.130 831 HA3 GLY 121 HA3 GLY 121 -26.845 -30.449 -11.039 832 H SER 122 H SER 122 -26.331 -32.701 -12.734 833 HA SER 122 HA SER 122 -28.904 -32.900 -14.026 834 HB2 SER 122 HB2 SER 122 -26.384 -32.974 -15.696 835 HB3 SER 122 HB3 SER 122 -27.968 -33.504 -16.251 836 HG SER 122 HG SER 122 -27.039 -30.931 -15.624 837 H LEU 123 H LEU 123 -29.476 -34.753 -13.057 838 HA LEU 123 HA LEU 123 -27.719 -36.839 -12.308 839 HB2 LEU 123 HB2 LEU 123 -29.945 -36.497 -11.283 840 HB3 LEU 123 HB3 LEU 123 -30.710 -36.938 -12.805 841 HG LEU 123 HG LEU 123 -29.592 -39.188 -12.652 842 HD11 LEU 123 HD11 LEU 123 -27.714 -38.646 -11.201 843 HD12 LEU 123 HD12 LEU 123 -28.719 -39.849 -10.394 844 HD13 LEU 123 HD13 LEU 123 -28.808 -38.157 -9.908 845 HD21 LEU 123 HD21 LEU 123 -31.364 -38.360 -10.333 846 HD22 LEU 123 HD22 LEU 123 -31.074 -40.027 -10.829 847 HD23 LEU 123 HD23 LEU 123 -31.906 -38.915 -11.917 848 H SER 124 H SER 124 -29.878 -36.434 -15.106 849 HA SER 124 HA SER 124 -28.488 -38.684 -16.445 850 HB2 SER 124 HB2 SER 124 -30.548 -38.981 -17.760 851 HB3 SER 124 HB3 SER 124 -30.854 -39.157 -16.034 852 HG SER 124 HG SER 124 -32.395 -37.777 -16.706 853 H SER 125 H SER 125 -29.397 -35.337 -16.649 854 HA SER 125 HA SER 125 -28.905 -33.667 -18.116 855 HB2 SER 125 HB2 SER 125 -26.917 -35.667 -19.233 856 HB3 SER 125 HB3 SER 125 -26.955 -33.944 -19.600 857 HG SER 125 HG SER 125 -26.196 -35.285 -17.271 858 H ALA 126 H ALA 126 -31.088 -35.354 -18.571 859 HA ALA 126 HA ALA 126 -31.175 -35.519 -21.503 860 HB1 ALA 126 HB1 ALA 126 -31.818 -37.641 -21.046 861 HB2 ALA 126 HB2 ALA 126 -33.383 -36.905 -20.677 862 HB3 ALA 126 HB3 ALA 126 -32.235 -37.251 -19.377 863 H LEU 127 H LEU 127 -32.656 -34.360 -22.605 864 HA LEU 127 HA LEU 127 -34.893 -33.156 -21.166 865 HB2 LEU 127 HB2 LEU 127 -32.836 -31.577 -22.728 866 HB3 LEU 127 HB3 LEU 127 -34.420 -30.940 -22.294 867 HG LEU 127 HG LEU 127 -32.470 -32.038 -20.249 868 HD11 LEU 127 HD11 LEU 127 -32.048 -29.609 -19.733 869 HD12 LEU 127 HD12 LEU 127 -32.902 -29.201 -21.221 870 HD13 LEU 127 HD13 LEU 127 -31.404 -30.130 -21.289 871 HD21 LEU 127 HD21 LEU 127 -35.009 -30.382 -20.107 872 HD22 LEU 127 HD22 LEU 127 -33.910 -30.580 -18.741 873 HD23 LEU 127 HD23 LEU 127 -34.735 -31.984 -19.417 874 H LEU 128 H LEU 128 -36.713 -32.868 -22.413 875 HA LEU 128 HA LEU 128 -36.538 -33.838 -25.205 876 HB2 LEU 128 HB2 LEU 128 -38.645 -34.085 -23.069 877 HB3 LEU 128 HB3 LEU 128 -39.097 -34.176 -24.770 878 HG LEU 128 HG LEU 128 -37.249 -35.950 -25.000 879 HD11 LEU 128 HD11 LEU 128 -36.834 -37.166 -22.796 880 HD12 LEU 128 HD12 LEU 128 -37.472 -35.735 -21.989 881 HD13 LEU 128 HD13 LEU 128 -36.015 -35.616 -22.973 882 HD21 LEU 128 HD21 LEU 128 -38.735 -37.732 -24.220 883 HD22 LEU 128 HD22 LEU 128 -39.696 -36.445 -24.947 884 HD23 LEU 128 HD23 LEU 128 -39.601 -36.592 -23.190 885 H MET 129 H MET 129 -37.400 -32.641 -26.838 886 HA MET 129 HA MET 129 -38.311 -29.922 -26.134 887 HB2 MET 129 HB2 MET 129 -37.125 -30.994 -28.709 888 HB3 MET 129 HB3 MET 129 -37.687 -29.341 -28.473 889 HG2 MET 129 HG2 MET 129 -35.382 -29.173 -28.048 890 HG3 MET 129 HG3 MET 129 -36.061 -29.330 -26.428 891 HE1 MET 129 HE1 MET 129 -33.164 -29.708 -26.906 892 HE2 MET 129 HE2 MET 129 -32.714 -31.242 -26.169 893 HE3 MET 129 HE3 MET 129 -33.820 -30.158 -25.327 894 HA PRO 130 HA PRO 130 -42.291 -31.006 -27.847 895 HB2 PRO 130 HB2 PRO 130 -43.419 -28.586 -28.212 896 HB3 PRO 130 HB3 PRO 130 -43.045 -29.201 -26.587 897 HG2 PRO 130 HG2 PRO 130 -41.566 -27.224 -28.253 898 HG3 PRO 130 HG3 PRO 130 -41.886 -27.217 -26.509 899 HD2 PRO 130 HD2 PRO 130 -39.495 -28.041 -27.661 900 HD3 PRO 130 HD3 PRO 130 -40.054 -28.520 -26.044 901 H LYS 131 H LYS 131 -41.067 -31.841 -29.797 902 HA LYS 131 HA LYS 131 -40.655 -30.318 -32.130 903 HB2 LYS 131 HB2 LYS 131 -41.178 -33.272 -31.746 904 HB3 LYS 131 HB3 LYS 131 -40.721 -32.557 -33.290 905 HG2 LYS 131 HG2 LYS 131 -39.071 -32.234 -30.768 906 HG3 LYS 131 HG3 LYS 131 -38.799 -33.525 -31.938 907 HD2 LYS 131 HD2 LYS 131 -38.477 -31.790 -33.713 908 HD3 LYS 131 HD3 LYS 131 -38.629 -30.541 -32.477 909 HE2 LYS 131 HE2 LYS 131 -36.700 -31.488 -31.270 910 HE3 LYS 131 HE3 LYS 131 -36.544 -32.739 -32.501 911 HZ1 LYS 131 HZ1 LYS 131 -36.274 -29.811 -32.915 912 HZ2 LYS 131 HZ2 LYS 131 -36.237 -30.969 -34.157 913 HZ3 LYS 131 HZ3 LYS 131 -35.025 -30.957 -32.966 914 H ASP 132 H ASP 132 -43.449 -32.172 -30.996 915 HA ASP 132 HA ASP 132 -45.090 -30.858 -33.083 916 HB2 ASP 132 HB2 ASP 132 -45.363 -33.715 -32.120 917 HB3 ASP 132 HB3 ASP 132 -46.416 -32.911 -33.282 918 H GLY 133 H GLY 133 -46.561 -29.588 -32.176 919 HA2 GLY 133 HA2 GLY 133 -48.093 -30.521 -29.870 920 HA3 GLY 133 HA3 GLY 133 -47.165 -29.043 -29.639 921 H LEU 134 H LEU 134 -50.140 -29.752 -29.845 922 HA LEU 134 HA LEU 134 -51.050 -27.324 -30.938 923 HB2 LEU 134 HB2 LEU 134 -50.402 -28.782 -33.043 924 HB3 LEU 134 HB3 LEU 134 -51.924 -29.600 -32.702 925 HG LEU 134 HG LEU 134 -51.759 -26.587 -32.904 926 HD11 LEU 134 HD11 LEU 134 -50.924 -27.440 -35.024 927 HD12 LEU 134 HD12 LEU 134 -52.576 -26.867 -35.255 928 HD13 LEU 134 HD13 LEU 134 -52.254 -28.596 -35.121 929 HD21 LEU 134 HD21 LEU 134 -53.791 -27.347 -31.892 930 HD22 LEU 134 HD22 LEU 134 -53.964 -28.658 -33.057 931 HD23 LEU 134 HD23 LEU 134 -54.199 -26.988 -33.568 932 H GLU 135 H GLU 135 -52.556 -27.054 -29.382 933 HA GLU 135 HA GLU 135 -54.848 -28.818 -29.328 934 HB2 GLU 135 HB2 GLU 135 -54.714 -29.267 -26.901 935 HB3 GLU 135 HB3 GLU 135 -53.373 -29.997 -27.776 936 HG2 GLU 135 HG2 GLU 135 -51.938 -28.065 -27.152 937 HG3 GLU 135 HG3 GLU 135 -53.279 -27.383 -26.235 938 H HIS 136 H HIS 136 -56.601 -27.960 -28.011 939 HA HIS 136 HA HIS 136 -56.367 -25.276 -26.957 940 HB2 HIS 136 HB2 HIS 136 -58.034 -24.277 -28.468 941 HB3 HIS 136 HB3 HIS 136 -56.600 -24.791 -29.350 942 HD2 HIS 136 HD2 HIS 136 -60.406 -25.444 -29.355 943 HE1 HIS 136 HE1 HIS 136 -58.681 -28.325 -31.917 944 HE2 HIS 136 HE2 HIS 136 -60.867 -27.293 -31.141 945 H HIS 137 H HIS 137 -58.429 -24.504 -26.030 946 HA HIS 137 HA HIS 137 -60.536 -26.462 -25.621 947 HB2 HIS 137 HB2 HIS 137 -58.748 -27.063 -23.954 948 HB3 HIS 137 HB3 HIS 137 -58.958 -25.466 -23.237 949 HD2 HIS 137 HD2 HIS 137 -60.863 -25.484 -21.245 950 HE1 HIS 137 HE1 HIS 137 -63.055 -28.859 -22.521 951 HE2 HIS 137 HE2 HIS 137 -62.861 -27.080 -20.719 952 H HIS 138 H HIS 138 -62.450 -25.521 -25.070 953 HA HIS 138 HA HIS 138 -62.456 -22.652 -24.371 954 HB2 HIS 138 HB2 HIS 138 -64.135 -23.994 -26.502 955 HB3 HIS 138 HB3 HIS 138 -64.409 -22.360 -25.903 956 HD2 HIS 138 HD2 HIS 138 -62.656 -20.420 -26.934 957 HE1 HIS 138 HE1 HIS 138 -60.260 -23.056 -29.202 958 HE2 HIS 138 HE2 HIS 138 -60.744 -20.613 -28.702 959 H HIS 139 H HIS 139 -64.204 -21.961 -23.125 960 HA HIS 139 HA HIS 139 -66.181 -23.943 -22.255 961 HB2 HIS 139 HB2 HIS 139 -64.239 -24.145 -20.699 962 HB3 HIS 139 HB3 HIS 139 -64.414 -22.440 -20.300 963 HD2 HIS 139 HD2 HIS 139 -66.172 -21.998 -18.207 964 HE1 HIS 139 HE1 HIS 139 -68.181 -25.710 -18.321 965 HE2 HIS 139 HE2 HIS 139 -67.969 -23.510 -17.067 966 H HIS 140 H HIS 140 -68.130 -23.034 -22.057 967 HA HIS 140 HA HIS 140 -68.586 -20.303 -22.679 968 HB2 HIS 140 HB2 HIS 140 -70.193 -22.201 -23.083 969 HB3 HIS 140 HB3 HIS 140 -70.513 -22.226 -21.350 970 HD2 HIS 140 HD2 HIS 140 -72.582 -20.536 -20.659 971 HE1 HIS 140 HE1 HIS 140 -72.392 -17.943 -23.986 972 HE2 HIS 140 HE2 HIS 140 -73.658 -18.477 -21.851 973 H HIS 141 H HIS 141 -68.964 -18.552 -21.413 974 HA HIS 141 HA HIS 141 -69.278 -18.842 -18.523 975 HB2 HIS 141 HB2 HIS 141 -66.798 -18.763 -18.995 976 HB3 HIS 141 HB3 HIS 141 -67.041 -17.151 -19.663 977 HD2 HIS 141 HD2 HIS 141 -66.794 -15.194 -17.736 978 HE1 HIS 141 HE1 HIS 141 -67.683 -17.554 -14.351 979 HE2 HIS 141 HE2 HIS 141 -67.005 -15.235 -15.134 Start of MODEL 6 1 H1 MET 1 HT1 MET 1 1.348 2.448 -12.597 2 H2 MET 1 HT2 MET 1 2.785 2.170 -11.734 3 H3 MET 1 HT3 MET 1 2.569 1.487 -13.276 4 HA MET 1 HA MET 1 2.556 3.673 -14.284 5 HB2 MET 1 HB2 MET 1 1.855 4.524 -11.754 6 HB3 MET 1 HB3 MET 1 3.558 4.974 -11.805 7 HG2 MET 1 HG2 MET 1 2.224 6.844 -12.620 8 HG3 MET 1 HG3 MET 1 3.128 6.165 -13.973 9 HE1 MET 1 HE1 MET 1 0.031 7.079 -15.934 10 HE2 MET 1 HE2 MET 1 1.782 7.146 -15.755 11 HE3 MET 1 HE3 MET 1 0.755 8.024 -14.626 12 H SER 2 H SER 2 4.758 5.164 -14.133 13 HA SER 2 HA SER 2 6.890 3.323 -14.606 14 HB2 SER 2 HB2 SER 2 8.202 5.271 -15.150 15 HB3 SER 2 HB3 SER 2 6.583 5.504 -15.806 16 HG SER 2 HG SER 2 7.725 6.605 -13.459 17 H ASP 3 H ASP 3 9.057 3.553 -13.587 18 HA ASP 3 HA ASP 3 8.817 3.339 -10.719 19 HB2 ASP 3 HB2 ASP 3 11.152 2.671 -10.778 20 HB3 ASP 3 HB3 ASP 3 10.273 1.833 -12.050 21 H GLN 4 H GLN 4 10.776 4.363 -9.449 22 HA GLN 4 HA GLN 4 11.541 6.288 -8.451 23 HB2 GLN 4 HB2 GLN 4 11.913 7.036 -11.364 24 HB3 GLN 4 HB3 GLN 4 12.603 7.928 -10.006 25 HG2 GLN 4 HG2 GLN 4 13.797 5.890 -9.277 26 HG3 GLN 4 HG3 GLN 4 13.120 5.009 -10.645 27 HE21 GLN 4 HE21 GLN 4 14.997 4.673 -11.912 28 HE22 GLN 4 HE22 GLN 4 15.969 5.935 -12.499 29 H SER 5 H SER 5 8.672 6.071 -9.037 30 HA SER 5 HA SER 5 7.707 8.681 -9.791 31 HB2 SER 5 HB2 SER 5 6.389 6.224 -8.648 32 HB3 SER 5 HB3 SER 5 5.509 7.716 -8.950 33 HG SER 5 HG SER 5 7.065 6.312 -10.867 34 H GLN 6 H GLN 6 7.821 10.402 -8.519 35 HA GLN 6 HA GLN 6 8.086 10.147 -5.637 36 HB2 GLN 6 HB2 GLN 6 8.015 12.529 -7.497 37 HB3 GLN 6 HB3 GLN 6 8.167 12.667 -5.745 38 HG2 GLN 6 HG2 GLN 6 10.233 11.410 -5.762 39 HG3 GLN 6 HG3 GLN 6 10.043 11.030 -7.473 40 HE21 GLN 6 HE21 GLN 6 12.233 12.587 -6.045 41 HE22 GLN 6 HE22 GLN 6 12.295 14.080 -6.850 42 H GLU 7 H GLU 7 5.733 11.455 -7.964 43 HA GLU 7 HA GLU 7 3.796 11.852 -5.795 44 HB2 GLU 7 HB2 GLU 7 3.878 12.812 -8.651 45 HB3 GLU 7 HB3 GLU 7 2.438 12.956 -7.650 46 HG2 GLU 7 HG2 GLU 7 3.729 14.227 -5.978 47 HG3 GLU 7 HG3 GLU 7 5.173 14.075 -6.975 48 HA PRO 8 HA PRO 8 1.344 8.854 -8.577 49 HB2 PRO 8 HB2 PRO 8 2.521 7.566 -10.668 50 HB3 PRO 8 HB3 PRO 8 1.756 9.159 -10.827 51 HG2 PRO 8 HG2 PRO 8 4.623 8.443 -10.674 52 HG3 PRO 8 HG3 PRO 8 3.824 9.736 -11.575 53 HD2 PRO 8 HD2 PRO 8 5.185 10.085 -9.171 54 HD3 PRO 8 HD3 PRO 8 3.987 11.208 -9.844 55 H THR 9 H THR 9 1.904 7.960 -6.465 56 HA THR 9 HA THR 9 3.773 5.710 -6.402 57 HB THR 9 HB THR 9 3.232 5.620 -3.998 58 HG1 THR 9 HG1 THR 9 1.125 6.275 -3.994 59 HG21 THR 9 HG21 THR 9 4.937 7.250 -4.985 60 HG22 THR 9 HG22 THR 9 4.331 7.639 -3.376 61 HG23 THR 9 HG23 THR 9 3.707 8.499 -4.784 62 H MET 10 H MET 10 2.828 3.787 -5.004 63 HA MET 10 HA MET 10 1.039 2.387 -6.618 64 HB2 MET 10 HB2 MET 10 1.808 1.991 -3.721 65 HB3 MET 10 HB3 MET 10 0.817 0.843 -4.622 66 HG2 MET 10 HG2 MET 10 2.655 0.735 -6.346 67 HG3 MET 10 HG3 MET 10 3.651 1.703 -5.260 68 HE1 MET 10 HE1 MET 10 4.365 -0.412 -2.256 69 HE2 MET 10 HE2 MET 10 3.069 0.773 -2.385 70 HE3 MET 10 HE3 MET 10 4.613 1.079 -3.175 71 H GLU 11 H GLU 11 0.427 4.296 -3.691 72 HA GLU 11 HA GLU 11 -2.345 3.653 -3.430 73 HB2 GLU 11 HB2 GLU 11 -1.028 4.772 -1.636 74 HB3 GLU 11 HB3 GLU 11 -0.893 6.207 -2.651 75 HG2 GLU 11 HG2 GLU 11 -3.347 6.451 -2.649 76 HG3 GLU 11 HG3 GLU 11 -3.494 5.008 -1.649 77 H GLU 12 H GLU 12 -0.645 6.372 -4.856 78 HA GLU 12 HA GLU 12 -2.709 7.814 -5.967 79 HB2 GLU 12 HB2 GLU 12 -0.260 8.429 -5.980 80 HB3 GLU 12 HB3 GLU 12 -0.068 7.375 -7.378 81 HG2 GLU 12 HG2 GLU 12 -2.171 9.541 -7.365 82 HG3 GLU 12 HG3 GLU 12 -0.503 9.910 -7.788 83 H ILE 13 H ILE 13 -0.970 5.096 -7.557 84 HA ILE 13 HA ILE 13 -2.351 5.131 -9.976 85 HB ILE 13 HB ILE 13 -1.099 2.824 -8.439 86 HG12 ILE 13 HG12 ILE 13 -0.050 4.336 -10.849 87 HG13 ILE 13 HG13 ILE 13 0.305 4.840 -9.199 88 HG21 ILE 13 HG21 ILE 13 -1.005 1.713 -10.708 89 HG22 ILE 13 HG22 ILE 13 -2.069 2.981 -11.317 90 HG23 ILE 13 HG23 ILE 13 -2.642 1.873 -10.071 91 HD11 ILE 13 HD11 ILE 13 1.206 2.522 -8.765 92 HD12 ILE 13 HD12 ILE 13 2.134 3.446 -9.947 93 HD13 ILE 13 HD13 ILE 13 1.019 2.190 -10.487 94 H LEU 14 H LEU 14 -3.127 3.413 -6.925 95 HA LEU 14 HA LEU 14 -5.398 2.031 -7.852 96 HB2 LEU 14 HB2 LEU 14 -4.304 1.551 -5.686 97 HB3 LEU 14 HB3 LEU 14 -4.837 3.109 -5.070 98 HG LEU 14 HG LEU 14 -7.214 2.387 -5.439 99 HD11 LEU 14 HD11 LEU 14 -7.070 0.714 -7.123 100 HD12 LEU 14 HD12 LEU 14 -7.496 -0.171 -5.657 101 HD13 LEU 14 HD13 LEU 14 -5.833 -0.182 -6.243 102 HD21 LEU 14 HD21 LEU 14 -5.407 0.757 -3.640 103 HD22 LEU 14 HD22 LEU 14 -7.164 0.636 -3.569 104 HD23 LEU 14 HD23 LEU 14 -6.369 2.171 -3.216 105 H ALA 15 H ALA 15 -5.062 5.237 -6.357 106 HA ALA 15 HA ALA 15 -7.788 5.931 -6.273 107 HB1 ALA 15 HB1 ALA 15 -5.632 7.099 -5.289 108 HB2 ALA 15 HB2 ALA 15 -7.071 8.044 -5.675 109 HB3 ALA 15 HB3 ALA 15 -5.708 8.018 -6.793 110 H SER 16 H SER 16 -5.358 6.298 -8.801 111 HA SER 16 HA SER 16 -6.838 7.920 -10.579 112 HB2 SER 16 HB2 SER 16 -4.701 5.852 -11.136 113 HB3 SER 16 HB3 SER 16 -5.335 6.969 -12.342 114 HG SER 16 HG SER 16 -4.434 8.634 -11.294 115 H ILE 17 H ILE 17 -6.532 4.380 -10.370 116 HA ILE 17 HA ILE 17 -8.241 3.747 -12.524 117 HB ILE 17 HB ILE 17 -7.508 2.176 -10.026 118 HG12 ILE 17 HG12 ILE 17 -6.527 1.853 -12.876 119 HG13 ILE 17 HG13 ILE 17 -5.710 2.893 -11.710 120 HG21 ILE 17 HG21 ILE 17 -9.560 1.219 -10.927 121 HG22 ILE 17 HG22 ILE 17 -8.220 0.179 -11.407 122 HG23 ILE 17 HG23 ILE 17 -8.926 1.301 -12.572 123 HD11 ILE 17 HD11 ILE 17 -6.277 -0.043 -11.217 124 HD12 ILE 17 HD12 ILE 17 -5.268 1.026 -10.243 125 HD13 ILE 17 HD13 ILE 17 -4.753 0.562 -11.864 126 H ARG 18 H ARG 18 -8.852 4.094 -9.044 127 HA ARG 18 HA ARG 18 -10.782 4.311 -7.821 128 HB2 ARG 18 HB2 ARG 18 -10.842 6.442 -9.066 129 HB3 ARG 18 HB3 ARG 18 -11.713 5.656 -10.376 130 HG2 ARG 18 HG2 ARG 18 -13.322 6.848 -9.010 131 HG3 ARG 18 HG3 ARG 18 -13.561 5.123 -8.747 132 HD2 ARG 18 HD2 ARG 18 -12.203 5.270 -6.669 133 HD3 ARG 18 HD3 ARG 18 -12.019 7.001 -6.930 134 HE ARG 18 HE ARG 18 -14.217 7.307 -6.218 135 HH11 ARG 18 HH11 ARG 18 -13.622 3.892 -6.749 136 HH12 ARG 18 HH12 ARG 18 -15.113 3.402 -6.011 137 HH21 ARG 18 HH21 ARG 18 -16.139 6.624 -5.266 138 HH22 ARG 18 HH22 ARG 18 -16.523 4.935 -5.180 139 H ARG 19 H ARG 19 -10.880 1.913 -8.029 140 HA ARG 19 HA ARG 19 -13.142 0.975 -9.682 141 HB2 ARG 19 HB2 ARG 19 -10.939 -0.183 -9.948 142 HB3 ARG 19 HB3 ARG 19 -11.022 -0.656 -8.253 143 HG2 ARG 19 HG2 ARG 19 -13.123 -1.870 -8.682 144 HG3 ARG 19 HG3 ARG 19 -13.066 -1.383 -10.376 145 HD2 ARG 19 HD2 ARG 19 -10.900 -2.560 -10.626 146 HD3 ARG 19 HD3 ARG 19 -11.001 -3.078 -8.946 147 HE ARG 19 HE ARG 19 -12.516 -4.143 -11.188 148 HH11 ARG 19 HH11 ARG 19 -12.296 -3.869 -7.699 149 HH12 ARG 19 HH12 ARG 19 -13.282 -5.264 -7.413 150 HH21 ARG 19 HH21 ARG 19 -13.795 -5.947 -10.769 151 HH22 ARG 19 HH22 ARG 19 -14.123 -6.429 -9.138 152 H ILE 20 H ILE 20 -14.995 0.369 -8.743 153 HA ILE 20 HA ILE 20 -15.618 0.935 -6.081 154 HB ILE 20 HB ILE 20 -17.671 -0.411 -6.445 155 HG12 ILE 20 HG12 ILE 20 -16.532 -1.052 -9.185 156 HG13 ILE 20 HG13 ILE 20 -16.453 -2.186 -7.839 157 HG21 ILE 20 HG21 ILE 20 -18.402 0.862 -8.533 158 HG22 ILE 20 HG22 ILE 20 -16.743 1.450 -8.644 159 HG23 ILE 20 HG23 ILE 20 -17.727 1.846 -7.234 160 HD11 ILE 20 HD11 ILE 20 -18.421 -2.706 -9.168 161 HD12 ILE 20 HD12 ILE 20 -18.963 -1.030 -9.087 162 HD13 ILE 20 HD13 ILE 20 -18.951 -2.025 -7.630 163 H ILE 21 H ILE 21 -15.705 -0.228 -4.214 164 HA ILE 21 HA ILE 21 -14.535 -2.949 -4.260 165 HB ILE 21 HB ILE 21 -14.076 -0.792 -2.166 166 HG12 ILE 21 HG12 ILE 21 -12.068 -2.067 -4.054 167 HG13 ILE 21 HG13 ILE 21 -12.896 -0.559 -4.432 168 HG21 ILE 21 HG21 ILE 21 -14.012 -2.891 -1.034 169 HG22 ILE 21 HG22 ILE 21 -12.325 -2.549 -1.412 170 HG23 ILE 21 HG23 ILE 21 -13.234 -3.695 -2.396 171 HD11 ILE 21 HD11 ILE 21 -11.005 -1.105 -2.131 172 HD12 ILE 21 HD12 ILE 21 -12.033 0.327 -2.199 173 HD13 ILE 21 HD13 ILE 21 -10.807 0.062 -3.438 174 H SER 22 H SER 22 -15.633 -4.480 -3.209 175 HA SER 22 HA SER 22 -17.988 -3.666 -1.601 176 HB2 SER 22 HB2 SER 22 -18.659 -4.824 -3.637 177 HB3 SER 22 HB3 SER 22 -17.554 -6.148 -3.282 178 HG SER 22 HG SER 22 -18.777 -6.632 -1.466 179 H GLU 23 H GLU 23 -17.589 -3.913 0.499 180 HA GLU 23 HA GLU 23 -16.293 -6.399 1.417 181 HB2 GLU 23 HB2 GLU 23 -14.609 -4.567 1.407 182 HB3 GLU 23 HB3 GLU 23 -15.658 -3.623 2.464 183 HG2 GLU 23 HG2 GLU 23 -13.956 -4.753 3.807 184 HG3 GLU 23 HG3 GLU 23 -15.537 -5.437 4.167 185 H ASP 24 H ASP 24 -17.151 -7.263 3.240 186 HA ASP 24 HA ASP 24 -19.622 -6.043 4.253 187 HB2 ASP 24 HB2 ASP 24 -18.471 -8.810 4.664 188 HB3 ASP 24 HB3 ASP 24 -20.038 -8.255 5.254 189 H ASP 25 H ASP 25 -16.398 -6.930 5.260 190 HA ASP 25 HA ASP 25 -16.984 -6.328 8.070 191 HB2 ASP 25 HB2 ASP 25 -14.472 -7.394 6.760 192 HB3 ASP 25 HB3 ASP 25 -14.717 -7.200 8.494 193 H ALA 26 H ALA 26 -16.802 -4.247 5.861 194 HA ALA 26 HA ALA 26 -14.403 -2.744 6.407 195 HB1 ALA 26 HB1 ALA 26 -16.045 -0.970 5.163 196 HB2 ALA 26 HB2 ALA 26 -16.757 -2.498 4.647 197 HB3 ALA 26 HB3 ALA 26 -15.060 -2.160 4.314 198 HA PRO 27 HA PRO 27 -16.416 -0.925 10.089 199 HB2 PRO 27 HB2 PRO 27 -14.318 0.461 11.078 200 HB3 PRO 27 HB3 PRO 27 -14.429 -1.306 11.207 201 HG2 PRO 27 HG2 PRO 27 -12.884 0.354 9.266 202 HG3 PRO 27 HG3 PRO 27 -12.387 -1.099 10.153 203 HD2 PRO 27 HD2 PRO 27 -13.207 -1.164 7.544 204 HD3 PRO 27 HD3 PRO 27 -13.419 -2.530 8.660 205 H ALA 28 H ALA 28 -15.059 0.753 7.408 206 HA ALA 28 HA ALA 28 -15.351 3.438 8.168 207 HB1 ALA 28 HB1 ALA 28 -15.640 2.195 5.427 208 HB2 ALA 28 HB2 ALA 28 -14.138 2.758 6.159 209 HB3 ALA 28 HB3 ALA 28 -15.408 3.913 5.752 210 H GLU 29 H GLU 29 -17.698 1.188 6.731 211 HA GLU 29 HA GLU 29 -19.906 2.681 7.789 212 HB2 GLU 29 HB2 GLU 29 -20.981 3.145 5.564 213 HB3 GLU 29 HB3 GLU 29 -19.558 4.129 5.888 214 HG2 GLU 29 HG2 GLU 29 -18.187 2.590 4.512 215 HG3 GLU 29 HG3 GLU 29 -19.618 1.618 4.177 216 HA PRO 30 HA PRO 30 -20.260 -1.955 6.861 217 HB2 PRO 30 HB2 PRO 30 -21.011 -2.658 9.419 218 HB3 PRO 30 HB3 PRO 30 -19.342 -2.685 8.826 219 HG2 PRO 30 HG2 PRO 30 -20.745 -0.616 10.449 220 HG3 PRO 30 HG3 PRO 30 -19.096 -1.251 10.606 221 HD2 PRO 30 HD2 PRO 30 -19.568 1.135 9.444 222 HD3 PRO 30 HD3 PRO 30 -18.278 0.058 8.859 223 H ALA 31 H ALA 31 -22.272 0.373 8.568 224 HA ALA 31 HA ALA 31 -24.705 -1.160 7.993 225 HB1 ALA 31 HB1 ALA 31 -25.854 0.524 9.339 226 HB2 ALA 31 HB2 ALA 31 -24.377 1.484 9.433 227 HB3 ALA 31 HB3 ALA 31 -24.455 -0.092 10.220 228 H ALA 32 H ALA 32 -23.549 2.180 7.527 229 HA ALA 32 HA ALA 32 -24.065 3.764 5.935 230 HB1 ALA 32 HB1 ALA 32 -24.253 2.636 3.567 231 HB2 ALA 32 HB2 ALA 32 -23.753 1.190 4.445 232 HB3 ALA 32 HB3 ALA 32 -22.719 2.619 4.438 233 H GLU 33 H GLU 33 -26.385 2.229 7.279 234 HA GLU 33 HA GLU 33 -28.522 3.601 6.062 235 HB2 GLU 33 HB2 GLU 33 -27.862 1.031 4.852 236 HB3 GLU 33 HB3 GLU 33 -29.475 0.974 5.552 237 HG2 GLU 33 HG2 GLU 33 -28.560 3.203 3.711 238 HG3 GLU 33 HG3 GLU 33 -29.365 1.746 3.132 239 H ALA 34 H ALA 34 -30.696 2.580 6.855 240 HA ALA 34 HA ALA 34 -30.525 1.059 9.312 241 HB1 ALA 34 HB1 ALA 34 -31.620 2.839 10.681 242 HB2 ALA 34 HB2 ALA 34 -31.352 3.973 9.357 243 HB3 ALA 34 HB3 ALA 34 -29.977 3.253 10.197 244 H ALA 35 H ALA 35 -32.506 0.258 9.980 245 HA ALA 35 HA ALA 35 -34.775 0.771 8.149 246 HB1 ALA 35 HB1 ALA 35 -34.584 -1.886 9.444 247 HB2 ALA 35 HB2 ALA 35 -33.358 -1.533 8.224 248 HB3 ALA 35 HB3 ALA 35 -35.072 -1.455 7.804 249 HA PRO 36 HA PRO 36 -36.183 1.888 12.449 250 HB2 PRO 36 HB2 PRO 36 -38.236 3.316 10.822 251 HB3 PRO 36 HB3 PRO 36 -37.280 3.900 12.197 252 HG2 PRO 36 HG2 PRO 36 -36.722 4.705 9.748 253 HG3 PRO 36 HG3 PRO 36 -35.419 4.323 10.893 254 HD2 PRO 36 HD2 PRO 36 -36.468 2.659 8.615 255 HD3 PRO 36 HD3 PRO 36 -34.785 2.930 9.129 256 HA PRO 37 HA PRO 37 -39.324 -1.300 12.718 257 HB2 PRO 37 HB2 PRO 37 -40.712 0.438 14.710 258 HB3 PRO 37 HB3 PRO 37 -40.179 -1.247 14.862 259 HG2 PRO 37 HG2 PRO 37 -38.857 0.680 16.079 260 HG3 PRO 37 HG3 PRO 37 -37.988 -0.653 15.295 261 HD2 PRO 37 HD2 PRO 37 -38.389 2.163 14.320 262 HD3 PRO 37 HD3 PRO 37 -36.944 1.131 14.226 263 HA PRO 38 HA PRO 38 -42.628 -0.029 9.979 264 HB2 PRO 38 HB2 PRO 38 -44.417 -1.863 11.518 265 HB3 PRO 38 HB3 PRO 38 -44.100 -1.798 9.773 266 HG2 PRO 38 HG2 PRO 38 -43.049 -3.716 11.242 267 HG3 PRO 38 HG3 PRO 38 -42.095 -2.938 9.965 268 HD2 PRO 38 HD2 PRO 38 -41.950 -2.524 12.938 269 HD3 PRO 38 HD3 PRO 38 -40.634 -2.601 11.744 270 HA PRO 39 HA PRO 39 -44.867 3.081 12.307 271 HB2 PRO 39 HB2 PRO 39 -46.885 3.732 10.587 272 HB3 PRO 39 HB3 PRO 39 -45.198 4.224 10.326 273 HG2 PRO 39 HG2 PRO 39 -46.706 1.944 9.126 274 HG3 PRO 39 HG3 PRO 39 -45.611 3.105 8.350 275 HD2 PRO 39 HD2 PRO 39 -44.793 0.611 9.027 276 HD3 PRO 39 HD3 PRO 39 -43.697 2.010 9.093 277 HA PRO 40 HA PRO 40 -48.131 1.046 14.581 278 HB2 PRO 40 HB2 PRO 40 -49.572 3.665 14.616 279 HB3 PRO 40 HB3 PRO 40 -49.119 2.606 15.968 280 HG2 PRO 40 HG2 PRO 40 -47.784 4.832 15.534 281 HG3 PRO 40 HG3 PRO 40 -46.924 3.344 15.980 282 HD2 PRO 40 HD2 PRO 40 -47.188 4.626 13.271 283 HD3 PRO 40 HD3 PRO 40 -45.768 3.858 14.020 284 H GLU 41 H GLU 41 -49.967 -0.060 14.105 285 HA GLU 41 HA GLU 41 -51.727 0.935 11.963 286 HB2 GLU 41 HB2 GLU 41 -51.850 -1.394 11.037 287 HB3 GLU 41 HB3 GLU 41 -50.274 -0.637 10.841 288 HG2 GLU 41 HG2 GLU 41 -49.436 -1.853 12.820 289 HG3 GLU 41 HG3 GLU 41 -51.012 -2.610 13.030 290 HA PRO 42 HA PRO 42 -53.986 -0.710 15.781 291 HB2 PRO 42 HB2 PRO 42 -55.396 1.542 16.383 292 HB3 PRO 42 HB3 PRO 42 -53.765 1.234 17.009 293 HG2 PRO 42 HG2 PRO 42 -54.618 2.934 14.709 294 HG3 PRO 42 HG3 PRO 42 -53.428 3.271 15.980 295 HD2 PRO 42 HD2 PRO 42 -52.689 2.447 13.498 296 HD3 PRO 42 HD3 PRO 42 -51.769 2.012 14.955 297 H GLU 43 H GLU 43 -56.139 -1.381 15.841 298 HA GLU 43 HA GLU 43 -58.176 -2.007 15.021 299 HB2 GLU 43 HB2 GLU 43 -58.021 0.742 13.771 300 HB3 GLU 43 HB3 GLU 43 -59.453 -0.283 13.710 301 HG2 GLU 43 HG2 GLU 43 -59.524 -0.358 16.166 302 HG3 GLU 43 HG3 GLU 43 -58.076 0.644 16.248 303 HA PRO 44 HA PRO 44 -57.440 -4.062 11.147 304 HB2 PRO 44 HB2 PRO 44 -60.324 -3.691 10.479 305 HB3 PRO 44 HB3 PRO 44 -59.369 -5.182 10.571 306 HG2 PRO 44 HG2 PRO 44 -61.117 -4.597 12.457 307 HG3 PRO 44 HG3 PRO 44 -59.546 -5.311 12.870 308 HD2 PRO 44 HD2 PRO 44 -60.433 -2.447 13.115 309 HD3 PRO 44 HD3 PRO 44 -59.459 -3.427 14.238 310 H GLU 45 H GLU 45 -57.008 -3.593 8.995 311 HA GLU 45 HA GLU 45 -57.982 -1.008 7.941 312 HB2 GLU 45 HB2 GLU 45 -55.151 -2.084 7.763 313 HB3 GLU 45 HB3 GLU 45 -55.738 -0.631 6.954 314 HG2 GLU 45 HG2 GLU 45 -56.288 0.371 9.136 315 HG3 GLU 45 HG3 GLU 45 -55.720 -1.084 9.954 316 HA PRO 46 HA PRO 46 -58.672 -4.568 4.940 317 HB2 PRO 46 HB2 PRO 46 -61.291 -4.054 4.387 318 HB3 PRO 46 HB3 PRO 46 -60.770 -5.053 5.757 319 HG2 PRO 46 HG2 PRO 46 -61.600 -2.188 5.714 320 HG3 PRO 46 HG3 PRO 46 -62.024 -3.465 6.867 321 HD2 PRO 46 HD2 PRO 46 -60.107 -1.613 7.401 322 HD3 PRO 46 HD3 PRO 46 -60.024 -3.275 8.027 323 H VAL 47 H VAL 47 -59.096 -1.138 4.862 324 HA VAL 47 HA VAL 47 -58.831 -1.153 1.917 325 HB VAL 47 HB VAL 47 -61.119 -0.491 2.567 326 HG11 VAL 47 HG11 VAL 47 -60.542 0.433 4.807 327 HG12 VAL 47 HG12 VAL 47 -61.523 1.543 3.850 328 HG13 VAL 47 HG13 VAL 47 -59.789 1.817 4.014 329 HG21 VAL 47 HG21 VAL 47 -59.472 1.855 1.575 330 HG22 VAL 47 HG22 VAL 47 -61.201 1.620 1.325 331 HG23 VAL 47 HG23 VAL 47 -60.043 0.524 0.570 332 H SER 48 H SER 48 -57.558 0.474 1.009 333 HA SER 48 HA SER 48 -55.751 1.877 0.856 334 HB2 SER 48 HB2 SER 48 -57.398 3.345 2.162 335 HB3 SER 48 HB3 SER 48 -56.475 2.912 3.599 336 HG SER 48 HG SER 48 -55.473 4.691 2.860 337 H PHE 49 H PHE 49 -55.420 -0.768 2.028 338 HA PHE 49 HA PHE 49 -53.695 -0.784 4.258 339 HB2 PHE 49 HB2 PHE 49 -54.819 -2.802 3.346 340 HB3 PHE 49 HB3 PHE 49 -53.778 -2.721 1.922 341 HD1 PHE 49 HD1 PHE 49 -53.773 -3.142 5.625 342 HD2 PHE 49 HD2 PHE 49 -51.545 -3.570 1.977 343 HE1 PHE 49 HE1 PHE 49 -52.021 -4.403 6.844 344 HE2 PHE 49 HE2 PHE 49 -49.792 -4.831 3.196 345 HZ PHE 49 HZ PHE 49 -50.029 -5.247 5.630 346 H ASP 50 H ASP 50 -53.026 -0.690 0.764 347 HA ASP 50 HA ASP 50 -50.237 -0.728 0.844 348 HB2 ASP 50 HB2 ASP 50 -51.667 -0.937 -1.205 349 HB3 ASP 50 HB3 ASP 50 -51.940 0.801 -1.130 350 H ASP 51 H ASP 51 -48.671 0.811 0.956 351 HA ASP 51 HA ASP 51 -49.339 3.628 1.293 352 HB2 ASP 51 HB2 ASP 51 -49.525 2.395 3.572 353 HB3 ASP 51 HB3 ASP 51 -47.767 2.325 3.501 354 H GLU 52 H GLU 52 -47.426 5.004 1.368 355 HA GLU 52 HA GLU 52 -44.856 3.812 0.736 356 HB2 GLU 52 HB2 GLU 52 -46.068 3.990 -1.467 357 HB3 GLU 52 HB3 GLU 52 -46.186 5.728 -1.203 358 HG2 GLU 52 HG2 GLU 52 -43.738 5.901 -1.102 359 HG3 GLU 52 HG3 GLU 52 -43.594 4.157 -1.315 360 H VAL 53 H VAL 53 -43.309 5.042 1.646 361 HA VAL 53 HA VAL 53 -44.015 7.821 2.336 362 HB VAL 53 HB VAL 53 -42.767 7.547 4.469 363 HG11 VAL 53 HG11 VAL 53 -45.228 7.266 4.368 364 HG12 VAL 53 HG12 VAL 53 -44.506 6.240 5.607 365 HG13 VAL 53 HG13 VAL 53 -45.010 5.543 4.066 366 HG21 VAL 53 HG21 VAL 53 -42.172 5.306 5.250 367 HG22 VAL 53 HG22 VAL 53 -41.345 5.626 3.727 368 HG23 VAL 53 HG23 VAL 53 -42.775 4.593 3.754 369 H LEU 54 H LEU 54 -42.078 9.188 2.833 370 HA LEU 54 HA LEU 54 -39.778 8.444 1.126 371 HB2 LEU 54 HB2 LEU 54 -40.915 11.190 1.730 372 HB3 LEU 54 HB3 LEU 54 -39.466 10.881 0.779 373 HG LEU 54 HG LEU 54 -42.194 9.752 0.070 374 HD11 LEU 54 HD11 LEU 54 -40.782 12.188 -1.062 375 HD12 LEU 54 HD12 LEU 54 -42.186 12.240 0.005 376 HD13 LEU 54 HD13 LEU 54 -42.327 11.536 -1.606 377 HD21 LEU 54 HD21 LEU 54 -40.407 8.491 -0.951 378 HD22 LEU 54 HD22 LEU 54 -39.534 9.962 -1.378 379 HD23 LEU 54 HD23 LEU 54 -41.044 9.562 -2.196 380 H GLU 55 H GLU 55 -37.688 9.511 1.845 381 HA GLU 55 HA GLU 55 -37.591 10.181 4.686 382 HB2 GLU 55 HB2 GLU 55 -35.797 8.536 5.130 383 HB3 GLU 55 HB3 GLU 55 -37.314 7.753 4.703 384 HG2 GLU 55 HG2 GLU 55 -36.503 7.494 2.367 385 HG3 GLU 55 HG3 GLU 55 -34.972 8.232 2.832 386 H LEU 56 H LEU 56 -35.853 11.419 5.275 387 HA LEU 56 HA LEU 56 -33.666 11.930 3.432 388 HB2 LEU 56 HB2 LEU 56 -35.490 13.439 2.632 389 HB3 LEU 56 HB3 LEU 56 -35.543 14.175 4.231 390 HG LEU 56 HG LEU 56 -33.108 14.777 3.956 391 HD11 LEU 56 HD11 LEU 56 -33.630 13.748 1.151 392 HD12 LEU 56 HD12 LEU 56 -32.405 13.180 2.282 393 HD13 LEU 56 HD13 LEU 56 -32.268 14.788 1.568 394 HD21 LEU 56 HD21 LEU 56 -35.036 15.831 1.862 395 HD22 LEU 56 HD22 LEU 56 -33.554 16.640 2.378 396 HD23 LEU 56 HD23 LEU 56 -34.880 16.418 3.519 397 H THR 57 H THR 57 -31.858 12.217 4.608 398 HA THR 57 HA THR 57 -32.106 13.297 7.351 399 HB THR 57 HB THR 57 -30.412 11.673 8.109 400 HG1 THR 57 HG1 THR 57 -29.590 11.380 5.909 401 HG21 THR 57 HG21 THR 57 -31.864 9.748 8.213 402 HG22 THR 57 HG22 THR 57 -32.725 10.257 6.763 403 HG23 THR 57 HG23 THR 57 -32.883 11.185 8.253 404 H ASP 58 H ASP 58 -30.168 14.240 8.201 405 HA ASP 58 HA ASP 58 -28.607 15.600 6.144 406 HB2 ASP 58 HB2 ASP 58 -29.610 16.921 7.963 407 HB3 ASP 58 HB3 ASP 58 -28.688 15.993 9.144 408 HA PRO 59 HA PRO 59 -25.305 12.565 6.921 409 HB2 PRO 59 HB2 PRO 59 -23.326 13.695 5.411 410 HB3 PRO 59 HB3 PRO 59 -24.663 12.755 4.715 411 HG2 PRO 59 HG2 PRO 59 -24.339 15.714 4.920 412 HG3 PRO 59 HG3 PRO 59 -24.919 14.735 3.560 413 HD2 PRO 59 HD2 PRO 59 -26.629 16.052 5.200 414 HD3 PRO 59 HD3 PRO 59 -27.047 14.490 4.462 415 H ILE 60 H ILE 60 -23.525 12.404 8.267 416 HA ILE 60 HA ILE 60 -22.572 14.902 9.541 417 HB ILE 60 HB ILE 60 -23.035 12.212 10.876 418 HG12 ILE 60 HG12 ILE 60 -24.423 14.863 11.387 419 HG13 ILE 60 HG13 ILE 60 -25.078 13.640 10.298 420 HG21 ILE 60 HG21 ILE 60 -22.003 14.867 11.943 421 HG22 ILE 60 HG22 ILE 60 -21.116 13.343 11.874 422 HG23 ILE 60 HG23 ILE 60 -22.494 13.515 12.965 423 HD11 ILE 60 HD11 ILE 60 -24.331 13.003 13.155 424 HD12 ILE 60 HD12 ILE 60 -25.347 12.059 12.063 425 HD13 ILE 60 HD13 ILE 60 -25.937 13.589 12.718 426 H ALA 61 H ALA 61 -20.432 15.191 9.606 427 HA ALA 61 HA ALA 61 -18.223 14.903 9.032 428 HB1 ALA 61 HB1 ALA 61 -18.715 12.216 10.344 429 HB2 ALA 61 HB2 ALA 61 -18.380 13.719 11.203 430 HB3 ALA 61 HB3 ALA 61 -17.153 13.015 10.151 431 HA PRO 62 HA PRO 62 -19.297 12.114 5.341 432 HB2 PRO 62 HB2 PRO 62 -19.090 13.992 3.370 433 HB3 PRO 62 HB3 PRO 62 -20.603 13.670 4.242 434 HG2 PRO 62 HG2 PRO 62 -18.605 15.843 4.665 435 HG3 PRO 62 HG3 PRO 62 -20.375 15.928 4.648 436 HD2 PRO 62 HD2 PRO 62 -18.959 15.871 6.967 437 HD3 PRO 62 HD3 PRO 62 -20.570 15.134 6.824 438 H GLU 63 H GLU 63 -17.772 11.180 4.013 439 HA GLU 63 HA GLU 63 -15.012 11.745 4.546 440 HB2 GLU 63 HB2 GLU 63 -16.352 9.850 2.603 441 HB3 GLU 63 HB3 GLU 63 -14.614 9.913 2.884 442 HG2 GLU 63 HG2 GLU 63 -14.984 9.432 5.281 443 HG3 GLU 63 HG3 GLU 63 -16.722 9.351 4.990 444 HA PRO 64 HA PRO 64 -14.190 14.555 1.190 445 HB2 PRO 64 HB2 PRO 64 -11.627 13.932 0.484 446 HB3 PRO 64 HB3 PRO 64 -12.033 14.789 1.985 447 HG2 PRO 64 HG2 PRO 64 -11.431 11.897 1.564 448 HG3 PRO 64 HG3 PRO 64 -10.867 12.989 2.845 449 HD2 PRO 64 HD2 PRO 64 -12.903 11.240 3.248 450 HD3 PRO 64 HD3 PRO 64 -12.853 12.829 4.045 451 H GLU 65 H GLU 65 -14.114 14.685 -1.092 452 HA GLU 65 HA GLU 65 -15.192 12.512 -2.514 453 HB2 GLU 65 HB2 GLU 65 -13.816 15.033 -3.464 454 HB3 GLU 65 HB3 GLU 65 -14.592 13.883 -4.555 455 HG2 GLU 65 HG2 GLU 65 -16.724 14.170 -3.366 456 HG3 GLU 65 HG3 GLU 65 -15.960 15.297 -2.248 457 H LEU 66 H LEU 66 -11.862 13.785 -2.413 458 HA LEU 66 HA LEU 66 -10.773 11.171 -2.927 459 HB2 LEU 66 HB2 LEU 66 -11.424 12.000 -5.217 460 HB3 LEU 66 HB3 LEU 66 -10.274 13.317 -5.000 461 HG LEU 66 HG LEU 66 -8.492 11.555 -4.583 462 HD11 LEU 66 HD11 LEU 66 -9.036 9.278 -5.537 463 HD12 LEU 66 HD12 LEU 66 -10.734 9.754 -5.542 464 HD13 LEU 66 HD13 LEU 66 -9.854 9.638 -4.020 465 HD21 LEU 66 HD21 LEU 66 -8.903 12.742 -6.781 466 HD22 LEU 66 HD22 LEU 66 -9.842 11.337 -7.286 467 HD23 LEU 66 HD23 LEU 66 -8.122 11.169 -6.931 468 HA PRO 67 HA PRO 67 -7.568 13.152 -0.441 469 HB2 PRO 67 HB2 PRO 67 -5.677 11.226 -1.715 470 HB3 PRO 67 HB3 PRO 67 -6.000 11.519 0.004 471 HG2 PRO 67 HG2 PRO 67 -6.895 9.332 -1.172 472 HG3 PRO 67 HG3 PRO 67 -7.894 10.198 0.010 473 HD2 PRO 67 HD2 PRO 67 -8.098 10.211 -2.992 474 HD3 PRO 67 HD3 PRO 67 -9.392 10.154 -1.773 475 HA PRO 68 HA PRO 68 -5.692 16.154 -3.199 476 HB2 PRO 68 HB2 PRO 68 -3.254 15.893 -1.468 477 HB3 PRO 68 HB3 PRO 68 -4.102 17.359 -2.007 478 HG2 PRO 68 HG2 PRO 68 -4.416 16.515 0.457 479 HG3 PRO 68 HG3 PRO 68 -5.817 17.086 -0.467 480 HD2 PRO 68 HD2 PRO 68 -5.013 14.264 0.177 481 HD3 PRO 68 HD3 PRO 68 -6.638 14.988 0.126 482 H LEU 69 H LEU 69 -3.601 13.476 -2.148 483 HA LEU 69 HA LEU 69 -3.074 12.602 -4.793 484 HB2 LEU 69 HB2 LEU 69 -1.588 14.768 -4.366 485 HB3 LEU 69 HB3 LEU 69 -0.546 13.618 -3.530 486 HG LEU 69 HG LEU 69 -1.571 13.094 -6.329 487 HD11 LEU 69 HD11 LEU 69 -0.328 15.240 -6.320 488 HD12 LEU 69 HD12 LEU 69 0.558 13.980 -7.177 489 HD13 LEU 69 HD13 LEU 69 1.035 14.434 -5.541 490 HD21 LEU 69 HD21 LEU 69 -0.693 11.139 -5.232 491 HD22 LEU 69 HD22 LEU 69 0.701 12.032 -4.625 492 HD23 LEU 69 HD23 LEU 69 0.554 11.695 -6.349 493 H GLU 70 H GLU 70 -0.961 12.684 -1.895 494 HA GLU 70 HA GLU 70 -1.454 9.791 -1.535 495 HB2 GLU 70 HB2 GLU 70 0.688 10.157 -2.760 496 HB3 GLU 70 HB3 GLU 70 1.264 11.132 -1.407 497 HG2 GLU 70 HG2 GLU 70 1.040 9.201 0.100 498 HG3 GLU 70 HG3 GLU 70 0.422 8.221 -1.228 499 H THR 71 H THR 71 -1.816 9.194 0.506 500 HA THR 71 HA THR 71 -1.146 11.084 2.681 501 HB THR 71 HB THR 71 -3.546 11.192 2.312 502 HG1 THR 71 HG1 THR 71 -4.178 10.531 4.391 503 HG21 THR 71 HG21 THR 71 -3.628 8.837 1.264 504 HG22 THR 71 HG22 THR 71 -4.987 9.311 2.282 505 HG23 THR 71 HG23 THR 71 -3.740 8.242 2.920 506 H VAL 72 H VAL 72 -1.936 7.687 1.934 507 HA VAL 72 HA VAL 72 -0.026 6.865 4.044 508 HB VAL 72 HB VAL 72 -2.652 5.515 3.328 509 HG11 VAL 72 HG11 VAL 72 -0.980 3.855 3.959 510 HG12 VAL 72 HG12 VAL 72 -2.113 4.060 5.294 511 HG13 VAL 72 HG13 VAL 72 -0.519 4.810 5.368 512 HG21 VAL 72 HG21 VAL 72 -3.431 6.226 5.489 513 HG22 VAL 72 HG22 VAL 72 -2.763 7.655 4.700 514 HG23 VAL 72 HG23 VAL 72 -1.831 6.814 5.940 515 H GLY 73 H GLY 73 1.559 5.574 3.363 516 HA2 GLY 73 HA2 GLY 73 1.505 4.585 0.600 517 HA3 GLY 73 HA3 GLY 73 2.926 4.704 1.635 518 H ASP 74 H ASP 74 1.815 2.420 0.062 519 HA ASP 74 HA ASP 74 1.572 0.145 0.252 520 HB2 ASP 74 HB2 ASP 74 2.747 0.602 3.015 521 HB3 ASP 74 HB3 ASP 74 2.629 -0.952 2.186 522 H ILE 75 H ILE 75 -0.707 0.759 0.186 523 HA ILE 75 HA ILE 75 -2.328 1.123 2.413 524 HB ILE 75 HB ILE 75 -3.011 -0.163 -0.258 525 HG12 ILE 75 HG12 ILE 75 -3.560 2.662 0.699 526 HG13 ILE 75 HG13 ILE 75 -2.099 2.235 -0.190 527 HG21 ILE 75 HG21 ILE 75 -5.360 0.486 0.300 528 HG22 ILE 75 HG22 ILE 75 -4.823 0.976 1.907 529 HG23 ILE 75 HG23 ILE 75 -4.724 -0.716 1.425 530 HD11 ILE 75 HD11 ILE 75 -3.564 2.940 -1.896 531 HD12 ILE 75 HD12 ILE 75 -4.962 2.183 -1.138 532 HD13 ILE 75 HD13 ILE 75 -3.743 1.187 -1.932 533 H ASP 76 H ASP 76 -1.594 -1.883 0.613 534 HA ASP 76 HA ASP 76 -1.437 -3.451 2.958 535 HB2 ASP 76 HB2 ASP 76 -3.997 -2.987 2.557 536 HB3 ASP 76 HB3 ASP 76 -3.818 -4.241 1.330 537 H VAL 77 H VAL 77 -1.076 -5.739 2.495 538 HA VAL 77 HA VAL 77 -0.571 -6.424 -0.307 539 HB VAL 77 HB VAL 77 1.685 -7.308 0.236 540 HG11 VAL 77 HG11 VAL 77 2.818 -5.168 0.230 541 HG12 VAL 77 HG12 VAL 77 1.412 -4.373 0.941 542 HG13 VAL 77 HG13 VAL 77 1.328 -5.006 -0.702 543 HG21 VAL 77 HG21 VAL 77 1.294 -7.566 2.702 544 HG22 VAL 77 HG22 VAL 77 1.345 -5.809 2.858 545 HG23 VAL 77 HG23 VAL 77 2.780 -6.690 2.331 546 H TYR 78 H TYR 78 -0.404 -8.750 -0.654 547 HA TYR 78 HA TYR 78 -1.476 -10.324 1.610 548 HB2 TYR 78 HB2 TYR 78 -2.168 -10.460 -1.334 549 HB3 TYR 78 HB3 TYR 78 -2.575 -11.745 -0.197 550 HD1 TYR 78 HD1 TYR 78 -3.237 -8.258 -1.189 551 HD2 TYR 78 HD2 TYR 78 -4.223 -11.398 1.572 552 HE1 TYR 78 HE1 TYR 78 -5.238 -6.990 -0.460 553 HE2 TYR 78 HE2 TYR 78 -6.224 -10.126 2.301 554 HH TYR 78 HH TYR 78 -7.526 -7.617 0.601 555 H SER 79 H SER 79 -0.493 -11.679 -1.514 556 HA SER 79 HA SER 79 0.937 -13.457 -1.923 557 HB2 SER 79 HB2 SER 79 3.306 -12.790 -1.622 558 HB3 SER 79 HB3 SER 79 2.335 -11.503 -2.333 559 HG SER 79 HG SER 79 3.504 -11.708 0.187 560 HA PRO 80 HA PRO 80 0.597 -15.026 2.581 561 HB2 PRO 80 HB2 PRO 80 -0.249 -17.415 0.999 562 HB3 PRO 80 HB3 PRO 80 -0.903 -16.780 2.519 563 HG2 PRO 80 HG2 PRO 80 -2.198 -16.437 0.238 564 HG3 PRO 80 HG3 PRO 80 -2.147 -15.156 1.463 565 HD2 PRO 80 HD2 PRO 80 -0.675 -15.338 -1.134 566 HD3 PRO 80 HD3 PRO 80 -1.303 -13.906 -0.289 567 HA PRO 81 HA PRO 81 4.526 -17.160 1.483 568 HB2 PRO 81 HB2 PRO 81 6.108 -16.161 3.400 569 HB3 PRO 81 HB3 PRO 81 5.586 -15.151 2.038 570 HG2 PRO 81 HG2 PRO 81 4.658 -15.159 4.851 571 HG3 PRO 81 HG3 PRO 81 4.794 -13.815 3.706 572 HD2 PRO 81 HD2 PRO 81 2.433 -15.275 4.341 573 HD3 PRO 81 HD3 PRO 81 2.626 -14.072 3.049 574 H GLU 82 H GLU 82 4.727 -19.286 2.031 575 HA GLU 82 HA GLU 82 3.511 -20.593 4.088 576 HB2 GLU 82 HB2 GLU 82 6.083 -21.275 2.661 577 HB3 GLU 82 HB3 GLU 82 5.274 -22.379 3.769 578 HG2 GLU 82 HG2 GLU 82 4.010 -21.159 1.297 579 HG3 GLU 82 HG3 GLU 82 4.645 -22.798 1.401 580 HA PRO 83 HA PRO 83 7.705 -20.271 6.783 581 HB2 PRO 83 HB2 PRO 83 8.053 -17.351 6.168 582 HB3 PRO 83 HB3 PRO 83 9.276 -18.559 6.618 583 HG2 PRO 83 HG2 PRO 83 9.054 -17.811 4.116 584 HG3 PRO 83 HG3 PRO 83 9.283 -19.527 4.510 585 HD2 PRO 83 HD2 PRO 83 6.789 -18.114 3.630 586 HD3 PRO 83 HD3 PRO 83 7.352 -19.755 3.248 587 H GLU 84 H GLU 84 5.633 -17.396 6.274 588 HA GLU 84 HA GLU 84 4.728 -17.624 9.085 589 HB2 GLU 84 HB2 GLU 84 6.260 -15.654 8.682 590 HB3 GLU 84 HB3 GLU 84 5.044 -15.022 7.572 591 HG2 GLU 84 HG2 GLU 84 4.706 -14.008 9.756 592 HG3 GLU 84 HG3 GLU 84 3.370 -15.108 9.432 593 H SER 85 H SER 85 2.643 -18.116 9.163 594 HA SER 85 HA SER 85 0.713 -16.770 7.473 595 HB2 SER 85 HB2 SER 85 -0.176 -18.757 6.416 596 HB3 SER 85 HB3 SER 85 1.541 -18.638 6.041 597 HG SER 85 HG SER 85 1.676 -20.548 6.889 598 H GLU 86 H GLU 86 -1.535 -17.806 7.869 599 HA GLU 86 HA GLU 86 -2.105 -17.622 10.645 600 HB2 GLU 86 HB2 GLU 86 -3.772 -18.512 8.281 601 HB3 GLU 86 HB3 GLU 86 -4.415 -18.329 9.912 602 HG2 GLU 86 HG2 GLU 86 -3.698 -15.963 9.925 603 HG3 GLU 86 HG3 GLU 86 -3.083 -16.147 8.284 604 HA PRO 87 HA PRO 87 -1.742 -21.711 12.317 605 HB2 PRO 87 HB2 PRO 87 -4.720 -21.786 12.688 606 HB3 PRO 87 HB3 PRO 87 -3.432 -22.171 13.845 607 HG2 PRO 87 HG2 PRO 87 -4.710 -19.884 14.026 608 HG3 PRO 87 HG3 PRO 87 -2.949 -19.940 14.247 609 HD2 PRO 87 HD2 PRO 87 -4.519 -18.967 11.886 610 HD3 PRO 87 HD3 PRO 87 -3.001 -18.339 12.565 611 H ALA 88 H ALA 88 -1.893 -23.866 11.726 612 HA ALA 88 HA ALA 88 -2.436 -24.469 9.038 613 HB1 ALA 88 HB1 ALA 88 -0.862 -25.798 10.284 614 HB2 ALA 88 HB2 ALA 88 -2.178 -26.853 9.771 615 HB3 ALA 88 HB3 ALA 88 -2.106 -26.278 11.437 616 H TYR 89 H TYR 89 -4.379 -24.982 11.961 617 HA TYR 89 HA TYR 89 -6.462 -26.389 10.537 618 HB2 TYR 89 HB2 TYR 89 -5.886 -26.751 12.973 619 HB3 TYR 89 HB3 TYR 89 -6.607 -25.177 13.306 620 HD1 TYR 89 HD1 TYR 89 -7.269 -28.628 12.175 621 HD2 TYR 89 HD2 TYR 89 -9.006 -24.822 13.146 622 HE1 TYR 89 HE1 TYR 89 -9.523 -29.662 12.198 623 HE2 TYR 89 HE2 TYR 89 -11.259 -25.855 13.169 624 HH TYR 89 HH TYR 89 -12.034 -28.600 11.790 625 H THR 90 H THR 90 -6.728 -24.714 8.878 626 HA THR 90 HA THR 90 -8.904 -22.930 9.588 627 HB THR 90 HB THR 90 -6.941 -21.514 9.996 628 HG1 THR 90 HG1 THR 90 -8.409 -20.207 9.249 629 HG21 THR 90 HG21 THR 90 -5.326 -21.010 8.301 630 HG22 THR 90 HG22 THR 90 -6.261 -21.855 7.067 631 HG23 THR 90 HG23 THR 90 -5.459 -22.767 8.346 632 HA PRO 91 HA PRO 91 -10.070 -24.355 5.495 633 HB2 PRO 91 HB2 PRO 91 -12.075 -22.619 4.877 634 HB3 PRO 91 HB3 PRO 91 -12.270 -23.921 6.067 635 HG2 PRO 91 HG2 PRO 91 -11.710 -21.023 6.511 636 HG3 PRO 91 HG3 PRO 91 -12.837 -22.096 7.361 637 HD2 PRO 91 HD2 PRO 91 -10.399 -21.455 8.386 638 HD3 PRO 91 HD3 PRO 91 -11.171 -23.031 8.680 639 HA PRO 92 HA PRO 92 -7.743 -21.639 2.780 640 HB2 PRO 92 HB2 PRO 92 -8.465 -22.541 0.319 641 HB3 PRO 92 HB3 PRO 92 -7.409 -23.464 1.403 642 HG2 PRO 92 HG2 PRO 92 -10.333 -23.779 0.897 643 HG3 PRO 92 HG3 PRO 92 -9.073 -25.020 1.037 644 HD2 PRO 92 HD2 PRO 92 -10.755 -24.409 3.096 645 HD3 PRO 92 HD3 PRO 92 -9.087 -24.967 3.356 646 HA PRO 93 HA PRO 93 -10.633 -18.342 1.780 647 HB2 PRO 93 HB2 PRO 93 -9.127 -16.776 0.124 648 HB3 PRO 93 HB3 PRO 93 -8.889 -16.844 1.881 649 HG2 PRO 93 HG2 PRO 93 -7.376 -18.219 -0.286 650 HG3 PRO 93 HG3 PRO 93 -6.775 -17.421 1.178 651 HD2 PRO 93 HD2 PRO 93 -7.022 -20.126 0.996 652 HD3 PRO 93 HD3 PRO 93 -7.232 -19.250 2.528 653 H ALA 94 H ALA 94 -8.968 -20.011 -0.841 654 HA ALA 94 HA ALA 94 -11.316 -20.416 -2.373 655 HB1 ALA 94 HB1 ALA 94 -11.235 -18.827 -4.042 656 HB2 ALA 94 HB2 ALA 94 -9.500 -18.571 -3.864 657 HB3 ALA 94 HB3 ALA 94 -10.618 -17.866 -2.697 658 H ALA 95 H ALA 95 -9.077 -21.906 -1.392 659 HA ALA 95 HA ALA 95 -7.458 -23.424 -2.025 660 HB1 ALA 95 HB1 ALA 95 -8.845 -23.940 -4.589 661 HB2 ALA 95 HB2 ALA 95 -9.859 -24.005 -3.150 662 HB3 ALA 95 HB3 ALA 95 -8.442 -25.049 -3.281 663 HA PRO 96 HA PRO 96 -5.582 -20.514 -5.305 664 HB2 PRO 96 HB2 PRO 96 -3.592 -19.404 -3.807 665 HB3 PRO 96 HB3 PRO 96 -5.224 -18.711 -3.905 666 HG2 PRO 96 HG2 PRO 96 -4.022 -20.427 -1.781 667 HG3 PRO 96 HG3 PRO 96 -5.039 -18.983 -1.622 668 HD2 PRO 96 HD2 PRO 96 -6.040 -21.499 -1.343 669 HD3 PRO 96 HD3 PRO 96 -7.005 -20.157 -1.998 670 H VAL 97 H VAL 97 -3.941 -21.242 -6.586 671 HA VAL 97 HA VAL 97 -2.058 -23.213 -5.432 672 HB VAL 97 HB VAL 97 -2.058 -24.339 -7.641 673 HG11 VAL 97 HG11 VAL 97 -4.805 -24.019 -6.394 674 HG12 VAL 97 HG12 VAL 97 -3.543 -25.110 -5.821 675 HG13 VAL 97 HG13 VAL 97 -4.280 -25.366 -7.403 676 HG21 VAL 97 HG21 VAL 97 -2.728 -22.467 -9.070 677 HG22 VAL 97 HG22 VAL 97 -4.285 -22.362 -8.246 678 HG23 VAL 97 HG23 VAL 97 -3.905 -23.772 -9.234 679 H PHE 98 H PHE 98 -2.319 -20.208 -7.006 680 HA PHE 98 HA PHE 98 -0.787 -18.780 -7.953 681 HB2 PHE 98 HB2 PHE 98 1.147 -20.611 -6.507 682 HB3 PHE 98 HB3 PHE 98 1.585 -19.065 -7.240 683 HD1 PHE 98 HD1 PHE 98 -0.148 -20.715 -4.462 684 HD2 PHE 98 HD2 PHE 98 0.703 -16.942 -6.334 685 HE1 PHE 98 HE1 PHE 98 -0.909 -19.532 -2.420 686 HE2 PHE 98 HE2 PHE 98 -0.057 -15.758 -4.290 687 HZ PHE 98 HZ PHE 98 -0.862 -17.052 -2.334 688 H ASP 99 H ASP 99 -0.974 -19.042 -10.118 689 HA ASP 99 HA ASP 99 1.058 -20.658 -11.446 690 HB2 ASP 99 HB2 ASP 99 -0.856 -22.208 -11.189 691 HB3 ASP 99 HB3 ASP 99 -1.880 -21.064 -12.054 692 H ARG 100 H ARG 100 1.960 -18.842 -12.326 693 HA ARG 100 HA ARG 100 2.246 -17.058 -13.746 694 HB2 ARG 100 HB2 ARG 100 0.039 -18.508 -15.231 695 HB3 ARG 100 HB3 ARG 100 1.022 -17.213 -15.911 696 HG2 ARG 100 HG2 ARG 100 3.037 -18.524 -15.676 697 HG3 ARG 100 HG3 ARG 100 2.182 -19.768 -14.764 698 HD2 ARG 100 HD2 ARG 100 1.555 -19.011 -17.630 699 HD3 ARG 100 HD3 ARG 100 2.544 -20.390 -17.158 700 HE ARG 100 HE ARG 100 0.113 -20.604 -15.788 701 HH11 ARG 100 HH11 ARG 100 1.241 -20.668 -19.105 702 HH12 ARG 100 HH12 ARG 100 -0.040 -21.703 -19.641 703 HH21 ARG 100 HH21 ARG 100 -1.537 -21.948 -16.530 704 HH22 ARG 100 HH22 ARG 100 -1.599 -22.418 -18.194 705 H ASP 101 H ASP 101 0.989 -16.213 -11.604 706 HA ASP 101 HA ASP 101 -1.604 -15.128 -11.872 707 HB2 ASP 101 HB2 ASP 101 -0.420 -15.341 -9.711 708 HB3 ASP 101 HB3 ASP 101 0.706 -14.084 -10.214 709 H GLU 102 H GLU 102 1.538 -13.437 -12.105 710 HA GLU 102 HA GLU 102 2.102 -11.405 -13.063 711 HB2 GLU 102 HB2 GLU 102 0.652 -12.969 -15.172 712 HB3 GLU 102 HB3 GLU 102 1.125 -11.311 -15.526 713 HG2 GLU 102 HG2 GLU 102 3.037 -12.399 -16.230 714 HG3 GLU 102 HG3 GLU 102 3.471 -12.148 -14.544 715 H VAL 103 H VAL 103 1.086 -9.905 -11.760 716 HA VAL 103 HA VAL 103 -1.350 -8.692 -12.911 717 HB VAL 103 HB VAL 103 -2.183 -8.228 -10.618 718 HG11 VAL 103 HG11 VAL 103 -1.726 -11.095 -11.465 719 HG12 VAL 103 HG12 VAL 103 -3.160 -10.101 -11.725 720 HG13 VAL 103 HG13 VAL 103 -2.762 -10.666 -10.102 721 HG21 VAL 103 HG21 VAL 103 0.226 -9.907 -9.869 722 HG22 VAL 103 HG22 VAL 103 -1.158 -9.738 -8.792 723 HG23 VAL 103 HG23 VAL 103 -0.223 -8.317 -9.255 724 H ALA 104 H ALA 104 -1.336 -6.524 -13.064 725 HA ALA 104 HA ALA 104 1.087 -5.084 -12.756 726 HB1 ALA 104 HB1 ALA 104 -0.198 -3.141 -13.431 727 HB2 ALA 104 HB2 ALA 104 -1.709 -3.973 -13.068 728 HB3 ALA 104 HB3 ALA 104 -0.698 -4.524 -14.404 729 H GLU 105 H GLU 105 -1.890 -5.221 -10.853 730 HA GLU 105 HA GLU 105 -0.544 -4.504 -8.424 731 HB2 GLU 105 HB2 GLU 105 -0.800 -2.279 -9.615 732 HB3 GLU 105 HB3 GLU 105 -2.544 -2.485 -9.453 733 HG2 GLU 105 HG2 GLU 105 -1.755 -1.147 -7.586 734 HG3 GLU 105 HG3 GLU 105 -2.241 -2.728 -6.984 735 H GLN 106 H GLN 106 -1.822 -4.880 -6.591 736 HA GLN 106 HA GLN 106 -4.630 -5.627 -7.008 737 HB2 GLN 106 HB2 GLN 106 -2.498 -7.422 -5.836 738 HB3 GLN 106 HB3 GLN 106 -4.220 -7.677 -5.558 739 HG2 GLN 106 HG2 GLN 106 -4.617 -7.868 -7.962 740 HG3 GLN 106 HG3 GLN 106 -2.920 -7.513 -8.291 741 HE21 GLN 106 HE21 GLN 106 -4.784 -10.061 -8.561 742 HE22 GLN 106 HE22 GLN 106 -3.797 -11.293 -7.936 743 H LEU 107 H LEU 107 -3.972 -3.280 -5.908 744 HA LEU 107 HA LEU 107 -3.598 -3.366 -3.066 745 HB2 LEU 107 HB2 LEU 107 -4.546 -1.161 -4.909 746 HB3 LEU 107 HB3 LEU 107 -4.291 -0.955 -3.175 747 HG LEU 107 HG LEU 107 -2.133 -1.988 -5.033 748 HD11 LEU 107 HD11 LEU 107 -2.684 0.236 -5.802 749 HD12 LEU 107 HD12 LEU 107 -1.211 0.355 -4.840 750 HD13 LEU 107 HD13 LEU 107 -2.757 0.841 -4.146 751 HD21 LEU 107 HD21 LEU 107 -1.687 -2.510 -2.722 752 HD22 LEU 107 HD22 LEU 107 -2.188 -0.903 -2.200 753 HD23 LEU 107 HD23 LEU 107 -0.697 -1.108 -3.119 754 H VAL 108 H VAL 108 -5.089 -2.940 -1.448 755 HA VAL 108 HA VAL 108 -7.942 -3.211 -2.169 756 HB VAL 108 HB VAL 108 -7.089 -5.400 -1.435 757 HG11 VAL 108 HG11 VAL 108 -6.487 -5.527 1.097 758 HG12 VAL 108 HG12 VAL 108 -6.152 -3.803 0.943 759 HG13 VAL 108 HG13 VAL 108 -5.257 -4.963 -0.032 760 HG21 VAL 108 HG21 VAL 108 -8.773 -5.846 0.256 761 HG22 VAL 108 HG22 VAL 108 -9.423 -4.649 -0.864 762 HG23 VAL 108 HG23 VAL 108 -8.823 -4.145 0.714 763 H GLY 109 H GLY 109 -9.403 -2.142 -0.860 764 HA2 GLY 109 HA2 GLY 109 -8.580 -0.729 1.530 765 HA3 GLY 109 HA3 GLY 109 -8.880 0.321 0.146 766 H VAL 110 H VAL 110 -10.521 0.985 1.974 767 HA VAL 110 HA VAL 110 -13.033 -0.542 1.572 768 HB VAL 110 HB VAL 110 -12.225 1.222 3.911 769 HG11 VAL 110 HG11 VAL 110 -14.329 0.217 4.932 770 HG12 VAL 110 HG12 VAL 110 -14.750 -0.342 3.314 771 HG13 VAL 110 HG13 VAL 110 -14.607 1.385 3.640 772 HG21 VAL 110 HG21 VAL 110 -12.310 -0.940 5.173 773 HG22 VAL 110 HG22 VAL 110 -11.042 -0.913 3.947 774 HG23 VAL 110 HG23 VAL 110 -12.545 -1.785 3.643 775 H SER 111 H SER 111 -14.514 0.440 0.373 776 HA SER 111 HA SER 111 -14.515 3.399 0.216 777 HB2 SER 111 HB2 SER 111 -15.227 3.203 -2.116 778 HB3 SER 111 HB3 SER 111 -13.687 2.384 -1.873 779 HG SER 111 HG SER 111 -16.118 1.382 -2.601 780 H ALA 112 H ALA 112 -16.410 0.418 0.215 781 HA ALA 112 HA ALA 112 -18.692 1.826 1.333 782 HB1 ALA 112 HB1 ALA 112 -19.423 2.158 -0.848 783 HB2 ALA 112 HB2 ALA 112 -20.158 0.599 -0.467 784 HB3 ALA 112 HB3 ALA 112 -18.682 0.667 -1.432 785 H ALA 113 H ALA 113 -20.279 0.375 2.224 786 HA ALA 113 HA ALA 113 -19.768 -2.480 2.198 787 HB1 ALA 113 HB1 ALA 113 -19.767 -1.298 4.934 788 HB2 ALA 113 HB2 ALA 113 -18.277 -1.198 3.999 789 HB3 ALA 113 HB3 ALA 113 -19.000 -2.769 4.344 790 H SER 114 H SER 114 -21.424 -3.694 3.343 791 HA SER 114 HA SER 114 -23.748 -2.288 4.347 792 HB2 SER 114 HB2 SER 114 -24.064 -2.180 1.882 793 HB3 SER 114 HB3 SER 114 -24.003 -3.940 1.818 794 HG SER 114 HG SER 114 -25.948 -2.232 2.903 795 H ALA 115 H ALA 115 -22.392 -3.801 5.924 796 HA ALA 115 HA ALA 115 -24.080 -6.108 6.419 797 HB1 ALA 115 HB1 ALA 115 -22.605 -7.403 5.202 798 HB2 ALA 115 HB2 ALA 115 -21.828 -7.453 6.784 799 HB3 ALA 115 HB3 ALA 115 -21.235 -6.350 5.542 800 H ALA 116 H ALA 116 -23.745 -6.991 8.550 801 HA ALA 116 HA ALA 116 -22.121 -5.329 10.347 802 HB1 ALA 116 HB1 ALA 116 -24.930 -6.115 11.097 803 HB2 ALA 116 HB2 ALA 116 -24.598 -4.620 10.216 804 HB3 ALA 116 HB3 ALA 116 -23.900 -4.874 11.816 805 H ALA 117 H ALA 117 -21.523 -7.883 9.356 806 HA ALA 117 HA ALA 117 -22.152 -9.796 11.478 807 HB1 ALA 117 HB1 ALA 117 -21.270 -11.468 10.053 808 HB2 ALA 117 HB2 ALA 117 -20.392 -10.286 9.081 809 HB3 ALA 117 HB3 ALA 117 -22.150 -10.370 8.989 810 H SER 118 H SER 118 -20.109 -7.349 11.481 811 HA SER 118 HA SER 118 -18.233 -8.642 13.250 812 HB2 SER 118 HB2 SER 118 -16.221 -8.082 12.017 813 HB3 SER 118 HB3 SER 118 -17.246 -9.094 11.003 814 HG SER 118 HG SER 118 -18.053 -7.081 10.105 815 H ALA 119 H ALA 119 -16.860 -7.108 14.339 816 HA ALA 119 HA ALA 119 -18.114 -4.455 14.462 817 HB1 ALA 119 HB1 ALA 119 -18.101 -5.341 16.621 818 HB2 ALA 119 HB2 ALA 119 -16.636 -4.359 16.620 819 HB3 ALA 119 HB3 ALA 119 -16.529 -6.108 16.406 820 H PHE 120 H PHE 120 -16.423 -2.706 15.237 821 HA PHE 120 HA PHE 120 -14.665 -2.239 13.076 822 HB2 PHE 120 HB2 PHE 120 -13.845 -0.324 14.408 823 HB3 PHE 120 HB3 PHE 120 -15.606 -0.396 14.380 824 HD1 PHE 120 HD1 PHE 120 -12.586 -0.851 16.441 825 HD2 PHE 120 HD2 PHE 120 -16.878 -1.000 16.385 826 HE1 PHE 120 HE1 PHE 120 -12.615 -0.914 18.919 827 HE2 PHE 120 HE2 PHE 120 -16.909 -1.063 18.862 828 HZ PHE 120 HZ PHE 120 -14.777 -1.019 20.131 829 H GLY 121 H GLY 121 -12.280 -1.745 13.405 830 HA2 GLY 121 HA2 GLY 121 -10.702 -2.916 15.392 831 HA3 GLY 121 HA3 GLY 121 -10.906 -4.116 14.117 832 H SER 122 H SER 122 -8.402 -3.502 14.381 833 HA SER 122 HA SER 122 -7.808 -1.497 12.281 834 HB2 SER 122 HB2 SER 122 -6.156 -2.199 14.721 835 HB3 SER 122 HB3 SER 122 -5.653 -1.109 13.432 836 HG SER 122 HG SER 122 -7.363 -0.701 15.524 837 H LEU 123 H LEU 123 -6.302 -2.032 10.746 838 HA LEU 123 HA LEU 123 -4.891 -4.584 10.897 839 HB2 LEU 123 HB2 LEU 123 -7.316 -4.722 9.769 840 HB3 LEU 123 HB3 LEU 123 -6.442 -4.092 8.382 841 HG LEU 123 HG LEU 123 -6.531 -6.535 8.275 842 HD11 LEU 123 HD11 LEU 123 -3.694 -5.895 9.080 843 HD12 LEU 123 HD12 LEU 123 -4.405 -5.241 7.604 844 HD13 LEU 123 HD13 LEU 123 -4.263 -6.987 7.816 845 HD21 LEU 123 HD21 LEU 123 -5.747 -7.986 9.973 846 HD22 LEU 123 HD22 LEU 123 -6.679 -6.763 10.835 847 HD23 LEU 123 HD23 LEU 123 -4.917 -6.684 10.825 848 H SER 124 H SER 124 -2.896 -4.345 10.100 849 HA SER 124 HA SER 124 -2.406 -2.399 7.954 850 HB2 SER 124 HB2 SER 124 -0.833 -2.553 10.541 851 HB3 SER 124 HB3 SER 124 -0.385 -1.588 9.137 852 HG SER 124 HG SER 124 -2.167 -1.063 11.099 853 H SER 125 H SER 125 -1.418 -3.478 6.366 854 HA SER 125 HA SER 125 0.046 -5.926 7.045 855 HB2 SER 125 HB2 SER 125 -1.004 -4.917 4.395 856 HB3 SER 125 HB3 SER 125 -0.126 -6.428 4.617 857 HG SER 125 HG SER 125 -2.673 -5.668 5.545 858 H ALA 126 H ALA 126 0.905 -2.807 6.831 859 HA ALA 126 HA ALA 126 2.967 -2.714 4.915 860 HB1 ALA 126 HB1 ALA 126 2.574 -0.585 5.603 861 HB2 ALA 126 HB2 ALA 126 3.811 -0.952 6.809 862 HB3 ALA 126 HB3 ALA 126 2.102 -1.092 7.226 863 H LEU 127 H LEU 127 5.221 -2.858 5.163 864 HA LEU 127 HA LEU 127 6.316 -3.930 7.619 865 HB2 LEU 127 HB2 LEU 127 5.444 -5.922 6.314 866 HB3 LEU 127 HB3 LEU 127 6.634 -5.533 5.074 867 HG LEU 127 HG LEU 127 8.409 -5.654 6.889 868 HD11 LEU 127 HD11 LEU 127 7.110 -5.419 8.890 869 HD12 LEU 127 HD12 LEU 127 7.700 -7.081 8.885 870 HD13 LEU 127 HD13 LEU 127 6.034 -6.737 8.425 871 HD21 LEU 127 HD21 LEU 127 8.527 -8.087 6.808 872 HD22 LEU 127 HD22 LEU 127 7.931 -7.491 5.260 873 HD23 LEU 127 HD23 LEU 127 6.808 -8.189 6.427 874 H LEU 128 H LEU 128 6.799 -3.014 4.247 875 HA LEU 128 HA LEU 128 8.494 -1.920 3.158 876 HB2 LEU 128 HB2 LEU 128 8.854 -0.965 5.996 877 HB3 LEU 128 HB3 LEU 128 9.955 -0.448 4.721 878 HG LEU 128 HG LEU 128 7.852 0.212 3.391 879 HD11 LEU 128 HD11 LEU 128 5.917 0.790 4.990 880 HD12 LEU 128 HD12 LEU 128 6.689 -0.298 6.141 881 HD13 LEU 128 HD13 LEU 128 6.121 -0.911 4.587 882 HD21 LEU 128 HD21 LEU 128 7.629 2.360 4.666 883 HD22 LEU 128 HD22 LEU 128 9.308 1.892 4.400 884 HD23 LEU 128 HD23 LEU 128 8.562 1.639 5.977 885 H MET 129 H MET 129 8.984 -4.652 4.604 886 HA MET 129 HA MET 129 11.888 -4.673 4.091 887 HB2 MET 129 HB2 MET 129 10.494 -5.931 6.468 888 HB3 MET 129 HB3 MET 129 12.175 -6.224 6.023 889 HG2 MET 129 HG2 MET 129 12.698 -3.852 6.298 890 HG3 MET 129 HG3 MET 129 11.007 -3.495 6.650 891 HE1 MET 129 HE1 MET 129 14.302 -4.993 7.687 892 HE2 MET 129 HE2 MET 129 13.374 -6.489 7.730 893 HE3 MET 129 HE3 MET 129 14.013 -5.813 9.226 894 HA PRO 130 HA PRO 130 10.831 -8.278 1.692 895 HB2 PRO 130 HB2 PRO 130 13.139 -9.726 1.740 896 HB3 PRO 130 HB3 PRO 130 12.974 -8.221 0.816 897 HG2 PRO 130 HG2 PRO 130 14.220 -8.670 3.489 898 HG3 PRO 130 HG3 PRO 130 14.794 -7.690 2.129 899 HD2 PRO 130 HD2 PRO 130 13.540 -6.594 4.283 900 HD3 PRO 130 HD3 PRO 130 13.407 -5.906 2.649 901 H LYS 131 H LYS 131 10.004 -10.344 1.965 902 HA LYS 131 HA LYS 131 9.908 -11.335 4.710 903 HB2 LYS 131 HB2 LYS 131 7.834 -11.109 3.323 904 HB3 LYS 131 HB3 LYS 131 8.462 -12.358 2.251 905 HG2 LYS 131 HG2 LYS 131 6.979 -13.456 3.792 906 HG3 LYS 131 HG3 LYS 131 8.617 -13.877 4.284 907 HD2 LYS 131 HD2 LYS 131 8.565 -12.172 6.041 908 HD3 LYS 131 HD3 LYS 131 6.967 -11.646 5.512 909 HE2 LYS 131 HE2 LYS 131 6.058 -13.878 6.040 910 HE3 LYS 131 HE3 LYS 131 7.657 -14.402 6.569 911 HZ1 LYS 131 HZ1 LYS 131 6.797 -13.744 8.547 912 HZ2 LYS 131 HZ2 LYS 131 5.773 -12.577 7.858 913 HZ3 LYS 131 HZ3 LYS 131 7.430 -12.252 8.047 914 H ASP 132 H ASP 132 10.562 -12.693 1.472 915 HA ASP 132 HA ASP 132 12.421 -14.623 2.725 916 HB2 ASP 132 HB2 ASP 132 10.492 -15.192 0.464 917 HB3 ASP 132 HB3 ASP 132 11.666 -16.326 1.131 918 H GLY 133 H GLY 133 14.100 -15.413 1.304 919 HA2 GLY 133 HA2 GLY 133 14.828 -13.447 -0.781 920 HA3 GLY 133 HA3 GLY 133 15.978 -14.401 0.158 921 H LEU 134 H LEU 134 16.973 -15.714 -1.232 922 HA LEU 134 HA LEU 134 15.995 -16.697 -3.658 923 HB2 LEU 134 HB2 LEU 134 18.166 -17.543 -1.761 924 HB3 LEU 134 HB3 LEU 134 17.794 -18.545 -3.164 925 HG LEU 134 HG LEU 134 18.024 -16.393 -4.560 926 HD11 LEU 134 HD11 LEU 134 19.586 -14.714 -3.455 927 HD12 LEU 134 HD12 LEU 134 19.215 -15.502 -1.921 928 HD13 LEU 134 HD13 LEU 134 17.931 -14.718 -2.842 929 HD21 LEU 134 HD21 LEU 134 19.725 -18.253 -4.400 930 HD22 LEU 134 HD22 LEU 134 20.523 -17.335 -3.124 931 HD23 LEU 134 HD23 LEU 134 20.419 -16.672 -4.756 932 H GLU 135 H GLU 135 14.871 -18.477 -4.256 933 HA GLU 135 HA GLU 135 13.979 -20.345 -2.141 934 HB2 GLU 135 HB2 GLU 135 12.186 -18.720 -2.781 935 HB3 GLU 135 HB3 GLU 135 12.289 -19.315 -4.437 936 HG2 GLU 135 HG2 GLU 135 11.692 -21.579 -3.675 937 HG3 GLU 135 HG3 GLU 135 11.618 -21.008 -2.009 938 H HIS 136 H HIS 136 14.329 -22.428 -2.598 939 HA HIS 136 HA HIS 136 15.746 -23.267 -4.887 940 HB2 HIS 136 HB2 HIS 136 15.698 -24.443 -2.658 941 HB3 HIS 136 HB3 HIS 136 14.080 -25.010 -3.056 942 HD2 HIS 136 HD2 HIS 136 16.667 -25.074 -6.003 943 HE1 HIS 136 HE1 HIS 136 16.225 -29.034 -4.611 944 HE2 HIS 136 HE2 HIS 136 17.232 -27.585 -6.435 945 H HIS 137 H HIS 137 12.314 -23.475 -4.021 946 HA HIS 137 HA HIS 137 10.427 -23.879 -5.248 947 HB2 HIS 137 HB2 HIS 137 11.382 -21.897 -6.492 948 HB3 HIS 137 HB3 HIS 137 12.081 -23.039 -7.639 949 HD2 HIS 137 HD2 HIS 137 10.354 -23.559 -9.721 950 HE1 HIS 137 HE1 HIS 137 6.728 -22.681 -7.743 951 HE2 HIS 137 HE2 HIS 137 7.758 -23.387 -9.955 952 H HIS 138 H HIS 138 11.584 -26.154 -4.618 953 HA HIS 138 HA HIS 138 11.001 -27.878 -6.890 954 HB2 HIS 138 HB2 HIS 138 13.461 -27.350 -7.048 955 HB3 HIS 138 HB3 HIS 138 13.666 -28.119 -5.476 956 HD2 HIS 138 HD2 HIS 138 14.173 -30.821 -5.707 957 HE1 HIS 138 HE1 HIS 138 12.455 -31.441 -9.513 958 HE2 HIS 138 HE2 HIS 138 13.716 -32.550 -7.609 959 H HIS 139 H HIS 139 10.250 -29.864 -6.273 960 HA HIS 139 HA HIS 139 10.317 -30.544 -3.397 961 HB2 HIS 139 HB2 HIS 139 7.902 -30.707 -5.221 962 HB3 HIS 139 HB3 HIS 139 7.971 -31.317 -3.569 963 HD2 HIS 139 HD2 HIS 139 7.124 -28.056 -5.367 964 HE1 HIS 139 HE1 HIS 139 7.885 -26.994 -1.353 965 HE2 HIS 139 HE2 HIS 139 6.957 -26.170 -3.568 966 H HIS 140 H HIS 140 10.465 -32.709 -2.915 967 HA HIS 140 HA HIS 140 11.705 -34.417 -4.779 968 HB2 HIS 140 HB2 HIS 140 11.940 -34.625 -2.314 969 HB3 HIS 140 HB3 HIS 140 10.263 -35.156 -2.212 970 HD2 HIS 140 HD2 HIS 140 9.969 -37.895 -2.506 971 HE1 HIS 140 HE1 HIS 140 13.738 -38.714 -4.225 972 HE2 HIS 140 HE2 HIS 140 11.594 -39.758 -3.352 973 H HIS 141 H HIS 141 8.364 -34.319 -3.555 974 HA HIS 141 HA HIS 141 7.554 -36.239 -5.646 975 HB2 HIS 141 HB2 HIS 141 6.981 -36.704 -3.229 976 HB3 HIS 141 HB3 HIS 141 5.939 -35.284 -3.272 977 HD2 HIS 141 HD2 HIS 141 3.374 -35.930 -4.056 978 HE1 HIS 141 HE1 HIS 141 4.262 -39.452 -6.210 979 HE2 HIS 141 HE2 HIS 141 2.390 -37.928 -5.419 Start of MODEL 7 1 H1 MET 1 HT1 MET 1 -2.172 7.145 -15.000 2 H2 MET 1 HT2 MET 1 -3.813 7.430 -14.667 3 H3 MET 1 HT3 MET 1 -2.862 6.542 -13.574 4 HA MET 1 HA MET 1 -3.393 9.018 -13.100 5 HB2 MET 1 HB2 MET 1 -1.755 7.366 -11.942 6 HB3 MET 1 HB3 MET 1 -0.500 8.169 -12.886 7 HG2 MET 1 HG2 MET 1 -0.624 9.271 -10.737 8 HG3 MET 1 HG3 MET 1 -1.299 10.366 -11.943 9 HE1 MET 1 HE1 MET 1 -3.481 11.179 -8.892 10 HE2 MET 1 HE2 MET 1 -2.676 11.843 -10.312 11 HE3 MET 1 HE3 MET 1 -1.739 10.959 -9.107 12 H SER 2 H SER 2 -0.600 8.206 -15.166 13 HA SER 2 HA SER 2 -0.995 10.580 -16.776 14 HB2 SER 2 HB2 SER 2 1.167 11.588 -16.319 15 HB3 SER 2 HB3 SER 2 0.264 11.451 -14.812 16 HG SER 2 HG SER 2 2.596 10.671 -15.000 17 H ASP 3 H ASP 3 0.632 10.711 -18.544 18 HA ASP 3 HA ASP 3 0.911 8.245 -19.878 19 HB2 ASP 3 HB2 ASP 3 2.221 10.932 -20.324 20 HB3 ASP 3 HB3 ASP 3 2.437 9.561 -21.411 21 H GLN 4 H GLN 4 3.169 10.149 -17.943 22 HA GLN 4 HA GLN 4 5.114 7.914 -18.062 23 HB2 GLN 4 HB2 GLN 4 5.559 10.887 -17.706 24 HB3 GLN 4 HB3 GLN 4 6.811 9.673 -17.434 25 HG2 GLN 4 HG2 GLN 4 6.681 8.927 -19.730 26 HG3 GLN 4 HG3 GLN 4 5.273 9.942 -20.030 27 HE21 GLN 4 HE21 GLN 4 7.987 10.013 -21.354 28 HE22 GLN 4 HE22 GLN 4 8.544 11.601 -21.133 29 H SER 5 H SER 5 5.472 6.876 -16.193 30 HA SER 5 HA SER 5 4.929 8.269 -13.651 31 HB2 SER 5 HB2 SER 5 2.931 6.967 -14.144 32 HB3 SER 5 HB3 SER 5 3.906 5.524 -14.405 33 HG SER 5 HG SER 5 2.867 6.068 -12.207 34 H GLN 6 H GLN 6 6.534 8.079 -12.281 35 HA GLN 6 HA GLN 6 8.151 5.643 -12.162 36 HB2 GLN 6 HB2 GLN 6 9.263 7.258 -13.762 37 HB3 GLN 6 HB3 GLN 6 9.445 8.366 -12.404 38 HG2 GLN 6 HG2 GLN 6 10.743 6.689 -11.175 39 HG3 GLN 6 HG3 GLN 6 10.517 5.530 -12.485 40 HE21 GLN 6 HE21 GLN 6 13.029 6.961 -11.363 41 HE22 GLN 6 HE22 GLN 6 13.771 7.603 -12.749 42 H GLU 7 H GLU 7 7.355 8.828 -10.862 43 HA GLU 7 HA GLU 7 8.412 8.159 -8.220 44 HB2 GLU 7 HB2 GLU 7 7.029 10.689 -9.125 45 HB3 GLU 7 HB3 GLU 7 7.908 10.451 -7.619 46 HG2 GLU 7 HG2 GLU 7 9.141 10.286 -10.389 47 HG3 GLU 7 HG3 GLU 7 9.286 11.657 -9.296 48 HA PRO 8 HA PRO 8 3.546 9.108 -7.468 49 HB2 PRO 8 HB2 PRO 8 2.743 7.320 -9.745 50 HB3 PRO 8 HB3 PRO 8 1.859 8.677 -9.014 51 HG2 PRO 8 HG2 PRO 8 3.109 9.027 -11.289 52 HG3 PRO 8 HG3 PRO 8 3.215 10.268 -10.024 53 HD2 PRO 8 HD2 PRO 8 5.270 8.259 -10.867 54 HD3 PRO 8 HD3 PRO 8 5.492 9.934 -10.320 55 H THR 9 H THR 9 2.982 7.963 -5.827 56 HA THR 9 HA THR 9 3.970 5.322 -5.316 57 HB THR 9 HB THR 9 2.746 5.514 -3.188 58 HG1 THR 9 HG1 THR 9 1.853 8.000 -4.209 59 HG21 THR 9 HG21 THR 9 4.972 6.640 -3.534 60 HG22 THR 9 HG22 THR 9 3.974 7.389 -2.287 61 HG23 THR 9 HG23 THR 9 4.100 8.133 -3.883 62 H MET 10 H MET 10 2.355 3.705 -4.303 63 HA MET 10 HA MET 10 0.681 2.705 -6.353 64 HB2 MET 10 HB2 MET 10 0.916 2.022 -3.418 65 HB3 MET 10 HB3 MET 10 -0.124 1.138 -4.534 66 HG2 MET 10 HG2 MET 10 2.856 1.529 -4.940 67 HG3 MET 10 HG3 MET 10 2.135 0.086 -4.228 68 HE1 MET 10 HE1 MET 10 3.368 -0.865 -7.836 69 HE2 MET 10 HE2 MET 10 3.285 -1.473 -6.185 70 HE3 MET 10 HE3 MET 10 4.050 0.082 -6.508 71 H GLU 11 H GLU 11 0.058 4.602 -3.478 72 HA GLU 11 HA GLU 11 -2.723 4.418 -3.263 73 HB2 GLU 11 HB2 GLU 11 -0.860 6.735 -2.729 74 HB3 GLU 11 HB3 GLU 11 -2.593 6.848 -2.425 75 HG2 GLU 11 HG2 GLU 11 -1.589 6.167 -0.357 76 HG3 GLU 11 HG3 GLU 11 -2.371 4.739 -1.025 77 H GLU 12 H GLU 12 -0.940 6.959 -5.054 78 HA GLU 12 HA GLU 12 -3.116 8.137 -6.303 79 HB2 GLU 12 HB2 GLU 12 -0.248 7.844 -7.196 80 HB3 GLU 12 HB3 GLU 12 -1.423 8.838 -8.062 81 HG2 GLU 12 HG2 GLU 12 -1.785 10.220 -6.109 82 HG3 GLU 12 HG3 GLU 12 -0.812 9.148 -5.109 83 H ILE 13 H ILE 13 -1.208 5.329 -7.354 84 HA ILE 13 HA ILE 13 -2.380 5.011 -9.907 85 HB ILE 13 HB ILE 13 -1.121 2.989 -8.014 86 HG12 ILE 13 HG12 ILE 13 -0.017 4.242 -10.548 87 HG13 ILE 13 HG13 ILE 13 0.240 4.952 -8.955 88 HG21 ILE 13 HG21 ILE 13 -0.941 1.501 -9.962 89 HG22 ILE 13 HG22 ILE 13 -1.747 2.694 -10.979 90 HG23 ILE 13 HG23 ILE 13 -2.639 1.893 -9.687 91 HD11 ILE 13 HD11 ILE 13 0.927 2.059 -9.481 92 HD12 ILE 13 HD12 ILE 13 1.538 3.126 -8.216 93 HD13 ILE 13 HD13 ILE 13 2.061 3.347 -9.884 94 H LEU 14 H LEU 14 -3.268 3.809 -6.692 95 HA LEU 14 HA LEU 14 -5.414 2.138 -7.401 96 HB2 LEU 14 HB2 LEU 14 -4.344 2.253 -5.151 97 HB3 LEU 14 HB3 LEU 14 -5.124 3.805 -4.883 98 HG LEU 14 HG LEU 14 -6.840 1.454 -5.677 99 HD11 LEU 14 HD11 LEU 14 -5.599 1.916 -2.956 100 HD12 LEU 14 HD12 LEU 14 -5.627 0.429 -3.903 101 HD13 LEU 14 HD13 LEU 14 -7.107 1.022 -3.156 102 HD21 LEU 14 HD21 LEU 14 -8.336 2.708 -3.927 103 HD22 LEU 14 HD22 LEU 14 -8.085 3.459 -5.499 104 HD23 LEU 14 HD23 LEU 14 -7.166 4.016 -4.106 105 H ALA 15 H ALA 15 -5.225 5.600 -6.829 106 HA ALA 15 HA ALA 15 -8.026 6.181 -6.898 107 HB1 ALA 15 HB1 ALA 15 -6.112 7.728 -6.142 108 HB2 ALA 15 HB2 ALA 15 -7.412 8.461 -7.082 109 HB3 ALA 15 HB3 ALA 15 -5.875 8.069 -7.855 110 H SER 16 H SER 16 -5.498 6.202 -9.322 111 HA SER 16 HA SER 16 -6.959 7.065 -11.549 112 HB2 SER 16 HB2 SER 16 -4.610 5.165 -11.428 113 HB3 SER 16 HB3 SER 16 -5.237 5.867 -12.916 114 HG SER 16 HG SER 16 -4.042 7.142 -10.695 115 H ILE 17 H ILE 17 -6.492 3.769 -10.319 116 HA ILE 17 HA ILE 17 -8.034 2.510 -12.397 117 HB ILE 17 HB ILE 17 -7.225 1.475 -9.661 118 HG12 ILE 17 HG12 ILE 17 -5.260 2.071 -11.029 119 HG13 ILE 17 HG13 ILE 17 -5.387 0.325 -10.864 120 HG21 ILE 17 HG21 ILE 17 -7.578 -0.775 -10.694 121 HG22 ILE 17 HG22 ILE 17 -8.255 0.019 -12.116 122 HG23 ILE 17 HG23 ILE 17 -9.067 0.161 -10.557 123 HD11 ILE 17 HD11 ILE 17 -6.156 1.981 -13.295 124 HD12 ILE 17 HD12 ILE 17 -6.490 0.258 -13.135 125 HD13 ILE 17 HD13 ILE 17 -4.825 0.832 -13.173 126 H ARG 18 H ARG 18 -8.630 3.613 -9.125 127 HA ARG 18 HA ARG 18 -10.950 2.655 -8.261 128 HB2 ARG 18 HB2 ARG 18 -9.611 4.580 -7.303 129 HB3 ARG 18 HB3 ARG 18 -10.533 5.637 -8.369 130 HG2 ARG 18 HG2 ARG 18 -12.631 4.877 -7.343 131 HG3 ARG 18 HG3 ARG 18 -11.730 3.778 -6.292 132 HD2 ARG 18 HD2 ARG 18 -10.527 5.700 -5.317 133 HD3 ARG 18 HD3 ARG 18 -11.433 6.798 -6.354 134 HE ARG 18 HE ARG 18 -13.288 6.523 -4.967 135 HH11 ARG 18 HH11 ARG 18 -10.830 4.172 -4.128 136 HH12 ARG 18 HH12 ARG 18 -11.630 3.687 -2.670 137 HH21 ARG 18 HH21 ARG 18 -14.292 5.866 -3.069 138 HH22 ARG 18 HH22 ARG 18 -13.577 4.641 -2.077 139 H ARG 19 H ARG 19 -12.394 1.921 -9.733 140 HA ARG 19 HA ARG 19 -13.685 3.767 -11.605 141 HB2 ARG 19 HB2 ARG 19 -12.954 1.426 -12.257 142 HB3 ARG 19 HB3 ARG 19 -14.238 0.819 -11.214 143 HG2 ARG 19 HG2 ARG 19 -15.211 0.898 -13.376 144 HG3 ARG 19 HG3 ARG 19 -15.817 2.334 -12.560 145 HD2 ARG 19 HD2 ARG 19 -15.094 2.949 -14.797 146 HD3 ARG 19 HD3 ARG 19 -13.991 3.665 -13.630 147 HE ARG 19 HE ARG 19 -13.035 1.114 -14.467 148 HH11 ARG 19 HH11 ARG 19 -13.348 4.424 -15.576 149 HH12 ARG 19 HH12 ARG 19 -12.000 4.312 -16.656 150 HH21 ARG 19 HH21 ARG 19 -11.289 1.011 -15.886 151 HH22 ARG 19 HH22 ARG 19 -10.844 2.395 -16.827 152 H ILE 20 H ILE 20 -15.674 4.621 -11.306 153 HA ILE 20 HA ILE 20 -17.635 5.223 -10.272 154 HB ILE 20 HB ILE 20 -17.635 2.265 -9.564 155 HG12 ILE 20 HG12 ILE 20 -19.235 3.736 -11.675 156 HG13 ILE 20 HG13 ILE 20 -17.661 3.035 -12.018 157 HG21 ILE 20 HG21 ILE 20 -19.920 4.273 -9.465 158 HG22 ILE 20 HG22 ILE 20 -19.126 3.575 -8.052 159 HG23 ILE 20 HG23 ILE 20 -20.049 2.544 -9.145 160 HD11 ILE 20 HD11 ILE 20 -20.040 1.501 -10.931 161 HD12 ILE 20 HD12 ILE 20 -18.473 0.815 -11.358 162 HD13 ILE 20 HD13 ILE 20 -19.514 1.488 -12.612 163 H ILE 21 H ILE 21 -17.028 6.649 -8.738 164 HA ILE 21 HA ILE 21 -16.048 5.659 -6.140 165 HB ILE 21 HB ILE 21 -16.148 8.491 -7.251 166 HG12 ILE 21 HG12 ILE 21 -13.723 6.712 -6.838 167 HG13 ILE 21 HG13 ILE 21 -14.570 6.810 -8.378 168 HG21 ILE 21 HG21 ILE 21 -15.049 7.289 -4.693 169 HG22 ILE 21 HG22 ILE 21 -16.157 8.649 -4.867 170 HG23 ILE 21 HG23 ILE 21 -14.463 8.831 -5.320 171 HD11 ILE 21 HD11 ILE 21 -14.056 9.130 -8.625 172 HD12 ILE 21 HD12 ILE 21 -12.556 8.359 -8.118 173 HD13 ILE 21 HD13 ILE 21 -13.521 9.261 -6.949 174 H SER 22 H SER 22 -18.339 8.077 -7.398 175 HA SER 22 HA SER 22 -20.102 7.526 -5.077 176 HB2 SER 22 HB2 SER 22 -19.036 9.730 -4.854 177 HB3 SER 22 HB3 SER 22 -19.646 10.191 -6.441 178 HG SER 22 HG SER 22 -20.973 9.884 -4.010 179 H GLU 23 H GLU 23 -20.311 9.262 -8.205 180 HA GLU 23 HA GLU 23 -21.914 9.250 -9.852 181 HB2 GLU 23 HB2 GLU 23 -21.958 6.392 -8.893 182 HB3 GLU 23 HB3 GLU 23 -23.094 6.934 -10.126 183 HG2 GLU 23 HG2 GLU 23 -20.094 7.313 -10.328 184 HG3 GLU 23 HG3 GLU 23 -20.957 5.952 -11.044 185 H ASP 24 H ASP 24 -22.619 10.202 -7.218 186 HA ASP 24 HA ASP 24 -25.543 9.828 -7.330 187 HB2 ASP 24 HB2 ASP 24 -23.718 9.679 -4.939 188 HB3 ASP 24 HB3 ASP 24 -25.390 10.204 -4.758 189 H ASP 25 H ASP 25 -24.233 11.834 -8.657 190 HA ASP 25 HA ASP 25 -24.672 14.226 -6.973 191 HB2 ASP 25 HB2 ASP 25 -22.360 14.014 -7.809 192 HB3 ASP 25 HB3 ASP 25 -22.968 13.958 -9.463 193 H ALA 26 H ALA 26 -26.946 14.245 -7.365 194 HA ALA 26 HA ALA 26 -28.112 14.180 -9.939 195 HB1 ALA 26 HB1 ALA 26 -29.626 13.792 -8.205 196 HB2 ALA 26 HB2 ALA 26 -30.004 15.453 -8.660 197 HB3 ALA 26 HB3 ALA 26 -29.013 15.132 -7.237 198 HA PRO 27 HA PRO 27 -27.086 18.277 -11.394 199 HB2 PRO 27 HB2 PRO 27 -29.098 18.783 -13.154 200 HB3 PRO 27 HB3 PRO 27 -27.811 17.607 -13.484 201 HG2 PRO 27 HG2 PRO 27 -30.589 17.137 -12.504 202 HG3 PRO 27 HG3 PRO 27 -29.668 16.264 -13.743 203 HD2 PRO 27 HD2 PRO 27 -29.933 15.324 -11.202 204 HD3 PRO 27 HD3 PRO 27 -28.480 15.025 -12.179 205 H ALA 28 H ALA 28 -27.571 20.451 -11.077 206 HA ALA 28 HA ALA 28 -29.915 21.011 -9.363 207 HB1 ALA 28 HB1 ALA 28 -27.716 21.368 -8.293 208 HB2 ALA 28 HB2 ALA 28 -28.617 22.875 -8.454 209 HB3 ALA 28 HB3 ALA 28 -27.294 22.516 -9.562 210 H GLU 29 H GLU 29 -29.763 20.996 -12.376 211 HA GLU 29 HA GLU 29 -30.965 23.624 -12.777 212 HB2 GLU 29 HB2 GLU 29 -29.719 23.901 -14.951 213 HB3 GLU 29 HB3 GLU 29 -28.706 24.057 -13.520 214 HG2 GLU 29 HG2 GLU 29 -27.963 21.710 -13.796 215 HG3 GLU 29 HG3 GLU 29 -28.963 21.563 -15.238 216 HA PRO 30 HA PRO 30 -33.160 19.753 -14.469 217 HB2 PRO 30 HB2 PRO 30 -35.417 21.383 -13.374 218 HB3 PRO 30 HB3 PRO 30 -35.192 19.622 -13.346 219 HG2 PRO 30 HG2 PRO 30 -34.789 21.020 -11.168 220 HG3 PRO 30 HG3 PRO 30 -33.647 19.735 -11.613 221 HD2 PRO 30 HD2 PRO 30 -33.339 22.714 -11.905 222 HD3 PRO 30 HD3 PRO 30 -32.138 21.496 -11.412 223 H ALA 31 H ALA 31 -34.128 19.678 -16.475 224 HA ALA 31 HA ALA 31 -35.330 22.052 -17.656 225 HB1 ALA 31 HB1 ALA 31 -33.170 22.587 -18.362 226 HB2 ALA 31 HB2 ALA 31 -33.783 21.645 -19.721 227 HB3 ALA 31 HB3 ALA 31 -32.703 20.898 -18.545 228 H ALA 32 H ALA 32 -36.379 21.587 -19.696 229 HA ALA 32 HA ALA 32 -36.723 18.755 -20.370 230 HB1 ALA 32 HB1 ALA 32 -39.145 20.494 -19.968 231 HB2 ALA 32 HB2 ALA 32 -38.460 19.558 -18.639 232 HB3 ALA 32 HB3 ALA 32 -39.056 18.736 -20.081 233 H GLU 33 H GLU 33 -37.511 18.395 -22.470 234 HA GLU 33 HA GLU 33 -37.856 20.748 -24.204 235 HB2 GLU 33 HB2 GLU 33 -35.944 18.467 -24.771 236 HB3 GLU 33 HB3 GLU 33 -36.343 19.766 -25.891 237 HG2 GLU 33 HG2 GLU 33 -35.067 20.150 -23.164 238 HG3 GLU 33 HG3 GLU 33 -34.206 20.193 -24.699 239 H ALA 34 H ALA 34 -38.734 20.165 -26.348 240 HA ALA 34 HA ALA 34 -40.237 17.624 -26.353 241 HB1 ALA 34 HB1 ALA 34 -41.294 20.417 -26.739 242 HB2 ALA 34 HB2 ALA 34 -41.938 19.122 -25.730 243 HB3 ALA 34 HB3 ALA 34 -42.100 19.036 -27.486 244 H ALA 35 H ALA 35 -40.295 16.594 -28.268 245 HA ALA 35 HA ALA 35 -39.310 18.003 -30.662 246 HB1 ALA 35 HB1 ALA 35 -38.428 15.204 -30.393 247 HB2 ALA 35 HB2 ALA 35 -37.729 16.309 -29.208 248 HB3 ALA 35 HB3 ALA 35 -37.535 16.627 -30.934 249 HA PRO 36 HA PRO 36 -42.575 16.072 -32.961 250 HB2 PRO 36 HB2 PRO 36 -40.578 14.907 -34.851 251 HB3 PRO 36 HB3 PRO 36 -41.980 15.942 -35.189 252 HG2 PRO 36 HG2 PRO 36 -39.536 16.928 -35.301 253 HG3 PRO 36 HG3 PRO 36 -40.858 17.874 -34.593 254 HD2 PRO 36 HD2 PRO 36 -38.664 16.365 -33.195 255 HD3 PRO 36 HD3 PRO 36 -39.369 17.952 -32.802 256 HA PRO 37 HA PRO 37 -43.034 11.878 -31.509 257 HB2 PRO 37 HB2 PRO 37 -44.372 11.274 -34.119 258 HB3 PRO 37 HB3 PRO 37 -44.941 10.971 -32.464 259 HG2 PRO 37 HG2 PRO 37 -45.959 12.953 -33.862 260 HG3 PRO 37 HG3 PRO 37 -45.577 13.177 -32.144 261 HD2 PRO 37 HD2 PRO 37 -44.057 14.137 -34.550 262 HD3 PRO 37 HD3 PRO 37 -44.357 14.962 -33.003 263 HA PRO 38 HA PRO 38 -39.625 9.702 -33.483 264 HB2 PRO 38 HB2 PRO 38 -39.832 7.241 -32.343 265 HB3 PRO 38 HB3 PRO 38 -39.255 8.663 -31.451 266 HG2 PRO 38 HG2 PRO 38 -41.968 7.418 -31.468 267 HG3 PRO 38 HG3 PRO 38 -41.007 8.008 -30.097 268 HD2 PRO 38 HD2 PRO 38 -43.018 9.478 -31.180 269 HD3 PRO 38 HD3 PRO 38 -41.564 10.229 -30.480 270 HA PRO 39 HA PRO 39 -41.116 7.528 -37.073 271 HB2 PRO 39 HB2 PRO 39 -39.026 5.441 -36.615 272 HB3 PRO 39 HB3 PRO 39 -39.350 6.413 -38.065 273 HG2 PRO 39 HG2 PRO 39 -37.272 6.964 -36.543 274 HG3 PRO 39 HG3 PRO 39 -38.261 8.272 -37.221 275 HD2 PRO 39 HD2 PRO 39 -38.247 7.181 -34.419 276 HD3 PRO 39 HD3 PRO 39 -38.370 8.869 -34.967 277 HA PRO 40 HA PRO 40 -43.948 4.415 -35.474 278 HB2 PRO 40 HB2 PRO 40 -43.857 3.223 -38.217 279 HB3 PRO 40 HB3 PRO 40 -45.260 3.714 -37.244 280 HG2 PRO 40 HG2 PRO 40 -44.483 5.190 -39.280 281 HG3 PRO 40 HG3 PRO 40 -45.000 5.954 -37.763 282 HD2 PRO 40 HD2 PRO 40 -42.211 5.548 -38.811 283 HD3 PRO 40 HD3 PRO 40 -42.906 6.954 -37.969 284 H GLU 41 H GLU 41 -43.765 2.449 -34.524 285 HA GLU 41 HA GLU 41 -41.557 0.669 -35.373 286 HB2 GLU 41 HB2 GLU 41 -42.478 1.270 -32.548 287 HB3 GLU 41 HB3 GLU 41 -41.259 0.073 -32.986 288 HG2 GLU 41 HG2 GLU 41 -39.873 1.855 -33.994 289 HG3 GLU 41 HG3 GLU 41 -41.089 3.050 -33.546 290 HA PRO 42 HA PRO 42 -45.494 -1.768 -35.580 291 HB2 PRO 42 HB2 PRO 42 -44.651 -3.581 -37.441 292 HB3 PRO 42 HB3 PRO 42 -45.285 -1.978 -37.866 293 HG2 PRO 42 HG2 PRO 42 -42.452 -2.895 -37.653 294 HG3 PRO 42 HG3 PRO 42 -43.220 -1.886 -38.895 295 HD2 PRO 42 HD2 PRO 42 -41.724 -0.814 -36.901 296 HD3 PRO 42 HD3 PRO 42 -43.131 0.034 -37.586 297 H GLU 43 H GLU 43 -46.044 -3.769 -34.707 298 HA GLU 43 HA GLU 43 -43.898 -5.558 -33.807 299 HB2 GLU 43 HB2 GLU 43 -44.831 -5.629 -31.520 300 HB3 GLU 43 HB3 GLU 43 -44.272 -4.014 -31.932 301 HG2 GLU 43 HG2 GLU 43 -46.581 -3.332 -32.455 302 HG3 GLU 43 HG3 GLU 43 -47.153 -4.958 -32.085 303 HA PRO 44 HA PRO 44 -46.840 -8.696 -34.945 304 HB2 PRO 44 HB2 PRO 44 -46.333 -10.731 -33.205 305 HB3 PRO 44 HB3 PRO 44 -45.225 -10.295 -34.522 306 HG2 PRO 44 HG2 PRO 44 -45.099 -9.574 -31.628 307 HG3 PRO 44 HG3 PRO 44 -43.803 -10.115 -32.712 308 HD2 PRO 44 HD2 PRO 44 -44.149 -7.499 -32.080 309 HD3 PRO 44 HD3 PRO 44 -43.540 -8.011 -33.668 310 H GLU 45 H GLU 45 -48.810 -9.777 -34.318 311 HA GLU 45 HA GLU 45 -50.474 -8.323 -32.610 312 HB2 GLU 45 HB2 GLU 45 -51.205 -9.841 -34.477 313 HB3 GLU 45 HB3 GLU 45 -50.856 -11.211 -33.426 314 HG2 GLU 45 HG2 GLU 45 -52.458 -10.340 -31.758 315 HG3 GLU 45 HG3 GLU 45 -52.812 -8.974 -32.813 316 HA PRO 46 HA PRO 46 -49.147 -9.980 -28.639 317 HB2 PRO 46 HB2 PRO 46 -51.230 -9.224 -27.057 318 HB3 PRO 46 HB3 PRO 46 -50.015 -8.078 -27.655 319 HG2 PRO 46 HG2 PRO 46 -52.754 -8.644 -28.699 320 HG3 PRO 46 HG3 PRO 46 -51.943 -7.087 -28.448 321 HD2 PRO 46 HD2 PRO 46 -52.101 -8.238 -30.899 322 HD3 PRO 46 HD3 PRO 46 -50.705 -7.254 -30.405 323 H VAL 47 H VAL 47 -49.532 -11.726 -27.257 324 HA VAL 47 HA VAL 47 -51.726 -13.534 -28.078 325 HB VAL 47 HB VAL 47 -50.293 -15.382 -27.253 326 HG11 VAL 47 HG11 VAL 47 -50.251 -14.680 -29.631 327 HG12 VAL 47 HG12 VAL 47 -48.688 -15.309 -29.107 328 HG13 VAL 47 HG13 VAL 47 -48.930 -13.569 -29.267 329 HG21 VAL 47 HG21 VAL 47 -48.988 -13.931 -25.631 330 HG22 VAL 47 HG22 VAL 47 -48.116 -13.278 -27.019 331 HG23 VAL 47 HG23 VAL 47 -47.991 -14.994 -26.625 332 H SER 48 H SER 48 -51.401 -11.358 -25.805 333 HA SER 48 HA SER 48 -52.184 -11.052 -23.677 334 HB2 SER 48 HB2 SER 48 -54.183 -12.196 -24.784 335 HB3 SER 48 HB3 SER 48 -53.640 -13.681 -24.010 336 HG SER 48 HG SER 48 -54.316 -12.942 -22.155 337 H PHE 49 H PHE 49 -49.697 -11.879 -23.639 338 HA PHE 49 HA PHE 49 -49.572 -13.724 -21.350 339 HB2 PHE 49 HB2 PHE 49 -49.002 -15.000 -23.410 340 HB3 PHE 49 HB3 PHE 49 -47.717 -13.841 -23.750 341 HD1 PHE 49 HD1 PHE 49 -48.902 -16.388 -21.305 342 HD2 PHE 49 HD2 PHE 49 -45.607 -13.967 -22.627 343 HE1 PHE 49 HE1 PHE 49 -47.373 -17.658 -19.823 344 HE2 PHE 49 HE2 PHE 49 -44.079 -15.238 -21.144 345 HZ PHE 49 HZ PHE 49 -44.963 -17.084 -19.742 346 H ASP 50 H ASP 50 -48.535 -12.779 -19.729 347 HA ASP 50 HA ASP 50 -46.994 -10.349 -20.185 348 HB2 ASP 50 HB2 ASP 50 -47.082 -10.072 -17.781 349 HB3 ASP 50 HB3 ASP 50 -48.689 -10.479 -18.376 350 H ASP 51 H ASP 51 -45.053 -10.226 -18.441 351 HA ASP 51 HA ASP 51 -43.012 -11.912 -19.479 352 HB2 ASP 51 HB2 ASP 51 -42.989 -10.206 -16.975 353 HB3 ASP 51 HB3 ASP 51 -41.568 -10.882 -17.769 354 H GLU 52 H GLU 52 -44.195 -11.691 -16.102 355 HA GLU 52 HA GLU 52 -44.070 -14.618 -15.900 356 HB2 GLU 52 HB2 GLU 52 -41.899 -13.597 -15.074 357 HB3 GLU 52 HB3 GLU 52 -42.844 -12.820 -13.802 358 HG2 GLU 52 HG2 GLU 52 -43.652 -15.027 -13.050 359 HG3 GLU 52 HG3 GLU 52 -42.716 -15.807 -14.322 360 H VAL 53 H VAL 53 -44.617 -11.762 -13.812 361 HA VAL 53 HA VAL 53 -47.407 -12.378 -13.541 362 HB VAL 53 HB VAL 53 -46.429 -14.040 -11.999 363 HG11 VAL 53 HG11 VAL 53 -44.389 -12.601 -11.481 364 HG12 VAL 53 HG12 VAL 53 -45.117 -13.425 -10.102 365 HG13 VAL 53 HG13 VAL 53 -45.419 -11.707 -10.361 366 HG21 VAL 53 HG21 VAL 53 -48.630 -12.896 -11.512 367 HG22 VAL 53 HG22 VAL 53 -47.756 -11.801 -10.443 368 HG23 VAL 53 HG23 VAL 53 -47.807 -13.528 -10.086 369 H LEU 54 H LEU 54 -48.599 -10.676 -12.787 370 HA LEU 54 HA LEU 54 -47.118 -8.225 -12.028 371 HB2 LEU 54 HB2 LEU 54 -49.665 -8.468 -13.660 372 HB3 LEU 54 HB3 LEU 54 -48.936 -6.951 -13.137 373 HG LEU 54 HG LEU 54 -47.482 -8.996 -14.845 374 HD11 LEU 54 HD11 LEU 54 -48.958 -6.472 -15.664 375 HD12 LEU 54 HD12 LEU 54 -49.439 -8.122 -16.056 376 HD13 LEU 54 HD13 LEU 54 -47.954 -7.453 -16.730 377 HD21 LEU 54 HD21 LEU 54 -45.947 -7.522 -13.699 378 HD22 LEU 54 HD22 LEU 54 -46.942 -6.113 -14.061 379 HD23 LEU 54 HD23 LEU 54 -46.077 -6.936 -15.357 380 H GLU 55 H GLU 55 -48.095 -6.888 -10.433 381 HA GLU 55 HA GLU 55 -50.603 -7.204 -9.279 382 HB2 GLU 55 HB2 GLU 55 -48.684 -9.228 -8.394 383 HB3 GLU 55 HB3 GLU 55 -49.208 -8.232 -7.041 384 HG2 GLU 55 HG2 GLU 55 -51.181 -9.465 -8.978 385 HG3 GLU 55 HG3 GLU 55 -50.613 -10.323 -7.547 386 H LEU 56 H LEU 56 -47.355 -6.969 -7.818 387 HA LEU 56 HA LEU 56 -47.869 -4.120 -7.228 388 HB2 LEU 56 HB2 LEU 56 -46.849 -6.258 -5.350 389 HB3 LEU 56 HB3 LEU 56 -46.647 -4.535 -5.034 390 HG LEU 56 HG LEU 56 -49.349 -5.788 -5.593 391 HD11 LEU 56 HD11 LEU 56 -49.711 -5.787 -3.170 392 HD12 LEU 56 HD12 LEU 56 -48.082 -5.165 -2.906 393 HD13 LEU 56 HD13 LEU 56 -48.311 -6.787 -3.560 394 HD21 LEU 56 HD21 LEU 56 -50.075 -3.687 -4.339 395 HD22 LEU 56 HD22 LEU 56 -49.353 -3.400 -5.922 396 HD23 LEU 56 HD23 LEU 56 -48.404 -3.138 -4.459 397 H THR 57 H THR 57 -46.290 -5.514 -9.332 398 HA THR 57 HA THR 57 -43.556 -4.642 -8.613 399 HB THR 57 HB THR 57 -42.804 -6.097 -10.471 400 HG1 THR 57 HG1 THR 57 -44.739 -6.035 -11.670 401 HG21 THR 57 HG21 THR 57 -42.812 -7.032 -8.240 402 HG22 THR 57 HG22 THR 57 -43.406 -8.266 -9.352 403 HG23 THR 57 HG23 THR 57 -44.539 -7.372 -8.340 404 H ASP 58 H ASP 58 -46.172 -3.398 -10.166 405 HA ASP 58 HA ASP 58 -45.023 -2.489 -12.617 406 HB2 ASP 58 HB2 ASP 58 -47.420 -1.530 -11.039 407 HB3 ASP 58 HB3 ASP 58 -46.982 -0.920 -12.630 408 HA PRO 59 HA PRO 59 -42.662 0.870 -10.865 409 HB2 PRO 59 HB2 PRO 59 -42.302 2.482 -13.021 410 HB3 PRO 59 HB3 PRO 59 -41.482 0.914 -12.859 411 HG2 PRO 59 HG2 PRO 59 -43.918 1.626 -14.428 412 HG3 PRO 59 HG3 PRO 59 -42.539 0.612 -14.885 413 HD2 PRO 59 HD2 PRO 59 -44.915 -0.432 -14.033 414 HD3 PRO 59 HD3 PRO 59 -43.355 -1.244 -13.776 415 H ILE 60 H ILE 60 -42.869 3.018 -10.093 416 HA ILE 60 HA ILE 60 -45.463 4.335 -10.661 417 HB ILE 60 HB ILE 60 -44.032 4.478 -7.994 418 HG12 ILE 60 HG12 ILE 60 -46.199 2.982 -7.380 419 HG13 ILE 60 HG13 ILE 60 -45.994 2.442 -9.043 420 HG21 ILE 60 HG21 ILE 60 -46.830 5.193 -8.920 421 HG22 ILE 60 HG22 ILE 60 -45.547 6.325 -8.494 422 HG23 ILE 60 HG23 ILE 60 -46.264 5.297 -7.254 423 HD11 ILE 60 HD11 ILE 60 -43.463 2.138 -8.303 424 HD12 ILE 60 HD12 ILE 60 -44.661 0.909 -7.907 425 HD13 ILE 60 HD13 ILE 60 -44.169 2.084 -6.688 426 H ALA 61 H ALA 61 -44.632 5.731 -12.180 427 HA ALA 61 HA ALA 61 -43.517 7.543 -13.044 428 HB1 ALA 61 HB1 ALA 61 -45.011 8.608 -11.373 429 HB2 ALA 61 HB2 ALA 61 -43.516 9.512 -11.607 430 HB3 ALA 61 HB3 ALA 61 -43.719 8.499 -10.177 431 HA PRO 62 HA PRO 62 -39.371 5.984 -11.223 432 HB2 PRO 62 HB2 PRO 62 -38.862 5.488 -14.119 433 HB3 PRO 62 HB3 PRO 62 -38.485 4.471 -12.713 434 HG2 PRO 62 HG2 PRO 62 -40.462 3.825 -14.332 435 HG3 PRO 62 HG3 PRO 62 -40.629 3.637 -12.575 436 HD2 PRO 62 HD2 PRO 62 -41.739 5.804 -14.348 437 HD3 PRO 62 HD3 PRO 62 -42.517 4.944 -13.000 438 H GLU 63 H GLU 63 -37.419 7.113 -11.298 439 HA GLU 63 HA GLU 63 -37.284 9.441 -13.120 440 HB2 GLU 63 HB2 GLU 63 -37.933 10.081 -10.779 441 HB3 GLU 63 HB3 GLU 63 -36.399 9.418 -10.222 442 HG2 GLU 63 HG2 GLU 63 -35.186 10.984 -11.698 443 HG3 GLU 63 HG3 GLU 63 -36.721 11.653 -12.248 444 HA PRO 64 HA PRO 64 -33.511 6.735 -13.694 445 HB2 PRO 64 HB2 PRO 64 -33.520 8.221 -16.281 446 HB3 PRO 64 HB3 PRO 64 -33.313 6.486 -15.973 447 HG2 PRO 64 HG2 PRO 64 -35.575 7.395 -16.977 448 HG3 PRO 64 HG3 PRO 64 -35.587 6.123 -15.738 449 HD2 PRO 64 HD2 PRO 64 -36.151 9.064 -15.420 450 HD3 PRO 64 HD3 PRO 64 -37.001 7.672 -14.704 451 H GLU 65 H GLU 65 -31.383 7.260 -13.450 452 HA GLU 65 HA GLU 65 -30.715 9.948 -12.672 453 HB2 GLU 65 HB2 GLU 65 -28.974 7.492 -13.029 454 HB3 GLU 65 HB3 GLU 65 -28.448 9.010 -12.301 455 HG2 GLU 65 HG2 GLU 65 -30.193 8.778 -10.564 456 HG3 GLU 65 HG3 GLU 65 -30.696 7.249 -11.283 457 H LEU 66 H LEU 66 -29.073 11.272 -13.625 458 HA LEU 66 HA LEU 66 -28.932 10.975 -16.549 459 HB2 LEU 66 HB2 LEU 66 -28.550 13.360 -14.731 460 HB3 LEU 66 HB3 LEU 66 -28.135 13.390 -16.441 461 HG LEU 66 HG LEU 66 -30.522 12.661 -16.924 462 HD11 LEU 66 HD11 LEU 66 -32.129 13.353 -15.005 463 HD12 LEU 66 HD12 LEU 66 -30.726 13.159 -13.952 464 HD13 LEU 66 HD13 LEU 66 -31.327 11.787 -14.881 465 HD21 LEU 66 HD21 LEU 66 -29.942 14.942 -17.319 466 HD22 LEU 66 HD22 LEU 66 -29.899 15.307 -15.596 467 HD23 LEU 66 HD23 LEU 66 -31.440 14.988 -16.391 468 HA PRO 67 HA PRO 67 -24.614 9.987 -16.650 469 HB2 PRO 67 HB2 PRO 67 -24.137 12.298 -18.481 470 HB3 PRO 67 HB3 PRO 67 -23.755 10.578 -18.710 471 HG2 PRO 67 HG2 PRO 67 -25.773 11.676 -20.005 472 HG3 PRO 67 HG3 PRO 67 -25.924 10.045 -19.319 473 HD2 PRO 67 HD2 PRO 67 -27.015 12.642 -18.259 474 HD3 PRO 67 HD3 PRO 67 -27.784 11.038 -18.315 475 HA PRO 68 HA PRO 68 -22.674 12.781 -13.715 476 HB2 PRO 68 HB2 PRO 68 -20.082 11.962 -13.794 477 HB3 PRO 68 HB3 PRO 68 -21.368 11.007 -13.027 478 HG2 PRO 68 HG2 PRO 68 -20.147 10.705 -15.735 479 HG3 PRO 68 HG3 PRO 68 -20.549 9.461 -14.534 480 HD2 PRO 68 HD2 PRO 68 -22.152 9.975 -16.668 481 HD3 PRO 68 HD3 PRO 68 -22.802 9.449 -15.100 482 H LEU 69 H LEU 69 -21.092 14.528 -13.531 483 HA LEU 69 HA LEU 69 -20.283 15.638 -16.155 484 HB2 LEU 69 HB2 LEU 69 -21.162 17.107 -13.654 485 HB3 LEU 69 HB3 LEU 69 -20.573 17.877 -15.124 486 HG LEU 69 HG LEU 69 -22.977 16.025 -15.067 487 HD11 LEU 69 HD11 LEU 69 -22.896 19.059 -15.055 488 HD12 LEU 69 HD12 LEU 69 -23.357 18.054 -13.680 489 HD13 LEU 69 HD13 LEU 69 -24.348 18.061 -15.139 490 HD21 LEU 69 HD21 LEU 69 -23.447 17.188 -17.248 491 HD22 LEU 69 HD22 LEU 69 -21.958 16.243 -17.276 492 HD23 LEU 69 HD23 LEU 69 -21.888 17.999 -17.108 493 H GLU 70 H GLU 70 -18.275 16.634 -16.299 494 HA GLU 70 HA GLU 70 -16.016 16.839 -15.897 495 HB2 GLU 70 HB2 GLU 70 -17.349 17.602 -13.321 496 HB3 GLU 70 HB3 GLU 70 -15.594 17.415 -13.324 497 HG2 GLU 70 HG2 GLU 70 -17.100 19.150 -15.302 498 HG3 GLU 70 HG3 GLU 70 -16.386 19.761 -13.811 499 H THR 71 H THR 71 -14.215 16.084 -14.213 500 HA THR 71 HA THR 71 -14.771 13.277 -13.452 501 HB THR 71 HB THR 71 -12.245 14.310 -14.780 502 HG1 THR 71 HG1 THR 71 -14.297 12.603 -15.736 503 HG21 THR 71 HG21 THR 71 -13.094 11.480 -14.094 504 HG22 THR 71 HG22 THR 71 -11.919 12.420 -13.174 505 HG23 THR 71 HG23 THR 71 -11.574 11.966 -14.843 506 H VAL 72 H VAL 72 -14.272 12.839 -11.397 507 HA VAL 72 HA VAL 72 -12.214 14.448 -10.029 508 HB VAL 72 HB VAL 72 -13.628 14.525 -7.996 509 HG11 VAL 72 HG11 VAL 72 -13.591 16.422 -9.580 510 HG12 VAL 72 HG12 VAL 72 -15.171 16.261 -8.808 511 HG13 VAL 72 HG13 VAL 72 -14.936 15.703 -10.464 512 HG21 VAL 72 HG21 VAL 72 -15.074 12.588 -8.440 513 HG22 VAL 72 HG22 VAL 72 -15.758 13.401 -9.848 514 HG23 VAL 72 HG23 VAL 72 -16.060 14.035 -8.232 515 H GLY 73 H GLY 73 -11.293 13.419 -8.140 516 HA2 GLY 73 HA2 GLY 73 -11.815 10.565 -7.778 517 HA3 GLY 73 HA3 GLY 73 -10.214 10.999 -8.365 518 H ASP 74 H ASP 74 -12.187 10.616 -5.632 519 HA ASP 74 HA ASP 74 -10.225 11.978 -3.888 520 HB2 ASP 74 HB2 ASP 74 -12.553 12.831 -3.720 521 HB3 ASP 74 HB3 ASP 74 -13.094 11.214 -3.287 522 H ILE 75 H ILE 75 -8.753 10.456 -3.401 523 HA ILE 75 HA ILE 75 -9.612 7.738 -2.824 524 HB ILE 75 HB ILE 75 -7.639 8.059 -4.246 525 HG12 ILE 75 HG12 ILE 75 -6.696 6.943 -1.593 526 HG13 ILE 75 HG13 ILE 75 -7.881 6.103 -2.593 527 HG21 ILE 75 HG21 ILE 75 -5.713 9.213 -3.632 528 HG22 ILE 75 HG22 ILE 75 -6.042 9.081 -1.907 529 HG23 ILE 75 HG23 ILE 75 -6.957 10.217 -2.893 530 HD11 ILE 75 HD11 ILE 75 -6.301 6.023 -4.459 531 HD12 ILE 75 HD12 ILE 75 -5.550 5.325 -3.023 532 HD13 ILE 75 HD13 ILE 75 -5.124 6.958 -3.535 533 H ASP 76 H ASP 76 -10.789 8.141 -0.947 534 HA ASP 76 HA ASP 76 -9.518 9.299 1.376 535 HB2 ASP 76 HB2 ASP 76 -12.102 9.139 0.654 536 HB3 ASP 76 HB3 ASP 76 -12.014 7.701 1.666 537 H VAL 77 H VAL 77 -9.603 7.989 3.491 538 HA VAL 77 HA VAL 77 -8.478 5.300 2.950 539 HB VAL 77 HB VAL 77 -7.960 7.156 5.298 540 HG11 VAL 77 HG11 VAL 77 -7.772 4.763 5.903 541 HG12 VAL 77 HG12 VAL 77 -6.190 5.543 5.891 542 HG13 VAL 77 HG13 VAL 77 -6.672 4.510 4.545 543 HG21 VAL 77 HG21 VAL 77 -6.930 7.984 3.234 544 HG22 VAL 77 HG22 VAL 77 -6.249 6.390 2.909 545 HG23 VAL 77 HG23 VAL 77 -5.684 7.326 4.294 546 H TYR 78 H TYR 78 -10.041 3.847 3.224 547 HA TYR 78 HA TYR 78 -11.355 3.696 5.845 548 HB2 TYR 78 HB2 TYR 78 -12.814 3.515 3.201 549 HB3 TYR 78 HB3 TYR 78 -13.503 3.041 4.752 550 HD1 TYR 78 HD1 TYR 78 -12.942 5.771 2.501 551 HD2 TYR 78 HD2 TYR 78 -13.486 4.800 6.650 552 HE1 TYR 78 HE1 TYR 78 -13.574 8.120 2.971 553 HE2 TYR 78 HE2 TYR 78 -14.115 7.151 7.120 554 HH TYR 78 HH TYR 78 -15.173 9.119 5.536 555 H SER 79 H SER 79 -11.208 1.705 6.678 556 HA SER 79 HA SER 79 -10.664 -0.516 6.876 557 HB2 SER 79 HB2 SER 79 -12.897 -0.591 5.663 558 HB3 SER 79 HB3 SER 79 -11.988 -0.819 4.174 559 HG SER 79 HG SER 79 -11.705 -2.432 6.493 560 HA PRO 80 HA PRO 80 -6.996 -0.052 3.992 561 HB2 PRO 80 HB2 PRO 80 -5.050 -0.405 5.868 562 HB3 PRO 80 HB3 PRO 80 -5.796 1.173 5.540 563 HG2 PRO 80 HG2 PRO 80 -6.385 -0.779 7.721 564 HG3 PRO 80 HG3 PRO 80 -6.211 0.985 7.804 565 HD2 PRO 80 HD2 PRO 80 -8.646 -0.216 7.749 566 HD3 PRO 80 HD3 PRO 80 -8.359 1.373 7.005 567 HA PRO 81 HA PRO 81 -6.410 -4.435 3.362 568 HB2 PRO 81 HB2 PRO 81 -3.490 -3.915 2.993 569 HB3 PRO 81 HB3 PRO 81 -4.640 -4.725 1.909 570 HG2 PRO 81 HG2 PRO 81 -3.791 -2.290 1.366 571 HG3 PRO 81 HG3 PRO 81 -5.490 -2.732 1.104 572 HD2 PRO 81 HD2 PRO 81 -4.286 -1.128 3.347 573 HD3 PRO 81 HD3 PRO 81 -5.811 -0.869 2.468 574 H GLU 82 H GLU 82 -5.787 -6.289 4.480 575 HA GLU 82 HA GLU 82 -3.787 -6.168 6.571 576 HB2 GLU 82 HB2 GLU 82 -6.725 -6.252 7.152 577 HB3 GLU 82 HB3 GLU 82 -5.658 -7.241 8.147 578 HG2 GLU 82 HG2 GLU 82 -4.314 -5.237 8.690 579 HG3 GLU 82 HG3 GLU 82 -5.385 -4.251 7.698 580 HA PRO 83 HA PRO 83 -5.027 -10.755 6.013 581 HB2 PRO 83 HB2 PRO 83 -7.208 -11.491 4.585 582 HB3 PRO 83 HB3 PRO 83 -7.313 -11.049 6.300 583 HG2 PRO 83 HG2 PRO 83 -7.932 -9.407 3.884 584 HG3 PRO 83 HG3 PRO 83 -8.844 -9.573 5.397 585 HD2 PRO 83 HD2 PRO 83 -7.210 -7.451 4.906 586 HD3 PRO 83 HD3 PRO 83 -7.489 -8.088 6.541 587 H GLU 84 H GLU 84 -4.494 -12.315 4.333 588 HA GLU 84 HA GLU 84 -3.520 -11.016 1.896 589 HB2 GLU 84 HB2 GLU 84 -2.236 -13.099 1.549 590 HB3 GLU 84 HB3 GLU 84 -1.911 -12.381 3.122 591 HG2 GLU 84 HG2 GLU 84 -3.517 -13.965 4.165 592 HG3 GLU 84 HG3 GLU 84 -3.803 -14.695 2.589 593 H SER 85 H SER 85 -4.359 -11.315 -0.063 594 HA SER 85 HA SER 85 -5.876 -13.643 -0.807 595 HB2 SER 85 HB2 SER 85 -7.614 -12.442 0.444 596 HB3 SER 85 HB3 SER 85 -7.330 -11.000 -0.526 597 HG SER 85 HG SER 85 -9.098 -12.406 -1.223 598 H GLU 86 H GLU 86 -5.974 -13.863 -3.029 599 HA GLU 86 HA GLU 86 -5.280 -11.546 -4.690 600 HB2 GLU 86 HB2 GLU 86 -3.171 -12.786 -4.110 601 HB3 GLU 86 HB3 GLU 86 -3.834 -14.192 -4.943 602 HG2 GLU 86 HG2 GLU 86 -2.421 -12.992 -6.502 603 HG3 GLU 86 HG3 GLU 86 -4.096 -12.785 -7.001 604 HA PRO 87 HA PRO 87 -8.631 -14.280 -6.524 605 HB2 PRO 87 HB2 PRO 87 -10.463 -12.333 -7.020 606 HB3 PRO 87 HB3 PRO 87 -10.335 -13.137 -5.442 607 HG2 PRO 87 HG2 PRO 87 -9.266 -10.487 -6.307 608 HG3 PRO 87 HG3 PRO 87 -10.087 -10.933 -4.799 609 HD2 PRO 87 HD2 PRO 87 -7.377 -10.690 -4.964 610 HD3 PRO 87 HD3 PRO 87 -8.169 -11.835 -3.858 611 H ALA 88 H ALA 88 -9.108 -14.507 -8.740 612 HA ALA 88 HA ALA 88 -8.437 -12.397 -10.616 613 HB1 ALA 88 HB1 ALA 88 -6.973 -14.976 -11.035 614 HB2 ALA 88 HB2 ALA 88 -6.293 -13.760 -9.952 615 HB3 ALA 88 HB3 ALA 88 -6.597 -13.364 -11.643 616 H TYR 89 H TYR 89 -9.341 -12.675 -12.621 617 HA TYR 89 HA TYR 89 -10.805 -15.181 -13.155 618 HB2 TYR 89 HB2 TYR 89 -11.946 -12.385 -13.412 619 HB3 TYR 89 HB3 TYR 89 -12.736 -13.856 -13.975 620 HD1 TYR 89 HD1 TYR 89 -11.780 -11.867 -11.040 621 HD2 TYR 89 HD2 TYR 89 -13.575 -15.532 -12.378 622 HE1 TYR 89 HE1 TYR 89 -12.697 -12.247 -8.769 623 HE2 TYR 89 HE2 TYR 89 -14.493 -15.914 -10.107 624 HH TYR 89 HH TYR 89 -13.429 -14.321 -7.406 625 H THR 90 H THR 90 -11.009 -15.710 -15.348 626 HA THR 90 HA THR 90 -9.303 -14.113 -17.161 627 HB THR 90 HB THR 90 -10.074 -17.037 -17.352 628 HG1 THR 90 HG1 THR 90 -8.580 -17.223 -15.903 629 HG21 THR 90 HG21 THR 90 -8.110 -17.034 -18.964 630 HG22 THR 90 HG22 THR 90 -8.173 -15.272 -18.914 631 HG23 THR 90 HG23 THR 90 -9.545 -16.186 -19.536 632 HA PRO 91 HA PRO 91 -13.488 -13.290 -18.960 633 HB2 PRO 91 HB2 PRO 91 -11.855 -11.580 -20.778 634 HB3 PRO 91 HB3 PRO 91 -13.319 -11.174 -19.858 635 HG2 PRO 91 HG2 PRO 91 -10.957 -10.262 -19.101 636 HG3 PRO 91 HG3 PRO 91 -12.146 -10.811 -17.903 637 HD2 PRO 91 HD2 PRO 91 -9.705 -12.242 -18.923 638 HD3 PRO 91 HD3 PRO 91 -10.337 -12.138 -17.263 639 HA PRO 92 HA PRO 92 -13.076 -16.133 -22.414 640 HB2 PRO 92 HB2 PRO 92 -15.343 -15.615 -23.840 641 HB3 PRO 92 HB3 PRO 92 -15.356 -16.494 -22.300 642 HG2 PRO 92 HG2 PRO 92 -15.966 -13.624 -22.844 643 HG3 PRO 92 HG3 PRO 92 -16.817 -14.778 -21.801 644 HD2 PRO 92 HD2 PRO 92 -15.088 -12.938 -20.797 645 HD3 PRO 92 HD3 PRO 92 -15.295 -14.545 -20.063 646 HA PRO 93 HA PRO 93 -11.218 -13.747 -25.710 647 HB2 PRO 93 HB2 PRO 93 -11.286 -15.486 -27.813 648 HB3 PRO 93 HB3 PRO 93 -10.173 -15.670 -26.442 649 HG2 PRO 93 HG2 PRO 93 -12.768 -17.047 -26.967 650 HG3 PRO 93 HG3 PRO 93 -11.238 -17.714 -26.370 651 HD2 PRO 93 HD2 PRO 93 -13.307 -17.135 -24.703 652 HD3 PRO 93 HD3 PRO 93 -11.611 -16.986 -24.195 653 H ALA 94 H ALA 94 -11.749 -12.422 -27.441 654 HA ALA 94 HA ALA 94 -14.406 -12.709 -28.675 655 HB1 ALA 94 HB1 ALA 94 -14.542 -10.144 -28.456 656 HB2 ALA 94 HB2 ALA 94 -13.329 -10.332 -27.186 657 HB3 ALA 94 HB3 ALA 94 -14.903 -11.112 -27.025 658 H ALA 95 H ALA 95 -11.361 -10.893 -28.676 659 HA ALA 95 HA ALA 95 -10.919 -11.402 -31.454 660 HB1 ALA 95 HB1 ALA 95 -11.344 -8.495 -30.978 661 HB2 ALA 95 HB2 ALA 95 -12.781 -9.522 -31.118 662 HB3 ALA 95 HB3 ALA 95 -11.604 -9.453 -32.442 663 HA PRO 96 HA PRO 96 -6.839 -10.248 -30.131 664 HB2 PRO 96 HB2 PRO 96 -5.582 -9.535 -32.423 665 HB3 PRO 96 HB3 PRO 96 -6.089 -11.208 -32.102 666 HG2 PRO 96 HG2 PRO 96 -7.392 -9.125 -33.789 667 HG3 PRO 96 HG3 PRO 96 -7.171 -10.856 -34.101 668 HD2 PRO 96 HD2 PRO 96 -9.529 -9.769 -33.182 669 HD3 PRO 96 HD3 PRO 96 -9.035 -11.449 -32.881 670 H VAL 97 H VAL 97 -7.899 -8.373 -28.972 671 HA VAL 97 HA VAL 97 -7.042 -5.771 -30.113 672 HB VAL 97 HB VAL 97 -9.269 -6.333 -28.122 673 HG11 VAL 97 HG11 VAL 97 -9.806 -3.933 -28.407 674 HG12 VAL 97 HG12 VAL 97 -8.384 -3.739 -29.431 675 HG13 VAL 97 HG13 VAL 97 -8.193 -4.150 -27.726 676 HG21 VAL 97 HG21 VAL 97 -9.942 -7.023 -30.342 677 HG22 VAL 97 HG22 VAL 97 -9.289 -5.545 -31.050 678 HG23 VAL 97 HG23 VAL 97 -10.710 -5.470 -30.007 679 H PHE 98 H PHE 98 -5.372 -4.865 -29.124 680 HA PHE 98 HA PHE 98 -5.014 -5.149 -26.230 681 HB2 PHE 98 HB2 PHE 98 -3.707 -6.996 -27.273 682 HB3 PHE 98 HB3 PHE 98 -2.815 -5.801 -28.216 683 HD1 PHE 98 HD1 PHE 98 -3.566 -6.945 -24.750 684 HD2 PHE 98 HD2 PHE 98 -1.014 -4.558 -27.249 685 HE1 PHE 98 HE1 PHE 98 -2.015 -6.611 -22.847 686 HE2 PHE 98 HE2 PHE 98 0.538 -4.225 -25.343 687 HZ PHE 98 HZ PHE 98 0.037 -5.252 -23.143 688 H ASP 99 H ASP 99 -4.546 -3.214 -25.381 689 HA ASP 99 HA ASP 99 -3.659 -1.058 -27.182 690 HB2 ASP 99 HB2 ASP 99 -4.871 -0.918 -24.411 691 HB3 ASP 99 HB3 ASP 99 -4.475 0.462 -25.434 692 H ARG 100 H ARG 100 -2.155 0.553 -26.253 693 HA ARG 100 HA ARG 100 0.235 -0.673 -25.322 694 HB2 ARG 100 HB2 ARG 100 -0.542 2.262 -25.308 695 HB3 ARG 100 HB3 ARG 100 1.091 1.634 -25.103 696 HG2 ARG 100 HG2 ARG 100 -0.590 1.052 -27.554 697 HG3 ARG 100 HG3 ARG 100 0.504 2.429 -27.456 698 HD2 ARG 100 HD2 ARG 100 2.387 0.883 -26.992 699 HD3 ARG 100 HD3 ARG 100 1.286 -0.485 -27.137 700 HE ARG 100 HE ARG 100 1.290 -0.202 -29.456 701 HH11 ARG 100 HH11 ARG 100 2.859 2.534 -27.927 702 HH12 ARG 100 HH12 ARG 100 3.466 3.165 -29.418 703 HH21 ARG 100 HH21 ARG 100 2.093 0.660 -31.373 704 HH22 ARG 100 HH22 ARG 100 3.035 2.114 -31.354 705 H ASP 101 H ASP 101 -0.048 -1.741 -23.405 706 HA ASP 101 HA ASP 101 -0.745 -0.086 -21.050 707 HB2 ASP 101 HB2 ASP 101 -2.511 -1.758 -21.684 708 HB3 ASP 101 HB3 ASP 101 -1.327 -3.031 -21.419 709 H GLU 102 H GLU 102 1.222 0.322 -20.184 710 HA GLU 102 HA GLU 102 3.188 -1.852 -19.944 711 HB2 GLU 102 HB2 GLU 102 3.403 1.115 -19.372 712 HB3 GLU 102 HB3 GLU 102 4.717 -0.043 -19.171 713 HG2 GLU 102 HG2 GLU 102 5.175 0.710 -21.311 714 HG3 GLU 102 HG3 GLU 102 4.131 -0.651 -21.696 715 H VAL 103 H VAL 103 1.483 0.531 -17.954 716 HA VAL 103 HA VAL 103 2.435 -0.433 -15.446 717 HB VAL 103 HB VAL 103 -0.041 1.204 -16.096 718 HG11 VAL 103 HG11 VAL 103 1.408 0.746 -13.466 719 HG12 VAL 103 HG12 VAL 103 -0.221 0.202 -13.866 720 HG13 VAL 103 HG13 VAL 103 0.119 1.926 -13.715 721 HG21 VAL 103 HG21 VAL 103 2.131 2.217 -16.800 722 HG22 VAL 103 HG22 VAL 103 2.709 2.065 -15.139 723 HG23 VAL 103 HG23 VAL 103 1.349 3.128 -15.508 724 H ALA 104 H ALA 104 1.729 -2.057 -14.187 725 HA ALA 104 HA ALA 104 -0.667 -3.557 -15.071 726 HB1 ALA 104 HB1 ALA 104 1.960 -4.477 -13.922 727 HB2 ALA 104 HB2 ALA 104 1.151 -5.010 -15.394 728 HB3 ALA 104 HB3 ALA 104 0.516 -5.485 -13.819 729 H GLU 105 H GLU 105 -2.139 -2.465 -13.784 730 HA GLU 105 HA GLU 105 -2.214 -3.308 -11.007 731 HB2 GLU 105 HB2 GLU 105 -0.929 -1.078 -11.120 732 HB3 GLU 105 HB3 GLU 105 -2.466 -0.354 -11.591 733 HG2 GLU 105 HG2 GLU 105 -2.250 -0.144 -9.186 734 HG3 GLU 105 HG3 GLU 105 -3.494 -1.341 -9.524 735 H GLN 106 H GLN 106 -4.320 -3.538 -10.306 736 HA GLN 106 HA GLN 106 -6.478 -2.292 -11.842 737 HB2 GLN 106 HB2 GLN 106 -6.132 -5.282 -11.519 738 HB3 GLN 106 HB3 GLN 106 -7.638 -4.519 -12.031 739 HG2 GLN 106 HG2 GLN 106 -6.458 -3.482 -13.941 740 HG3 GLN 106 HG3 GLN 106 -4.961 -4.263 -13.435 741 HE21 GLN 106 HE21 GLN 106 -4.659 -5.804 -15.091 742 HE22 GLN 106 HE22 GLN 106 -5.805 -6.989 -15.497 743 H LEU 107 H LEU 107 -5.688 -1.578 -9.322 744 HA LEU 107 HA LEU 107 -6.987 -2.945 -7.194 745 HB2 LEU 107 HB2 LEU 107 -6.165 -0.037 -7.451 746 HB3 LEU 107 HB3 LEU 107 -6.644 -0.822 -5.946 747 HG LEU 107 HG LEU 107 -4.353 -1.810 -7.661 748 HD11 LEU 107 HD11 LEU 107 -2.836 -0.568 -6.328 749 HD12 LEU 107 HD12 LEU 107 -4.062 -0.194 -5.121 750 HD13 LEU 107 HD13 LEU 107 -4.114 0.585 -6.702 751 HD21 LEU 107 HD21 LEU 107 -5.159 -3.514 -6.161 752 HD22 LEU 107 HD22 LEU 107 -5.300 -2.363 -4.831 753 HD23 LEU 107 HD23 LEU 107 -3.707 -2.845 -5.416 754 H VAL 108 H VAL 108 -9.128 -3.161 -6.894 755 HA VAL 108 HA VAL 108 -11.047 -1.625 -8.333 756 HB VAL 108 HB VAL 108 -11.399 -3.984 -7.658 757 HG11 VAL 108 HG11 VAL 108 -11.839 -2.929 -4.856 758 HG12 VAL 108 HG12 VAL 108 -10.330 -3.681 -5.369 759 HG13 VAL 108 HG13 VAL 108 -11.829 -4.611 -5.388 760 HG21 VAL 108 HG21 VAL 108 -13.431 -2.109 -6.414 761 HG22 VAL 108 HG22 VAL 108 -13.733 -3.740 -7.009 762 HG23 VAL 108 HG23 VAL 108 -13.319 -2.453 -8.140 763 H GLY 109 H GLY 109 -9.682 -1.432 -5.096 764 HA2 GLY 109 HA2 GLY 109 -9.569 0.699 -3.961 765 HA3 GLY 109 HA3 GLY 109 -11.121 1.115 -4.683 766 H VAL 110 H VAL 110 -12.597 1.257 -3.138 767 HA VAL 110 HA VAL 110 -12.716 -0.863 -1.074 768 HB VAL 110 HB VAL 110 -13.636 0.826 0.486 769 HG11 VAL 110 HG11 VAL 110 -11.506 2.047 0.854 770 HG12 VAL 110 HG12 VAL 110 -10.953 1.530 -0.740 771 HG13 VAL 110 HG13 VAL 110 -11.238 0.335 0.526 772 HG21 VAL 110 HG21 VAL 110 -14.599 2.462 -0.983 773 HG22 VAL 110 HG22 VAL 110 -13.074 2.692 -1.835 774 HG23 VAL 110 HG23 VAL 110 -13.252 3.266 -0.177 775 H SER 111 H SER 111 -14.928 -1.048 -0.076 776 HA SER 111 HA SER 111 -17.192 -0.231 -1.668 777 HB2 SER 111 HB2 SER 111 -17.938 -2.458 -2.274 778 HB3 SER 111 HB3 SER 111 -16.321 -2.210 -2.927 779 HG SER 111 HG SER 111 -15.650 -3.781 -1.712 780 H ALA 112 H ALA 112 -19.243 -0.954 -0.656 781 HA ALA 112 HA ALA 112 -19.116 -0.718 2.182 782 HB1 ALA 112 HB1 ALA 112 -21.177 0.041 1.677 783 HB2 ALA 112 HB2 ALA 112 -21.677 -1.649 1.587 784 HB3 ALA 112 HB3 ALA 112 -21.186 -0.794 0.125 785 H ALA 113 H ALA 113 -20.478 -3.373 0.214 786 HA ALA 113 HA ALA 113 -20.769 -5.612 0.682 787 HB1 ALA 113 HB1 ALA 113 -18.606 -6.668 1.641 788 HB2 ALA 113 HB2 ALA 113 -17.933 -5.042 1.515 789 HB3 ALA 113 HB3 ALA 113 -18.517 -5.870 0.071 790 H SER 114 H SER 114 -21.681 -3.729 2.734 791 HA SER 114 HA SER 114 -22.223 -5.592 4.843 792 HB2 SER 114 HB2 SER 114 -19.927 -4.783 5.467 793 HB3 SER 114 HB3 SER 114 -20.581 -3.150 5.566 794 HG SER 114 HG SER 114 -20.978 -3.768 7.554 795 H ALA 115 H ALA 115 -23.327 -4.175 6.749 796 HA ALA 115 HA ALA 115 -24.897 -2.002 5.534 797 HB1 ALA 115 HB1 ALA 115 -26.552 -3.579 5.324 798 HB2 ALA 115 HB2 ALA 115 -26.817 -3.152 7.017 799 HB3 ALA 115 HB3 ALA 115 -25.890 -4.597 6.603 800 H ALA 116 H ALA 116 -25.351 -0.359 6.905 801 HA ALA 116 HA ALA 116 -24.813 -0.729 9.764 802 HB1 ALA 116 HB1 ALA 116 -23.807 1.747 8.402 803 HB2 ALA 116 HB2 ALA 116 -22.828 0.279 8.394 804 HB3 ALA 116 HB3 ALA 116 -23.288 1.023 9.925 805 H ALA 117 H ALA 117 -26.285 1.130 7.174 806 HA ALA 117 HA ALA 117 -28.130 2.480 7.083 807 HB1 ALA 117 HB1 ALA 117 -28.831 1.535 9.868 808 HB2 ALA 117 HB2 ALA 117 -29.097 0.540 8.436 809 HB3 ALA 117 HB3 ALA 117 -29.923 2.090 8.597 810 H SER 118 H SER 118 -26.245 4.050 7.295 811 HA SER 118 HA SER 118 -27.007 6.115 9.164 812 HB2 SER 118 HB2 SER 118 -24.827 6.359 10.202 813 HB3 SER 118 HB3 SER 118 -25.406 4.721 10.490 814 HG SER 118 HG SER 118 -23.136 5.317 9.498 815 H ALA 119 H ALA 119 -25.946 8.152 8.628 816 HA ALA 119 HA ALA 119 -25.619 8.416 5.803 817 HB1 ALA 119 HB1 ALA 119 -26.634 10.162 7.318 818 HB2 ALA 119 HB2 ALA 119 -25.406 10.777 6.212 819 HB3 ALA 119 HB3 ALA 119 -25.007 10.502 7.907 820 H PHE 120 H PHE 120 -23.815 8.866 4.602 821 HA PHE 120 HA PHE 120 -21.219 8.362 5.923 822 HB2 PHE 120 HB2 PHE 120 -21.902 6.729 4.178 823 HB3 PHE 120 HB3 PHE 120 -21.988 8.045 3.004 824 HD1 PHE 120 HD1 PHE 120 -19.685 6.202 5.283 825 HD2 PHE 120 HD2 PHE 120 -20.020 8.881 1.940 826 HE1 PHE 120 HE1 PHE 120 -17.254 5.976 4.858 827 HE2 PHE 120 HE2 PHE 120 -17.586 8.653 1.517 828 HZ PHE 120 HZ PHE 120 -16.203 7.201 2.976 829 H GLY 121 H GLY 121 -19.686 9.904 5.894 830 HA2 GLY 121 HA2 GLY 121 -19.488 11.940 3.895 831 HA3 GLY 121 HA3 GLY 121 -20.160 12.577 5.394 832 H SER 122 H SER 122 -17.731 13.503 4.420 833 HA SER 122 HA SER 122 -15.969 12.843 6.633 834 HB2 SER 122 HB2 SER 122 -14.063 12.256 5.250 835 HB3 SER 122 HB3 SER 122 -15.394 11.159 4.887 836 HG SER 122 HG SER 122 -14.338 13.284 3.384 837 H LEU 123 H LEU 123 -14.025 14.259 6.639 838 HA LEU 123 HA LEU 123 -14.738 16.974 6.297 839 HB2 LEU 123 HB2 LEU 123 -12.166 15.533 6.916 840 HB3 LEU 123 HB3 LEU 123 -12.161 17.272 6.624 841 HG LEU 123 HG LEU 123 -14.034 17.412 8.382 842 HD11 LEU 123 HD11 LEU 123 -13.056 14.577 8.803 843 HD12 LEU 123 HD12 LEU 123 -14.713 15.117 8.529 844 HD13 LEU 123 HD13 LEU 123 -13.905 15.491 10.051 845 HD21 LEU 123 HD21 LEU 123 -11.264 16.475 9.201 846 HD22 LEU 123 HD22 LEU 123 -12.399 17.314 10.257 847 HD23 LEU 123 HD23 LEU 123 -11.735 18.137 8.847 848 H SER 124 H SER 124 -14.057 18.524 4.816 849 HA SER 124 HA SER 124 -12.544 17.669 2.466 850 HB2 SER 124 HB2 SER 124 -15.291 18.946 2.323 851 HB3 SER 124 HB3 SER 124 -14.222 18.676 0.950 852 HG SER 124 HG SER 124 -15.232 16.821 0.893 853 H SER 125 H SER 125 -11.531 19.449 1.414 854 HA SER 125 HA SER 125 -11.772 22.009 2.862 855 HB2 SER 125 HB2 SER 125 -9.244 20.700 1.825 856 HB3 SER 125 HB3 SER 125 -9.336 22.331 2.481 857 HG SER 125 HG SER 125 -9.995 19.908 3.813 858 H ALA 126 H ALA 126 -12.382 23.609 1.560 859 HA ALA 126 HA ALA 126 -12.664 23.275 -1.247 860 HB1 ALA 126 HB1 ALA 126 -13.763 25.284 -1.200 861 HB2 ALA 126 HB2 ALA 126 -12.575 26.034 -0.134 862 HB3 ALA 126 HB3 ALA 126 -13.800 24.950 0.530 863 H LEU 127 H LEU 127 -10.349 24.963 0.782 864 HA LEU 127 HA LEU 127 -8.876 26.252 -1.243 865 HB2 LEU 127 HB2 LEU 127 -8.087 25.354 1.534 866 HB3 LEU 127 HB3 LEU 127 -7.031 26.307 0.494 867 HG LEU 127 HG LEU 127 -9.850 27.171 1.199 868 HD11 LEU 127 HD11 LEU 127 -8.584 27.023 3.273 869 HD12 LEU 127 HD12 LEU 127 -8.725 28.719 2.817 870 HD13 LEU 127 HD13 LEU 127 -7.214 27.856 2.537 871 HD21 LEU 127 HD21 LEU 127 -8.833 29.425 0.584 872 HD22 LEU 127 HD22 LEU 127 -9.000 28.295 -0.760 873 HD23 LEU 127 HD23 LEU 127 -7.426 28.542 -0.006 874 H LEU 128 H LEU 128 -7.647 25.476 -2.770 875 HA LEU 128 HA LEU 128 -6.343 22.838 -2.423 876 HB2 LEU 128 HB2 LEU 128 -7.461 24.108 -4.935 877 HB3 LEU 128 HB3 LEU 128 -6.543 22.603 -4.895 878 HG LEU 128 HG LEU 128 -9.076 23.020 -3.287 879 HD11 LEU 128 HD11 LEU 128 -9.732 23.221 -5.586 880 HD12 LEU 128 HD12 LEU 128 -10.108 21.567 -5.101 881 HD13 LEU 128 HD13 LEU 128 -8.670 21.898 -6.069 882 HD21 LEU 128 HD21 LEU 128 -7.725 21.203 -2.443 883 HD22 LEU 128 HD22 LEU 128 -7.416 20.605 -4.073 884 HD23 LEU 128 HD23 LEU 128 -9.033 20.478 -3.380 885 H MET 129 H MET 129 -4.275 22.559 -3.343 886 HA MET 129 HA MET 129 -2.857 25.055 -4.060 887 HB2 MET 129 HB2 MET 129 -2.342 24.279 -1.727 888 HB3 MET 129 HB3 MET 129 -1.713 22.783 -2.412 889 HG2 MET 129 HG2 MET 129 -0.096 24.113 -3.763 890 HG3 MET 129 HG3 MET 129 -0.684 25.579 -2.980 891 HE1 MET 129 HE1 MET 129 0.420 25.503 0.549 892 HE2 MET 129 HE2 MET 129 -1.137 24.817 0.094 893 HE3 MET 129 HE3 MET 129 -0.518 26.227 -0.764 894 HA PRO 130 HA PRO 130 -2.226 21.913 -7.427 895 HB2 PRO 130 HB2 PRO 130 -2.362 23.612 -9.532 896 HB3 PRO 130 HB3 PRO 130 -3.818 22.976 -8.735 897 HG2 PRO 130 HG2 PRO 130 -2.480 25.623 -8.392 898 HG3 PRO 130 HG3 PRO 130 -4.207 25.246 -8.558 899 HD2 PRO 130 HD2 PRO 130 -3.039 25.725 -6.138 900 HD3 PRO 130 HD3 PRO 130 -4.428 24.632 -6.336 901 H LYS 131 H LYS 131 -0.466 21.636 -8.946 902 HA LYS 131 HA LYS 131 2.047 22.500 -8.013 903 HB2 LYS 131 HB2 LYS 131 1.655 20.430 -9.345 904 HB3 LYS 131 HB3 LYS 131 1.350 21.430 -10.764 905 HG2 LYS 131 HG2 LYS 131 3.609 22.310 -10.710 906 HG3 LYS 131 HG3 LYS 131 3.930 21.511 -9.172 907 HD2 LYS 131 HD2 LYS 131 4.931 20.115 -10.827 908 HD3 LYS 131 HD3 LYS 131 3.431 19.307 -10.377 909 HE2 LYS 131 HE2 LYS 131 3.603 19.292 -12.797 910 HE3 LYS 131 HE3 LYS 131 2.318 20.414 -12.343 911 HZ1 LYS 131 HZ1 LYS 131 3.659 22.244 -12.777 912 HZ2 LYS 131 HZ2 LYS 131 4.030 21.181 -14.051 913 HZ3 LYS 131 HZ3 LYS 131 5.094 21.343 -12.737 914 H ASP 132 H ASP 132 -0.011 23.637 -10.667 915 HA ASP 132 HA ASP 132 1.644 26.082 -10.844 916 HB2 ASP 132 HB2 ASP 132 2.028 24.652 -12.826 917 HB3 ASP 132 HB3 ASP 132 0.295 24.644 -13.146 918 H GLY 133 H GLY 133 0.365 27.498 -9.766 919 HA2 GLY 133 HA2 GLY 133 -2.480 27.427 -9.758 920 HA3 GLY 133 HA3 GLY 133 -1.475 28.745 -9.166 921 H LEU 134 H LEU 134 -3.949 28.437 -10.978 922 HA LEU 134 HA LEU 134 -3.144 30.515 -12.878 923 HB2 LEU 134 HB2 LEU 134 -2.956 28.229 -13.982 924 HB3 LEU 134 HB3 LEU 134 -4.704 28.103 -13.809 925 HG LEU 134 HG LEU 134 -4.876 30.326 -15.034 926 HD11 LEU 134 HD11 LEU 134 -2.661 31.209 -14.804 927 HD12 LEU 134 HD12 LEU 134 -2.847 30.804 -16.509 928 HD13 LEU 134 HD13 LEU 134 -1.935 29.735 -15.444 929 HD21 LEU 134 HD21 LEU 134 -4.526 29.282 -17.254 930 HD22 LEU 134 HD22 LEU 134 -5.327 28.174 -16.139 931 HD23 LEU 134 HD23 LEU 134 -3.608 27.984 -16.489 932 H GLU 135 H GLU 135 -5.809 28.480 -11.695 933 HA GLU 135 HA GLU 135 -8.014 28.936 -11.239 934 HB2 GLU 135 HB2 GLU 135 -6.815 30.405 -9.570 935 HB3 GLU 135 HB3 GLU 135 -7.037 31.744 -10.696 936 HG2 GLU 135 HG2 GLU 135 -9.471 31.429 -10.623 937 HG3 GLU 135 HG3 GLU 135 -9.272 30.053 -9.537 938 H HIS 136 H HIS 136 -8.908 28.675 -13.274 939 HA HIS 136 HA HIS 136 -9.257 31.118 -14.907 940 HB2 HIS 136 HB2 HIS 136 -8.103 29.217 -16.028 941 HB3 HIS 136 HB3 HIS 136 -9.518 28.209 -15.733 942 HD2 HIS 136 HD2 HIS 136 -11.398 28.369 -17.760 943 HE1 HIS 136 HE1 HIS 136 -10.058 31.959 -19.534 944 HE2 HIS 136 HE2 HIS 136 -11.724 30.053 -19.731 945 H HIS 137 H HIS 137 -11.181 32.040 -14.725 946 HA HIS 137 HA HIS 137 -13.403 30.795 -13.424 947 HB2 HIS 137 HB2 HIS 137 -13.119 33.387 -14.958 948 HB3 HIS 137 HB3 HIS 137 -14.610 32.891 -14.158 949 HD2 HIS 137 HD2 HIS 137 -14.626 33.261 -11.381 950 HE1 HIS 137 HE1 HIS 137 -10.608 34.504 -10.998 951 HE2 HIS 137 HE2 HIS 137 -12.811 34.221 -9.767 952 H HIS 138 H HIS 138 -15.380 30.151 -14.284 953 HA HIS 138 HA HIS 138 -15.291 28.848 -16.803 954 HB2 HIS 138 HB2 HIS 138 -17.647 28.302 -16.383 955 HB3 HIS 138 HB3 HIS 138 -16.669 28.027 -14.946 956 HD2 HIS 138 HD2 HIS 138 -19.754 30.087 -16.009 957 HE1 HIS 138 HE1 HIS 138 -18.605 31.511 -12.204 958 HE2 HIS 138 HE2 HIS 138 -20.427 31.578 -13.973 959 H HIS 139 H HIS 139 -16.153 32.075 -15.912 960 HA HIS 139 HA HIS 139 -17.930 32.707 -18.033 961 HB2 HIS 139 HB2 HIS 139 -17.520 34.069 -15.931 962 HB3 HIS 139 HB3 HIS 139 -16.017 34.614 -16.672 963 HD2 HIS 139 HD2 HIS 139 -19.823 35.343 -16.890 964 HE1 HIS 139 HE1 HIS 139 -17.951 37.580 -19.943 965 HE2 HIS 139 HE2 HIS 139 -20.131 37.205 -18.697 966 H HIS 140 H HIS 140 -17.576 33.386 -20.092 967 HA HIS 140 HA HIS 140 -14.934 34.119 -21.023 968 HB2 HIS 140 HB2 HIS 140 -14.781 32.343 -22.722 969 HB3 HIS 140 HB3 HIS 140 -14.768 31.673 -21.094 970 HD2 HIS 140 HD2 HIS 140 -16.832 31.374 -24.341 971 HE1 HIS 140 HE1 HIS 140 -19.025 29.388 -21.331 972 HE2 HIS 140 HE2 HIS 140 -18.853 29.801 -23.830 973 H HIS 141 H HIS 141 -14.947 34.705 -23.346 974 HA HIS 141 HA HIS 141 -17.557 35.868 -24.079 975 HB2 HIS 141 HB2 HIS 141 -16.259 37.455 -25.457 976 HB3 HIS 141 HB3 HIS 141 -15.778 37.515 -23.765 977 HD2 HIS 141 HD2 HIS 141 -14.178 36.874 -27.217 978 HE1 HIS 141 HE1 HIS 141 -11.309 35.749 -24.332 979 HE2 HIS 141 HE2 HIS 141 -11.692 36.196 -26.802 Start of MODEL 8 1 H1 MET 1 HT1 MET 1 -0.717 9.539 -9.903 2 H2 MET 1 HT2 MET 1 -0.775 9.573 -11.599 3 H3 MET 1 HT3 MET 1 -1.684 8.425 -10.739 4 HA MET 1 HA MET 1 -2.977 10.355 -11.634 5 HB2 MET 1 HB2 MET 1 -3.653 8.846 -9.700 6 HB3 MET 1 HB3 MET 1 -3.021 10.084 -8.618 7 HG2 MET 1 HG2 MET 1 -5.010 10.843 -10.751 8 HG3 MET 1 HG3 MET 1 -5.566 10.117 -9.247 9 HE1 MET 1 HE1 MET 1 -3.642 11.401 -6.867 10 HE2 MET 1 HE2 MET 1 -5.267 10.773 -7.130 11 HE3 MET 1 HE3 MET 1 -5.053 12.413 -6.523 12 H SER 2 H SER 2 -0.703 11.035 -8.982 13 HA SER 2 HA SER 2 -0.653 13.859 -9.822 14 HB2 SER 2 HB2 SER 2 -0.836 12.876 -6.964 15 HB3 SER 2 HB3 SER 2 -0.523 14.542 -7.439 16 HG SER 2 HG SER 2 -2.804 13.775 -6.997 17 H ASP 3 H ASP 3 1.351 14.864 -9.617 18 HA ASP 3 HA ASP 3 3.613 13.024 -9.219 19 HB2 ASP 3 HB2 ASP 3 3.506 14.267 -11.348 20 HB3 ASP 3 HB3 ASP 3 3.538 15.787 -10.456 21 H GLN 4 H GLN 4 4.019 12.965 -7.044 22 HA GLN 4 HA GLN 4 4.893 15.499 -5.818 23 HB2 GLN 4 HB2 GLN 4 2.507 14.748 -5.132 24 HB3 GLN 4 HB3 GLN 4 3.326 13.479 -4.223 25 HG2 GLN 4 HG2 GLN 4 4.580 15.140 -2.951 26 HG3 GLN 4 HG3 GLN 4 3.907 16.441 -3.927 27 HE21 GLN 4 HE21 GLN 4 3.630 15.697 -0.927 28 HE22 GLN 4 HE22 GLN 4 1.954 15.721 -0.668 29 H SER 5 H SER 5 6.002 12.727 -6.879 30 HA SER 5 HA SER 5 8.135 12.574 -4.936 31 HB2 SER 5 HB2 SER 5 7.829 10.224 -4.391 32 HB3 SER 5 HB3 SER 5 6.386 11.119 -3.931 33 HG SER 5 HG SER 5 6.744 9.720 -6.378 34 H GLN 6 H GLN 6 9.916 11.251 -5.690 35 HA GLN 6 HA GLN 6 10.387 11.469 -8.459 36 HB2 GLN 6 HB2 GLN 6 11.800 9.913 -6.288 37 HB3 GLN 6 HB3 GLN 6 12.396 10.022 -7.945 38 HG2 GLN 6 HG2 GLN 6 12.581 12.427 -7.794 39 HG3 GLN 6 HG3 GLN 6 11.777 12.438 -6.227 40 HE21 GLN 6 HE21 GLN 6 14.561 13.367 -6.943 41 HE22 GLN 6 HE22 GLN 6 15.597 12.490 -5.924 42 H GLU 7 H GLU 7 9.430 8.719 -6.435 43 HA GLU 7 HA GLU 7 9.279 6.981 -8.795 44 HB2 GLU 7 HB2 GLU 7 8.971 6.418 -5.842 45 HB3 GLU 7 HB3 GLU 7 8.880 5.195 -7.110 46 HG2 GLU 7 HG2 GLU 7 11.188 5.754 -7.811 47 HG3 GLU 7 HG3 GLU 7 11.282 6.957 -6.529 48 HA PRO 8 HA PRO 8 4.838 7.477 -9.091 49 HB2 PRO 8 HB2 PRO 8 4.652 4.544 -9.594 50 HB3 PRO 8 HB3 PRO 8 4.085 5.898 -10.590 51 HG2 PRO 8 HG2 PRO 8 6.215 4.499 -11.299 52 HG3 PRO 8 HG3 PRO 8 6.166 6.260 -11.520 53 HD2 PRO 8 HD2 PRO 8 7.571 4.667 -9.387 54 HD3 PRO 8 HD3 PRO 8 8.132 6.101 -10.278 55 H THR 9 H THR 9 3.521 7.683 -7.412 56 HA THR 9 HA THR 9 3.762 6.155 -5.001 57 HB THR 9 HB THR 9 1.509 8.004 -5.848 58 HG1 THR 9 HG1 THR 9 2.750 9.606 -5.189 59 HG21 THR 9 HG21 THR 9 2.432 6.922 -3.176 60 HG22 THR 9 HG22 THR 9 0.848 6.729 -3.923 61 HG23 THR 9 HG23 THR 9 1.356 8.310 -3.329 62 H MET 10 H MET 10 2.548 4.439 -4.263 63 HA MET 10 HA MET 10 1.168 2.835 -6.179 64 HB2 MET 10 HB2 MET 10 1.485 2.629 -3.180 65 HB3 MET 10 HB3 MET 10 0.654 1.417 -4.157 66 HG2 MET 10 HG2 MET 10 2.697 1.103 -5.509 67 HG3 MET 10 HG3 MET 10 3.527 2.314 -4.535 68 HE1 MET 10 HE1 MET 10 5.469 0.458 -4.042 69 HE2 MET 10 HE2 MET 10 4.504 -0.503 -5.160 70 HE3 MET 10 HE3 MET 10 5.040 -1.210 -3.639 71 H GLU 11 H GLU 11 0.163 4.927 -3.516 72 HA GLU 11 HA GLU 11 -2.565 4.261 -3.465 73 HB2 GLU 11 HB2 GLU 11 -1.108 6.806 -2.742 74 HB3 GLU 11 HB3 GLU 11 -2.834 6.572 -2.462 75 HG2 GLU 11 HG2 GLU 11 -2.414 4.680 -1.021 76 HG3 GLU 11 HG3 GLU 11 -0.701 4.684 -1.427 77 H GLU 12 H GLU 12 -0.791 6.703 -5.359 78 HA GLU 12 HA GLU 12 -3.003 7.962 -6.522 79 HB2 GLU 12 HB2 GLU 12 -0.162 7.587 -7.479 80 HB3 GLU 12 HB3 GLU 12 -1.341 8.592 -8.324 81 HG2 GLU 12 HG2 GLU 12 -1.618 10.015 -6.390 82 HG3 GLU 12 HG3 GLU 12 -0.642 8.939 -5.397 83 H ILE 13 H ILE 13 -1.172 5.084 -7.555 84 HA ILE 13 HA ILE 13 -2.376 4.793 -10.087 85 HB ILE 13 HB ILE 13 -1.124 2.757 -8.214 86 HG12 ILE 13 HG12 ILE 13 -0.054 3.993 -10.769 87 HG13 ILE 13 HG13 ILE 13 0.229 4.710 -9.185 88 HG21 ILE 13 HG21 ILE 13 -2.672 1.655 -9.846 89 HG22 ILE 13 HG22 ILE 13 -0.982 1.264 -10.165 90 HG23 ILE 13 HG23 ILE 13 -1.814 2.455 -11.164 91 HD11 ILE 13 HD11 ILE 13 1.301 2.615 -8.427 92 HD12 ILE 13 HD12 ILE 13 2.119 3.272 -9.844 93 HD13 ILE 13 HD13 ILE 13 1.024 1.901 -10.016 94 H LEU 14 H LEU 14 -3.254 3.350 -6.923 95 HA LEU 14 HA LEU 14 -5.500 1.899 -7.810 96 HB2 LEU 14 HB2 LEU 14 -4.507 1.476 -5.639 97 HB3 LEU 14 HB3 LEU 14 -4.842 3.117 -5.110 98 HG LEU 14 HG LEU 14 -7.295 2.634 -5.307 99 HD11 LEU 14 HD11 LEU 14 -7.375 0.875 -6.932 100 HD12 LEU 14 HD12 LEU 14 -7.915 0.165 -5.411 101 HD13 LEU 14 HD13 LEU 14 -6.278 -0.133 -5.991 102 HD21 LEU 14 HD21 LEU 14 -6.207 2.400 -3.142 103 HD22 LEU 14 HD22 LEU 14 -5.674 0.771 -3.550 104 HD23 LEU 14 HD23 LEU 14 -7.391 1.107 -3.330 105 H ALA 15 H ALA 15 -5.231 5.175 -6.482 106 HA ALA 15 HA ALA 15 -7.969 5.864 -6.565 107 HB1 ALA 15 HB1 ALA 15 -7.142 8.220 -6.523 108 HB2 ALA 15 HB2 ALA 15 -5.504 7.610 -6.759 109 HB3 ALA 15 HB3 ALA 15 -6.398 7.199 -5.294 110 H SER 16 H SER 16 -5.417 6.129 -8.967 111 HA SER 16 HA SER 16 -6.704 7.698 -10.889 112 HB2 SER 16 HB2 SER 16 -4.309 7.226 -10.952 113 HB3 SER 16 HB3 SER 16 -4.635 5.524 -11.267 114 HG SER 16 HG SER 16 -4.530 7.578 -12.986 115 H ILE 17 H ILE 17 -6.798 4.182 -10.370 116 HA ILE 17 HA ILE 17 -8.556 3.862 -12.697 117 HB ILE 17 HB ILE 17 -6.668 2.299 -12.436 118 HG12 ILE 17 HG12 ILE 17 -9.246 0.793 -11.930 119 HG13 ILE 17 HG13 ILE 17 -8.952 1.650 -13.443 120 HG21 ILE 17 HG21 ILE 17 -6.484 2.245 -10.012 121 HG22 ILE 17 HG22 ILE 17 -6.769 0.607 -10.599 122 HG23 ILE 17 HG23 ILE 17 -8.087 1.523 -9.870 123 HD11 ILE 17 HD11 ILE 17 -6.962 -0.345 -12.356 124 HD12 ILE 17 HD12 ILE 17 -7.117 0.263 -14.004 125 HD13 ILE 17 HD13 ILE 17 -8.319 -0.852 -13.359 126 H ARG 18 H ARG 18 -8.738 4.217 -9.298 127 HA ARG 18 HA ARG 18 -11.621 3.820 -9.340 128 HB2 ARG 18 HB2 ARG 18 -10.439 1.596 -8.766 129 HB3 ARG 18 HB3 ARG 18 -10.009 2.364 -7.241 130 HG2 ARG 18 HG2 ARG 18 -12.878 2.395 -8.190 131 HG3 ARG 18 HG3 ARG 18 -12.227 0.965 -7.393 132 HD2 ARG 18 HD2 ARG 18 -11.426 2.570 -5.542 133 HD3 ARG 18 HD3 ARG 18 -12.500 3.756 -6.278 134 HE ARG 18 HE ARG 18 -14.334 2.521 -5.523 135 HH11 ARG 18 HH11 ARG 18 -11.378 0.712 -4.984 136 HH12 ARG 18 HH12 ARG 18 -12.150 -0.466 -3.978 137 HH21 ARG 18 HH21 ARG 18 -15.293 0.957 -4.215 138 HH22 ARG 18 HH22 ARG 18 -14.345 -0.329 -3.548 139 H ARG 19 H ARG 19 -11.565 6.101 -9.014 140 HA ARG 19 HA ARG 19 -10.187 7.433 -6.973 141 HB2 ARG 19 HB2 ARG 19 -11.292 8.514 -8.928 142 HB3 ARG 19 HB3 ARG 19 -12.854 8.192 -8.186 143 HG2 ARG 19 HG2 ARG 19 -12.221 9.548 -6.229 144 HG3 ARG 19 HG3 ARG 19 -10.637 9.851 -6.944 145 HD2 ARG 19 HD2 ARG 19 -11.732 10.942 -8.879 146 HD3 ARG 19 HD3 ARG 19 -13.305 10.670 -8.132 147 HE ARG 19 HE ARG 19 -11.340 12.671 -7.368 148 HH11 ARG 19 HH11 ARG 19 -14.181 10.869 -6.384 149 HH12 ARG 19 HH12 ARG 19 -14.641 12.028 -5.182 150 HH21 ARG 19 HH21 ARG 19 -11.972 14.149 -5.793 151 HH22 ARG 19 HH22 ARG 19 -13.399 13.869 -4.852 152 H ILE 20 H ILE 20 -13.528 6.125 -6.968 153 HA ILE 20 HA ILE 20 -13.387 5.708 -4.116 154 HB ILE 20 HB ILE 20 -13.887 8.133 -4.273 155 HG12 ILE 20 HG12 ILE 20 -16.312 6.654 -3.235 156 HG13 ILE 20 HG13 ILE 20 -14.750 6.556 -2.429 157 HG21 ILE 20 HG21 ILE 20 -16.339 7.138 -5.748 158 HG22 ILE 20 HG22 ILE 20 -15.138 8.297 -6.311 159 HG23 ILE 20 HG23 ILE 20 -16.245 8.738 -5.011 160 HD11 ILE 20 HD11 ILE 20 -16.352 9.077 -2.964 161 HD12 ILE 20 HD12 ILE 20 -14.726 9.056 -2.282 162 HD13 ILE 20 HD13 ILE 20 -16.063 8.328 -1.392 163 H ILE 21 H ILE 21 -15.119 4.498 -3.268 164 HA ILE 21 HA ILE 21 -16.166 2.521 -4.977 165 HB ILE 21 HB ILE 21 -15.679 2.216 -2.563 166 HG12 ILE 21 HG12 ILE 21 -18.597 1.624 -3.108 167 HG13 ILE 21 HG13 ILE 21 -17.300 0.766 -3.941 168 HG21 ILE 21 HG21 ILE 21 -18.289 3.672 -2.064 169 HG22 ILE 21 HG22 ILE 21 -16.708 4.433 -1.876 170 HG23 ILE 21 HG23 ILE 21 -17.150 3.060 -0.864 171 HD11 ILE 21 HD11 ILE 21 -17.900 0.810 -0.977 172 HD12 ILE 21 HD12 ILE 21 -16.346 0.262 -1.610 173 HD13 ILE 21 HD13 ILE 21 -17.828 -0.586 -2.050 174 H SER 22 H SER 22 -17.286 5.686 -4.538 175 HA SER 22 HA SER 22 -20.094 5.317 -4.650 176 HB2 SER 22 HB2 SER 22 -19.136 7.446 -3.972 177 HB3 SER 22 HB3 SER 22 -18.368 7.636 -5.545 178 HG SER 22 HG SER 22 -20.273 8.767 -5.601 179 H GLU 23 H GLU 23 -21.499 5.217 -6.340 180 HA GLU 23 HA GLU 23 -20.932 3.873 -8.649 181 HB2 GLU 23 HB2 GLU 23 -23.216 4.461 -7.744 182 HB3 GLU 23 HB3 GLU 23 -23.029 6.046 -8.497 183 HG2 GLU 23 HG2 GLU 23 -22.725 4.969 -10.697 184 HG3 GLU 23 HG3 GLU 23 -22.907 3.385 -9.947 185 H ASP 24 H ASP 24 -20.435 4.348 -10.753 186 HA ASP 24 HA ASP 24 -18.813 6.708 -11.184 187 HB2 ASP 24 HB2 ASP 24 -18.312 4.372 -12.062 188 HB3 ASP 24 HB3 ASP 24 -19.619 4.638 -13.225 189 H ASP 25 H ASP 25 -21.238 7.696 -10.666 190 HA ASP 25 HA ASP 25 -22.970 7.988 -12.876 191 HB2 ASP 25 HB2 ASP 25 -23.586 8.425 -10.485 192 HB3 ASP 25 HB3 ASP 25 -22.625 9.897 -10.549 193 H ALA 26 H ALA 26 -20.260 9.943 -11.685 194 HA ALA 26 HA ALA 26 -20.590 12.093 -13.515 195 HB1 ALA 26 HB1 ALA 26 -19.129 11.878 -11.329 196 HB2 ALA 26 HB2 ALA 26 -18.612 12.930 -12.646 197 HB3 ALA 26 HB3 ALA 26 -17.894 11.330 -12.463 198 HA PRO 27 HA PRO 27 -19.133 10.310 -17.345 199 HB2 PRO 27 HB2 PRO 27 -17.516 12.794 -17.719 200 HB3 PRO 27 HB3 PRO 27 -18.698 12.043 -18.808 201 HG2 PRO 27 HG2 PRO 27 -19.328 14.225 -17.480 202 HG3 PRO 27 HG3 PRO 27 -20.507 12.908 -17.652 203 HD2 PRO 27 HD2 PRO 27 -18.824 13.628 -15.264 204 HD3 PRO 27 HD3 PRO 27 -20.526 13.106 -15.330 205 H ALA 28 H ALA 28 -17.467 9.005 -17.949 206 HA ALA 28 HA ALA 28 -15.205 8.685 -16.230 207 HB1 ALA 28 HB1 ALA 28 -15.785 7.496 -18.956 208 HB2 ALA 28 HB2 ALA 28 -16.207 6.777 -17.401 209 HB3 ALA 28 HB3 ALA 28 -14.514 6.959 -17.858 210 H GLU 29 H GLU 29 -13.023 9.121 -16.629 211 HA GLU 29 HA GLU 29 -12.191 10.403 -19.071 212 HB2 GLU 29 HB2 GLU 29 -12.659 11.947 -16.553 213 HB3 GLU 29 HB3 GLU 29 -11.163 12.285 -17.419 214 HG2 GLU 29 HG2 GLU 29 -12.469 12.727 -19.479 215 HG3 GLU 29 HG3 GLU 29 -13.959 12.409 -18.595 216 HA PRO 30 HA PRO 30 -8.413 9.423 -16.398 217 HB2 PRO 30 HB2 PRO 30 -8.573 8.737 -13.786 218 HB3 PRO 30 HB3 PRO 30 -8.539 10.433 -14.316 219 HG2 PRO 30 HG2 PRO 30 -10.869 8.747 -13.527 220 HG3 PRO 30 HG3 PRO 30 -10.502 10.431 -13.109 221 HD2 PRO 30 HD2 PRO 30 -12.261 9.742 -15.084 222 HD3 PRO 30 HD3 PRO 30 -11.328 11.251 -15.103 223 H ALA 31 H ALA 31 -7.321 7.456 -16.350 224 HA ALA 31 HA ALA 31 -8.638 5.008 -15.559 225 HB1 ALA 31 HB1 ALA 31 -9.644 5.116 -17.715 226 HB2 ALA 31 HB2 ALA 31 -8.303 3.982 -17.866 227 HB3 ALA 31 HB3 ALA 31 -8.136 5.629 -18.472 228 H ALA 32 H ALA 32 -7.201 3.227 -15.466 229 HA ALA 32 HA ALA 32 -4.432 3.593 -16.263 230 HB1 ALA 32 HB1 ALA 32 -4.819 2.889 -13.386 231 HB2 ALA 32 HB2 ALA 32 -4.941 4.585 -13.853 232 HB3 ALA 32 HB3 ALA 32 -3.458 3.685 -14.172 233 H GLU 33 H GLU 33 -5.375 1.845 -17.604 234 HA GLU 33 HA GLU 33 -4.755 -0.747 -16.406 235 HB2 GLU 33 HB2 GLU 33 -7.219 -0.357 -16.101 236 HB3 GLU 33 HB3 GLU 33 -7.371 -0.286 -17.855 237 HG2 GLU 33 HG2 GLU 33 -7.894 -2.547 -17.112 238 HG3 GLU 33 HG3 GLU 33 -6.377 -2.571 -18.003 239 H ALA 34 H ALA 34 -3.931 -2.197 -17.857 240 HA ALA 34 HA ALA 34 -4.045 -1.560 -20.726 241 HB1 ALA 34 HB1 ALA 34 -1.409 -2.379 -19.564 242 HB2 ALA 34 HB2 ALA 34 -1.893 -0.686 -19.475 243 HB3 ALA 34 HB3 ALA 34 -1.748 -1.482 -21.043 244 H ALA 35 H ALA 35 -4.262 -3.280 -21.983 245 HA ALA 35 HA ALA 35 -3.675 -5.958 -20.895 246 HB1 ALA 35 HB1 ALA 35 -6.119 -5.814 -22.527 247 HB2 ALA 35 HB2 ALA 35 -6.226 -4.937 -20.998 248 HB3 ALA 35 HB3 ALA 35 -5.822 -6.655 -21.003 249 HA PRO 36 HA PRO 36 -1.874 -6.893 -24.847 250 HB2 PRO 36 HB2 PRO 36 -3.529 -9.373 -24.992 251 HB3 PRO 36 HB3 PRO 36 -1.765 -9.186 -25.079 252 HG2 PRO 36 HG2 PRO 36 -2.897 -10.163 -22.906 253 HG3 PRO 36 HG3 PRO 36 -1.538 -9.027 -22.784 254 HD2 PRO 36 HD2 PRO 36 -4.472 -8.501 -22.381 255 HD3 PRO 36 HD3 PRO 36 -3.082 -7.895 -21.451 256 HA PRO 37 HA PRO 37 -4.878 -5.496 -27.867 257 HB2 PRO 37 HB2 PRO 37 -3.656 -6.143 -30.226 258 HB3 PRO 37 HB3 PRO 37 -3.130 -4.793 -29.201 259 HG2 PRO 37 HG2 PRO 37 -2.009 -7.550 -29.413 260 HG3 PRO 37 HG3 PRO 37 -1.165 -5.992 -29.331 261 HD2 PRO 37 HD2 PRO 37 -1.422 -7.595 -27.157 262 HD3 PRO 37 HD3 PRO 37 -1.412 -5.822 -27.026 263 HA PRO 38 HA PRO 38 -7.316 -9.108 -28.892 264 HB2 PRO 38 HB2 PRO 38 -9.011 -8.146 -30.787 265 HB3 PRO 38 HB3 PRO 38 -9.138 -7.695 -29.075 266 HG2 PRO 38 HG2 PRO 38 -7.893 -6.195 -31.337 267 HG3 PRO 38 HG3 PRO 38 -8.948 -5.606 -30.041 268 HD2 PRO 38 HD2 PRO 38 -6.248 -5.289 -29.961 269 HD3 PRO 38 HD3 PRO 38 -7.223 -5.507 -28.491 270 HA PRO 39 HA PRO 39 -5.438 -10.985 -32.497 271 HB2 PRO 39 HB2 PRO 39 -7.189 -12.977 -33.107 272 HB3 PRO 39 HB3 PRO 39 -6.138 -13.032 -31.675 273 HG2 PRO 39 HG2 PRO 39 -9.015 -12.262 -31.877 274 HG3 PRO 39 HG3 PRO 39 -8.205 -13.288 -30.678 275 HD2 PRO 39 HD2 PRO 39 -8.814 -10.687 -30.173 276 HD3 PRO 39 HD3 PRO 39 -7.380 -11.477 -29.481 277 HA PRO 40 HA PRO 40 -7.324 -9.138 -36.105 278 HB2 PRO 40 HB2 PRO 40 -6.406 -10.692 -38.154 279 HB3 PRO 40 HB3 PRO 40 -5.374 -9.545 -37.274 280 HG2 PRO 40 HG2 PRO 40 -5.634 -12.499 -36.933 281 HG3 PRO 40 HG3 PRO 40 -4.175 -11.492 -36.966 282 HD2 PRO 40 HD2 PRO 40 -5.256 -12.369 -34.637 283 HD3 PRO 40 HD3 PRO 40 -4.433 -10.796 -34.762 284 H GLU 41 H GLU 41 -9.091 -9.320 -37.500 285 HA GLU 41 HA GLU 41 -11.040 -11.273 -36.878 286 HB2 GLU 41 HB2 GLU 41 -11.524 -8.953 -37.665 287 HB3 GLU 41 HB3 GLU 41 -10.959 -9.418 -39.268 288 HG2 GLU 41 HG2 GLU 41 -12.695 -11.173 -39.373 289 HG3 GLU 41 HG3 GLU 41 -13.263 -10.706 -37.771 290 HA PRO 42 HA PRO 42 -9.455 -14.562 -39.592 291 HB2 PRO 42 HB2 PRO 42 -12.272 -15.549 -39.479 292 HB3 PRO 42 HB3 PRO 42 -10.760 -16.413 -39.140 293 HG2 PRO 42 HG2 PRO 42 -12.336 -15.680 -37.164 294 HG3 PRO 42 HG3 PRO 42 -10.575 -15.522 -37.013 295 HD2 PRO 42 HD2 PRO 42 -12.616 -13.384 -37.581 296 HD3 PRO 42 HD3 PRO 42 -11.188 -13.325 -36.520 297 H GLU 43 H GLU 43 -9.418 -14.885 -41.784 298 HA GLU 43 HA GLU 43 -11.646 -13.914 -43.432 299 HB2 GLU 43 HB2 GLU 43 -10.099 -12.674 -44.908 300 HB3 GLU 43 HB3 GLU 43 -10.108 -12.010 -43.276 301 HG2 GLU 43 HG2 GLU 43 -8.036 -13.244 -42.755 302 HG3 GLU 43 HG3 GLU 43 -8.034 -13.937 -44.375 303 HA PRO 44 HA PRO 44 -10.823 -17.577 -45.809 304 HB2 PRO 44 HB2 PRO 44 -11.209 -16.747 -48.410 305 HB3 PRO 44 HB3 PRO 44 -12.522 -17.107 -47.275 306 HG2 PRO 44 HG2 PRO 44 -11.358 -14.473 -48.046 307 HG3 PRO 44 HG3 PRO 44 -13.054 -14.930 -47.801 308 HD2 PRO 44 HD2 PRO 44 -11.681 -13.572 -45.916 309 HD3 PRO 44 HD3 PRO 44 -12.903 -14.787 -45.480 310 H GLU 45 H GLU 45 -9.137 -14.637 -46.723 311 HA GLU 45 HA GLU 45 -7.150 -15.880 -48.374 312 HB2 GLU 45 HB2 GLU 45 -7.226 -13.195 -46.976 313 HB3 GLU 45 HB3 GLU 45 -5.957 -13.692 -48.093 314 HG2 GLU 45 HG2 GLU 45 -8.910 -13.545 -48.774 315 HG3 GLU 45 HG3 GLU 45 -7.715 -12.329 -49.211 316 HA PRO 46 HA PRO 46 -4.498 -17.435 -45.143 317 HB2 PRO 46 HB2 PRO 46 -2.035 -17.336 -46.293 318 HB3 PRO 46 HB3 PRO 46 -3.274 -18.508 -46.787 319 HG2 PRO 46 HG2 PRO 46 -2.505 -15.918 -48.060 320 HG3 PRO 46 HG3 PRO 46 -2.831 -17.490 -48.815 321 HD2 PRO 46 HD2 PRO 46 -4.687 -15.503 -48.764 322 HD3 PRO 46 HD3 PRO 46 -5.136 -17.222 -48.699 323 H VAL 47 H VAL 47 -3.199 -16.729 -43.447 324 HA VAL 47 HA VAL 47 -2.685 -13.838 -43.361 325 HB VAL 47 HB VAL 47 -2.633 -15.907 -41.135 326 HG11 VAL 47 HG11 VAL 47 -1.208 -13.968 -40.631 327 HG12 VAL 47 HG12 VAL 47 -2.666 -13.920 -39.642 328 HG13 VAL 47 HG13 VAL 47 -2.523 -12.874 -41.054 329 HG21 VAL 47 HG21 VAL 47 -4.714 -13.830 -41.894 330 HG22 VAL 47 HG22 VAL 47 -4.773 -14.844 -40.453 331 HG23 VAL 47 HG23 VAL 47 -4.892 -15.577 -42.053 332 H SER 48 H SER 48 -1.045 -16.935 -42.750 333 HA SER 48 HA SER 48 1.489 -15.821 -43.636 334 HB2 SER 48 HB2 SER 48 2.700 -16.336 -41.596 335 HB3 SER 48 HB3 SER 48 1.384 -15.226 -41.217 336 HG SER 48 HG SER 48 1.846 -17.690 -40.277 337 H PHE 49 H PHE 49 3.201 -17.513 -43.681 338 HA PHE 49 HA PHE 49 2.087 -20.245 -43.894 339 HB2 PHE 49 HB2 PHE 49 3.460 -20.612 -45.918 340 HB3 PHE 49 HB3 PHE 49 2.261 -19.345 -46.159 341 HD1 PHE 49 HD1 PHE 49 5.847 -20.091 -45.766 342 HD2 PHE 49 HD2 PHE 49 2.927 -16.994 -46.342 343 HE1 PHE 49 HE1 PHE 49 7.650 -18.506 -46.388 344 HE2 PHE 49 HE2 PHE 49 4.732 -15.408 -46.962 345 HZ PHE 49 HZ PHE 49 7.093 -16.165 -46.986 346 H ASP 50 H ASP 50 4.892 -18.188 -43.341 347 HA ASP 50 HA ASP 50 6.884 -20.084 -42.952 348 HB2 ASP 50 HB2 ASP 50 6.996 -17.494 -42.927 349 HB3 ASP 50 HB3 ASP 50 6.663 -17.650 -41.204 350 H ASP 51 H ASP 51 7.924 -20.540 -40.789 351 HA ASP 51 HA ASP 51 5.928 -21.820 -39.072 352 HB2 ASP 51 HB2 ASP 51 8.953 -21.944 -39.007 353 HB3 ASP 51 HB3 ASP 51 7.863 -22.921 -38.024 354 H GLU 52 H GLU 52 8.573 -19.456 -38.815 355 HA GLU 52 HA GLU 52 7.252 -18.220 -36.530 356 HB2 GLU 52 HB2 GLU 52 10.120 -19.206 -36.415 357 HB3 GLU 52 HB3 GLU 52 9.336 -18.197 -35.198 358 HG2 GLU 52 HG2 GLU 52 7.655 -19.984 -34.821 359 HG3 GLU 52 HG3 GLU 52 8.487 -20.997 -36.001 360 H VAL 53 H VAL 53 7.887 -16.047 -36.256 361 HA VAL 53 HA VAL 53 9.667 -15.004 -38.358 362 HB VAL 53 HB VAL 53 7.319 -14.644 -39.033 363 HG11 VAL 53 HG11 VAL 53 7.071 -12.976 -36.515 364 HG12 VAL 53 HG12 VAL 53 6.369 -14.579 -36.720 365 HG13 VAL 53 HG13 VAL 53 5.821 -13.241 -37.732 366 HG21 VAL 53 HG21 VAL 53 7.441 -12.184 -39.342 367 HG22 VAL 53 HG22 VAL 53 8.984 -12.966 -39.684 368 HG23 VAL 53 HG23 VAL 53 8.748 -12.115 -38.158 369 H LEU 54 H LEU 54 10.933 -13.208 -37.761 370 HA LEU 54 HA LEU 54 10.654 -12.197 -35.018 371 HB2 LEU 54 HB2 LEU 54 13.152 -12.384 -34.717 372 HB3 LEU 54 HB3 LEU 54 12.275 -13.908 -34.668 373 HG LEU 54 HG LEU 54 13.371 -12.991 -37.325 374 HD11 LEU 54 HD11 LEU 54 15.548 -14.015 -36.843 375 HD12 LEU 54 HD12 LEU 54 15.046 -14.345 -35.185 376 HD13 LEU 54 HD13 LEU 54 15.249 -12.680 -35.731 377 HD21 LEU 54 HD21 LEU 54 12.117 -15.010 -37.430 378 HD22 LEU 54 HD22 LEU 54 12.830 -15.627 -35.941 379 HD23 LEU 54 HD23 LEU 54 13.796 -15.545 -37.413 380 H GLU 55 H GLU 55 9.876 -10.303 -36.031 381 HA GLU 55 HA GLU 55 11.295 -8.817 -37.977 382 HB2 GLU 55 HB2 GLU 55 9.240 -8.016 -35.912 383 HB3 GLU 55 HB3 GLU 55 9.879 -6.902 -37.121 384 HG2 GLU 55 HG2 GLU 55 9.064 -8.285 -38.929 385 HG3 GLU 55 HG3 GLU 55 8.606 -9.563 -37.809 386 H LEU 56 H LEU 56 11.334 -8.773 -34.436 387 HA LEU 56 HA LEU 56 13.428 -6.710 -34.451 388 HB2 LEU 56 HB2 LEU 56 11.431 -7.688 -32.457 389 HB3 LEU 56 HB3 LEU 56 12.966 -7.124 -31.821 390 HG LEU 56 HG LEU 56 11.284 -5.320 -31.853 391 HD11 LEU 56 HD11 LEU 56 13.304 -4.662 -33.992 392 HD12 LEU 56 HD12 LEU 56 13.782 -4.917 -32.315 393 HD13 LEU 56 HD13 LEU 56 12.663 -3.618 -32.722 394 HD21 LEU 56 HD21 LEU 56 10.060 -6.213 -33.894 395 HD22 LEU 56 HD22 LEU 56 11.337 -5.498 -34.878 396 HD23 LEU 56 HD23 LEU 56 10.314 -4.467 -33.878 397 H THR 57 H THR 57 15.478 -7.089 -33.824 398 HA THR 57 HA THR 57 16.213 -9.886 -33.208 399 HB THR 57 HB THR 57 18.463 -9.255 -34.060 400 HG1 THR 57 HG1 THR 57 18.223 -7.005 -33.620 401 HG21 THR 57 HG21 THR 57 16.249 -8.590 -36.017 402 HG22 THR 57 HG22 THR 57 16.673 -10.231 -35.533 403 HG23 THR 57 HG23 THR 57 17.844 -9.236 -36.401 404 H ASP 58 H ASP 58 15.405 -7.567 -31.326 405 HA ASP 58 HA ASP 58 17.716 -6.839 -29.839 406 HB2 ASP 58 HB2 ASP 58 14.779 -6.886 -29.104 407 HB3 ASP 58 HB3 ASP 58 16.036 -6.224 -28.068 408 HA PRO 59 HA PRO 59 18.344 -10.619 -27.620 409 HB2 PRO 59 HB2 PRO 59 19.436 -9.765 -25.261 410 HB3 PRO 59 HB3 PRO 59 20.324 -9.779 -26.798 411 HG2 PRO 59 HG2 PRO 59 18.958 -7.510 -25.424 412 HG3 PRO 59 HG3 PRO 59 20.530 -7.552 -26.244 413 HD2 PRO 59 HD2 PRO 59 18.308 -6.532 -27.434 414 HD3 PRO 59 HD3 PRO 59 19.591 -7.346 -28.356 415 H ILE 60 H ILE 60 16.450 -8.089 -26.117 416 HA ILE 60 HA ILE 60 14.954 -10.151 -24.614 417 HB ILE 60 HB ILE 60 14.616 -8.539 -22.771 418 HG12 ILE 60 HG12 ILE 60 16.759 -6.845 -24.094 419 HG13 ILE 60 HG13 ILE 60 15.039 -6.502 -24.274 420 HG21 ILE 60 HG21 ILE 60 16.863 -8.739 -21.824 421 HG22 ILE 60 HG22 ILE 60 17.542 -9.006 -23.428 422 HG23 ILE 60 HG23 ILE 60 16.465 -10.206 -22.717 423 HD11 ILE 60 HD11 ILE 60 15.682 -5.154 -22.446 424 HD12 ILE 60 HD12 ILE 60 16.723 -6.406 -21.770 425 HD13 ILE 60 HD13 ILE 60 14.968 -6.570 -21.677 426 H ALA 61 H ALA 61 12.746 -9.650 -24.189 427 HA ALA 61 HA ALA 61 11.399 -7.374 -25.196 428 HB1 ALA 61 HB1 ALA 61 10.159 -8.832 -27.030 429 HB2 ALA 61 HB2 ALA 61 11.700 -9.688 -27.060 430 HB3 ALA 61 HB3 ALA 61 11.644 -7.960 -27.411 431 HA PRO 62 HA PRO 62 8.055 -10.602 -23.971 432 HB2 PRO 62 HB2 PRO 62 8.746 -13.166 -23.400 433 HB3 PRO 62 HB3 PRO 62 8.380 -12.622 -25.052 434 HG2 PRO 62 HG2 PRO 62 11.032 -13.013 -23.738 435 HG3 PRO 62 HG3 PRO 62 10.496 -13.503 -25.357 436 HD2 PRO 62 HD2 PRO 62 11.990 -11.273 -24.949 437 HD3 PRO 62 HD3 PRO 62 10.774 -11.373 -26.240 438 H GLU 63 H GLU 63 7.244 -10.991 -21.891 439 HA GLU 63 HA GLU 63 8.890 -10.139 -19.705 440 HB2 GLU 63 HB2 GLU 63 6.078 -11.255 -19.806 441 HB3 GLU 63 HB3 GLU 63 6.841 -10.628 -18.344 442 HG2 GLU 63 HG2 GLU 63 7.153 -8.442 -19.423 443 HG3 GLU 63 HG3 GLU 63 6.427 -9.059 -20.905 444 HA PRO 64 HA PRO 64 10.523 -14.063 -18.360 445 HB2 PRO 64 HB2 PRO 64 9.914 -13.338 -15.546 446 HB3 PRO 64 HB3 PRO 64 11.470 -13.723 -16.300 447 HG2 PRO 64 HG2 PRO 64 10.829 -11.239 -15.585 448 HG3 PRO 64 HG3 PRO 64 11.792 -11.577 -17.033 449 HD2 PRO 64 HD2 PRO 64 8.899 -10.817 -16.829 450 HD3 PRO 64 HD3 PRO 64 10.109 -10.348 -18.044 451 H GLU 65 H GLU 65 8.764 -15.257 -19.258 452 HA GLU 65 HA GLU 65 6.335 -15.806 -17.898 453 HB2 GLU 65 HB2 GLU 65 7.778 -17.220 -20.141 454 HB3 GLU 65 HB3 GLU 65 6.195 -17.721 -19.546 455 HG2 GLU 65 HG2 GLU 65 5.230 -15.574 -20.101 456 HG3 GLU 65 HG3 GLU 65 6.811 -14.913 -20.500 457 H LEU 66 H LEU 66 9.445 -17.492 -17.988 458 HA LEU 66 HA LEU 66 8.680 -19.904 -16.802 459 HB2 LEU 66 HB2 LEU 66 11.303 -18.418 -16.769 460 HB3 LEU 66 HB3 LEU 66 11.110 -20.019 -16.058 461 HG LEU 66 HG LEU 66 10.361 -19.382 -18.925 462 HD11 LEU 66 HD11 LEU 66 12.957 -20.381 -17.731 463 HD12 LEU 66 HD12 LEU 66 12.720 -19.001 -18.803 464 HD13 LEU 66 HD13 LEU 66 12.534 -20.642 -19.422 465 HD21 LEU 66 HD21 LEU 66 9.279 -21.386 -18.158 466 HD22 LEU 66 HD22 LEU 66 10.730 -21.927 -17.316 467 HD23 LEU 66 HD23 LEU 66 10.685 -21.924 -19.077 468 HA PRO 67 HA PRO 67 9.646 -18.218 -12.397 469 HB2 PRO 67 HB2 PRO 67 9.916 -15.550 -11.976 470 HB3 PRO 67 HB3 PRO 67 11.288 -16.582 -12.436 471 HG2 PRO 67 HG2 PRO 67 9.590 -14.826 -14.151 472 HG3 PRO 67 HG3 PRO 67 11.358 -14.981 -14.111 473 HD2 PRO 67 HD2 PRO 67 9.877 -16.239 -15.991 474 HD3 PRO 67 HD3 PRO 67 11.349 -16.967 -15.320 475 HA PRO 68 HA PRO 68 5.350 -17.182 -11.681 476 HB2 PRO 68 HB2 PRO 68 5.289 -16.585 -9.023 477 HB3 PRO 68 HB3 PRO 68 5.504 -18.240 -9.628 478 HG2 PRO 68 HG2 PRO 68 7.555 -16.303 -8.650 479 HG3 PRO 68 HG3 PRO 68 7.389 -18.036 -8.312 480 HD2 PRO 68 HD2 PRO 68 9.158 -17.088 -10.144 481 HD3 PRO 68 HD3 PRO 68 8.354 -18.662 -10.332 482 H LEU 69 H LEU 69 3.882 -15.418 -11.274 483 HA LEU 69 HA LEU 69 5.173 -12.788 -11.549 484 HB2 LEU 69 HB2 LEU 69 3.488 -13.490 -13.243 485 HB3 LEU 69 HB3 LEU 69 2.277 -13.586 -11.969 486 HG LEU 69 HG LEU 69 2.694 -11.149 -11.479 487 HD11 LEU 69 HD11 LEU 69 4.909 -10.835 -12.380 488 HD12 LEU 69 HD12 LEU 69 3.813 -9.859 -13.358 489 HD13 LEU 69 HD13 LEU 69 4.405 -11.401 -13.971 490 HD21 LEU 69 HD21 LEU 69 0.813 -11.888 -12.899 491 HD22 LEU 69 HD22 LEU 69 1.860 -11.822 -14.318 492 HD23 LEU 69 HD23 LEU 69 1.453 -10.341 -13.453 493 H GLU 70 H GLU 70 5.579 -11.881 -9.638 494 HA GLU 70 HA GLU 70 4.000 -12.320 -7.283 495 HB2 GLU 70 HB2 GLU 70 6.474 -11.824 -7.312 496 HB3 GLU 70 HB3 GLU 70 6.070 -10.162 -7.744 497 HG2 GLU 70 HG2 GLU 70 4.713 -9.958 -5.691 498 HG3 GLU 70 HG3 GLU 70 5.121 -11.614 -5.255 499 H THR 71 H THR 71 2.497 -11.007 -6.328 500 HA THR 71 HA THR 71 0.958 -9.336 -6.048 501 HB THR 71 HB THR 71 2.381 -7.695 -8.148 502 HG1 THR 71 HG1 THR 71 3.022 -8.139 -5.429 503 HG21 THR 71 HG21 THR 71 1.429 -5.836 -7.010 504 HG22 THR 71 HG22 THR 71 1.004 -6.817 -5.608 505 HG23 THR 71 HG23 THR 71 0.128 -7.022 -7.124 506 H VAL 72 H VAL 72 -0.765 -10.425 -6.830 507 HA VAL 72 HA VAL 72 -1.322 -10.971 -9.537 508 HB VAL 72 HB VAL 72 -3.142 -10.758 -7.118 509 HG11 VAL 72 HG11 VAL 72 -4.806 -12.004 -8.411 510 HG12 VAL 72 HG12 VAL 72 -3.740 -12.016 -9.817 511 HG13 VAL 72 HG13 VAL 72 -4.427 -10.497 -9.244 512 HG21 VAL 72 HG21 VAL 72 -1.489 -12.509 -6.894 513 HG22 VAL 72 HG22 VAL 72 -1.795 -13.072 -8.539 514 HG23 VAL 72 HG23 VAL 72 -3.030 -13.269 -7.296 515 H GLY 73 H GLY 73 -2.208 -8.258 -7.427 516 HA2 GLY 73 HA2 GLY 73 -4.035 -6.957 -9.107 517 HA3 GLY 73 HA3 GLY 73 -3.049 -6.165 -7.884 518 H ASP 74 H ASP 74 -0.490 -6.738 -8.952 519 HA ASP 74 HA ASP 74 1.063 -5.862 -10.383 520 HB2 ASP 74 HB2 ASP 74 -0.249 -7.412 -11.955 521 HB3 ASP 74 HB3 ASP 74 -1.066 -5.957 -12.528 522 H ILE 75 H ILE 75 0.380 -4.009 -8.867 523 HA ILE 75 HA ILE 75 -1.170 -1.880 -9.737 524 HB ILE 75 HB ILE 75 -0.350 -2.173 -7.409 525 HG12 ILE 75 HG12 ILE 75 0.556 0.487 -8.519 526 HG13 ILE 75 HG13 ILE 75 -1.144 0.048 -8.412 527 HG21 ILE 75 HG21 ILE 75 2.291 -1.118 -8.459 528 HG22 ILE 75 HG22 ILE 75 1.996 -2.806 -8.042 529 HG23 ILE 75 HG23 ILE 75 1.912 -1.565 -6.795 530 HD11 ILE 75 HD11 ILE 75 -0.971 1.045 -6.355 531 HD12 ILE 75 HD12 ILE 75 0.767 0.763 -6.254 532 HD13 ILE 75 HD13 ILE 75 -0.357 -0.539 -5.872 533 H ASP 76 H ASP 76 2.188 -2.719 -10.373 534 HA ASP 76 HA ASP 76 2.219 -1.043 -12.689 535 HB2 ASP 76 HB2 ASP 76 2.891 0.422 -10.647 536 HB3 ASP 76 HB3 ASP 76 4.397 -0.485 -10.700 537 H VAL 77 H VAL 77 4.315 -1.313 -13.895 538 HA VAL 77 HA VAL 77 4.964 -4.080 -14.031 539 HB VAL 77 HB VAL 77 6.591 -3.405 -15.773 540 HG11 VAL 77 HG11 VAL 77 3.909 -2.003 -15.969 541 HG12 VAL 77 HG12 VAL 77 4.196 -3.707 -16.314 542 HG13 VAL 77 HG13 VAL 77 4.937 -2.467 -17.326 543 HG21 VAL 77 HG21 VAL 77 7.388 -1.295 -14.838 544 HG22 VAL 77 HG22 VAL 77 5.773 -0.598 -14.948 545 HG23 VAL 77 HG23 VAL 77 6.667 -0.984 -16.416 546 H TYR 78 H TYR 78 6.513 -5.232 -13.129 547 HA TYR 78 HA TYR 78 8.928 -3.961 -12.071 548 HB2 TYR 78 HB2 TYR 78 7.127 -5.729 -10.393 549 HB3 TYR 78 HB3 TYR 78 8.743 -5.200 -9.931 550 HD1 TYR 78 HD1 TYR 78 5.267 -4.391 -9.835 551 HD2 TYR 78 HD2 TYR 78 9.182 -2.625 -9.956 552 HE1 TYR 78 HE1 TYR 78 4.340 -2.273 -8.939 553 HE2 TYR 78 HE2 TYR 78 8.252 -0.508 -9.063 554 HH TYR 78 HH TYR 78 5.270 0.378 -9.163 555 H SER 79 H SER 79 10.567 -5.084 -12.976 556 HA SER 79 HA SER 79 10.264 -8.015 -13.234 557 HB2 SER 79 HB2 SER 79 11.521 -6.106 -15.214 558 HB3 SER 79 HB3 SER 79 11.569 -7.864 -15.337 559 HG SER 79 HG SER 79 9.391 -7.900 -15.617 560 HA PRO 80 HA PRO 80 14.184 -8.205 -11.128 561 HB2 PRO 80 HB2 PRO 80 15.215 -10.556 -11.995 562 HB3 PRO 80 HB3 PRO 80 13.801 -10.482 -10.926 563 HG2 PRO 80 HG2 PRO 80 13.911 -10.870 -13.883 564 HG3 PRO 80 HG3 PRO 80 12.936 -11.722 -12.672 565 HD2 PRO 80 HD2 PRO 80 11.923 -9.710 -14.207 566 HD3 PRO 80 HD3 PRO 80 11.355 -10.031 -12.554 567 HA PRO 81 HA PRO 81 17.564 -6.544 -13.521 568 HB2 PRO 81 HB2 PRO 81 19.270 -8.830 -12.582 569 HB3 PRO 81 HB3 PRO 81 19.618 -7.088 -12.573 570 HG2 PRO 81 HG2 PRO 81 18.946 -8.286 -10.339 571 HG3 PRO 81 HG3 PRO 81 18.256 -6.698 -10.733 572 HD2 PRO 81 HD2 PRO 81 16.969 -9.409 -10.899 573 HD3 PRO 81 HD3 PRO 81 16.264 -7.854 -10.394 574 H GLU 82 H GLU 82 17.204 -10.071 -13.691 575 HA GLU 82 HA GLU 82 17.415 -11.577 -15.405 576 HB2 GLU 82 HB2 GLU 82 15.478 -10.091 -16.118 577 HB3 GLU 82 HB3 GLU 82 16.620 -9.257 -17.175 578 HG2 GLU 82 HG2 GLU 82 17.147 -11.379 -18.297 579 HG3 GLU 82 HG3 GLU 82 16.032 -12.231 -17.232 580 HA PRO 83 HA PRO 83 21.561 -9.685 -16.744 581 HB2 PRO 83 HB2 PRO 83 23.194 -11.532 -15.564 582 HB3 PRO 83 HB3 PRO 83 22.641 -10.057 -14.746 583 HG2 PRO 83 HG2 PRO 83 21.595 -12.842 -14.536 584 HG3 PRO 83 HG3 PRO 83 21.891 -11.649 -13.257 585 HD2 PRO 83 HD2 PRO 83 19.403 -12.114 -14.237 586 HD3 PRO 83 HD3 PRO 83 19.911 -10.506 -13.676 587 H GLU 84 H GLU 84 20.107 -12.849 -16.833 588 HA GLU 84 HA GLU 84 21.432 -13.384 -19.409 589 HB2 GLU 84 HB2 GLU 84 22.589 -14.644 -17.557 590 HB3 GLU 84 HB3 GLU 84 21.076 -15.502 -17.278 591 HG2 GLU 84 HG2 GLU 84 21.098 -16.299 -19.617 592 HG3 GLU 84 HG3 GLU 84 22.614 -15.446 -19.892 593 H SER 85 H SER 85 20.100 -14.166 -20.940 594 HA SER 85 HA SER 85 17.599 -15.486 -20.243 595 HB2 SER 85 HB2 SER 85 17.650 -12.861 -21.745 596 HB3 SER 85 HB3 SER 85 16.250 -13.922 -21.635 597 HG SER 85 HG SER 85 16.455 -13.713 -19.325 598 H GLU 86 H GLU 86 17.067 -16.993 -21.726 599 HA GLU 86 HA GLU 86 18.825 -17.527 -23.913 600 HB2 GLU 86 HB2 GLU 86 16.152 -18.711 -23.130 601 HB3 GLU 86 HB3 GLU 86 17.154 -19.324 -24.442 602 HG2 GLU 86 HG2 GLU 86 19.002 -19.719 -22.867 603 HG3 GLU 86 HG3 GLU 86 18.022 -19.082 -21.549 604 HA PRO 87 HA PRO 87 17.008 -15.071 -27.167 605 HB2 PRO 87 HB2 PRO 87 17.143 -17.499 -28.904 606 HB3 PRO 87 HB3 PRO 87 17.795 -15.873 -29.185 607 HG2 PRO 87 HG2 PRO 87 19.411 -17.850 -28.546 608 HG3 PRO 87 HG3 PRO 87 19.643 -16.239 -27.838 609 HD2 PRO 87 HD2 PRO 87 18.428 -18.688 -26.584 610 HD3 PRO 87 HD3 PRO 87 19.528 -17.486 -25.872 611 H ALA 88 H ALA 88 14.970 -14.581 -27.833 612 HA ALA 88 HA ALA 88 12.807 -16.401 -27.148 613 HB1 ALA 88 HB1 ALA 88 12.895 -13.552 -28.152 614 HB2 ALA 88 HB2 ALA 88 12.436 -14.123 -26.547 615 HB3 ALA 88 HB3 ALA 88 11.388 -14.437 -27.930 616 H TYR 89 H TYR 89 11.381 -17.351 -28.576 617 HA TYR 89 HA TYR 89 12.336 -18.040 -31.149 618 HB2 TYR 89 HB2 TYR 89 9.594 -18.291 -29.894 619 HB3 TYR 89 HB3 TYR 89 10.017 -18.974 -31.466 620 HD1 TYR 89 HD1 TYR 89 10.541 -19.186 -27.828 621 HD2 TYR 89 HD2 TYR 89 11.609 -20.828 -31.652 622 HE1 TYR 89 HE1 TYR 89 11.540 -21.157 -26.704 623 HE2 TYR 89 HE2 TYR 89 12.610 -22.798 -30.526 624 HH TYR 89 HH TYR 89 11.982 -23.741 -27.571 625 H THR 90 H THR 90 9.875 -15.719 -30.065 626 HA THR 90 HA THR 90 10.227 -14.180 -32.516 627 HB THR 90 HB THR 90 7.814 -14.127 -33.026 628 HG1 THR 90 HG1 THR 90 6.410 -15.194 -31.832 629 HG21 THR 90 HG21 THR 90 9.418 -15.860 -34.026 630 HG22 THR 90 HG22 THR 90 7.698 -16.236 -34.121 631 HG23 THR 90 HG23 THR 90 8.702 -17.011 -32.896 632 HA PRO 91 HA PRO 91 9.439 -10.926 -29.560 633 HB2 PRO 91 HB2 PRO 91 8.743 -8.839 -31.143 634 HB3 PRO 91 HB3 PRO 91 10.396 -9.491 -31.112 635 HG2 PRO 91 HG2 PRO 91 8.206 -9.983 -33.082 636 HG3 PRO 91 HG3 PRO 91 9.927 -9.665 -33.365 637 HD2 PRO 91 HD2 PRO 91 8.863 -12.183 -33.424 638 HD3 PRO 91 HD3 PRO 91 10.542 -11.857 -32.946 639 HA PRO 92 HA PRO 92 4.988 -11.031 -28.894 640 HB2 PRO 92 HB2 PRO 92 4.669 -9.168 -26.949 641 HB3 PRO 92 HB3 PRO 92 5.448 -10.733 -26.643 642 HG2 PRO 92 HG2 PRO 92 6.693 -8.064 -27.117 643 HG3 PRO 92 HG3 PRO 92 7.119 -9.312 -25.933 644 HD2 PRO 92 HD2 PRO 92 8.480 -8.967 -28.286 645 HD3 PRO 92 HD3 PRO 92 8.346 -10.538 -27.465 646 HA PRO 93 HA PRO 93 3.565 -7.601 -31.481 647 HB2 PRO 93 HB2 PRO 93 0.888 -8.012 -31.460 648 HB3 PRO 93 HB3 PRO 93 2.002 -9.087 -32.332 649 HG2 PRO 93 HG2 PRO 93 0.711 -9.457 -29.669 650 HG3 PRO 93 HG3 PRO 93 0.941 -10.624 -30.983 651 HD2 PRO 93 HD2 PRO 93 2.567 -10.519 -28.776 652 HD3 PRO 93 HD3 PRO 93 3.113 -11.103 -30.363 653 H ALA 94 H ALA 94 2.974 -5.483 -31.161 654 HA ALA 94 HA ALA 94 1.174 -4.640 -29.097 655 HB1 ALA 94 HB1 ALA 94 3.331 -5.169 -27.842 656 HB2 ALA 94 HB2 ALA 94 2.673 -3.548 -27.616 657 HB3 ALA 94 HB3 ALA 94 4.044 -3.801 -28.695 658 H ALA 95 H ALA 95 0.615 -2.486 -29.241 659 HA ALA 95 HA ALA 95 2.016 -0.616 -30.893 660 HB1 ALA 95 HB1 ALA 95 -0.529 -0.904 -32.240 661 HB2 ALA 95 HB2 ALA 95 0.380 -2.415 -32.290 662 HB3 ALA 95 HB3 ALA 95 1.104 -0.930 -32.908 663 HA PRO 96 HA PRO 96 -2.233 1.417 -29.549 664 HB2 PRO 96 HB2 PRO 96 -3.156 -0.611 -27.558 665 HB3 PRO 96 HB3 PRO 96 -4.105 0.382 -28.684 666 HG2 PRO 96 HG2 PRO 96 -3.751 -2.188 -29.149 667 HG3 PRO 96 HG3 PRO 96 -3.677 -1.013 -30.476 668 HD2 PRO 96 HD2 PRO 96 -1.412 -2.398 -29.064 669 HD3 PRO 96 HD3 PRO 96 -1.616 -2.045 -30.793 670 H VAL 97 H VAL 97 -1.618 3.027 -28.226 671 HA VAL 97 HA VAL 97 0.292 2.685 -26.142 672 HB VAL 97 HB VAL 97 -1.500 5.029 -26.861 673 HG11 VAL 97 HG11 VAL 97 0.114 6.393 -25.536 674 HG12 VAL 97 HG12 VAL 97 0.889 4.907 -24.988 675 HG13 VAL 97 HG13 VAL 97 -0.777 5.254 -24.529 676 HG21 VAL 97 HG21 VAL 97 0.411 5.886 -28.031 677 HG22 VAL 97 HG22 VAL 97 0.223 4.208 -28.539 678 HG23 VAL 97 HG23 VAL 97 1.460 4.639 -27.356 679 H PHE 98 H PHE 98 -3.204 3.303 -26.181 680 HA PHE 98 HA PHE 98 -3.517 1.988 -23.602 681 HB2 PHE 98 HB2 PHE 98 -2.988 4.390 -23.075 682 HB3 PHE 98 HB3 PHE 98 -4.434 4.854 -23.976 683 HD1 PHE 98 HD1 PHE 98 -3.175 3.063 -20.990 684 HD2 PHE 98 HD2 PHE 98 -6.646 4.502 -23.072 685 HE1 PHE 98 HE1 PHE 98 -4.557 2.632 -18.980 686 HE2 PHE 98 HE2 PHE 98 -8.031 4.067 -21.060 687 HZ PHE 98 HZ PHE 98 -6.985 3.132 -19.014 688 H ASP 99 H ASP 99 -5.297 0.754 -23.725 689 HA ASP 99 HA ASP 99 -7.258 1.293 -25.843 690 HB2 ASP 99 HB2 ASP 99 -6.133 -1.007 -25.381 691 HB3 ASP 99 HB3 ASP 99 -7.273 -1.115 -24.043 692 H ARG 100 H ARG 100 -9.577 1.001 -25.314 693 HA ARG 100 HA ARG 100 -10.253 2.513 -22.935 694 HB2 ARG 100 HB2 ARG 100 -11.940 1.358 -25.174 695 HB3 ARG 100 HB3 ARG 100 -12.594 2.316 -23.845 696 HG2 ARG 100 HG2 ARG 100 -10.345 3.336 -25.591 697 HG3 ARG 100 HG3 ARG 100 -12.038 3.577 -26.019 698 HD2 ARG 100 HD2 ARG 100 -10.787 4.446 -23.395 699 HD3 ARG 100 HD3 ARG 100 -11.080 5.510 -24.765 700 HE ARG 100 HE ARG 100 -13.516 4.306 -24.216 701 HH11 ARG 100 HH11 ARG 100 -11.257 6.347 -22.477 702 HH12 ARG 100 HH12 ARG 100 -12.489 7.071 -21.497 703 HH21 ARG 100 HH21 ARG 100 -15.083 5.270 -22.921 704 HH22 ARG 100 HH22 ARG 100 -14.637 6.466 -21.749 705 H ASP 101 H ASP 101 -9.108 0.369 -21.954 706 HA ASP 101 HA ASP 101 -11.256 -1.490 -21.146 707 HB2 ASP 101 HB2 ASP 101 -8.335 -1.807 -21.670 708 HB3 ASP 101 HB3 ASP 101 -9.033 -2.774 -20.369 709 H GLU 102 H GLU 102 -11.706 -1.752 -18.989 710 HA GLU 102 HA GLU 102 -9.975 -0.472 -16.999 711 HB2 GLU 102 HB2 GLU 102 -12.950 0.063 -17.244 712 HB3 GLU 102 HB3 GLU 102 -11.927 0.591 -15.909 713 HG2 GLU 102 HG2 GLU 102 -10.541 1.893 -17.497 714 HG3 GLU 102 HG3 GLU 102 -11.592 1.385 -18.817 715 H VAL 103 H VAL 103 -10.137 -1.423 -14.923 716 HA VAL 103 HA VAL 103 -12.015 -3.651 -14.597 717 HB VAL 103 HB VAL 103 -10.202 -5.124 -13.757 718 HG11 VAL 103 HG11 VAL 103 -9.673 -4.123 -16.569 719 HG12 VAL 103 HG12 VAL 103 -10.990 -5.213 -16.129 720 HG13 VAL 103 HG13 VAL 103 -9.315 -5.731 -15.935 721 HG21 VAL 103 HG21 VAL 103 -8.519 -3.512 -13.101 722 HG22 VAL 103 HG22 VAL 103 -8.431 -2.863 -14.736 723 HG23 VAL 103 HG23 VAL 103 -7.835 -4.489 -14.401 724 H ALA 104 H ALA 104 -12.226 -4.327 -12.322 725 HA ALA 104 HA ALA 104 -12.086 -2.047 -10.549 726 HB1 ALA 104 HB1 ALA 104 -12.918 -4.873 -9.869 727 HB2 ALA 104 HB2 ALA 104 -13.999 -3.703 -10.628 728 HB3 ALA 104 HB3 ALA 104 -13.347 -3.389 -9.018 729 H GLU 105 H GLU 105 -10.016 -1.590 -9.973 730 HA GLU 105 HA GLU 105 -7.872 -3.233 -9.583 731 HB2 GLU 105 HB2 GLU 105 -8.039 -0.673 -9.481 732 HB3 GLU 105 HB3 GLU 105 -8.403 -0.884 -7.773 733 HG2 GLU 105 HG2 GLU 105 -6.010 -0.509 -8.039 734 HG3 GLU 105 HG3 GLU 105 -6.279 -2.168 -7.512 735 H GLN 106 H GLN 106 -6.987 -4.404 -7.967 736 HA GLN 106 HA GLN 106 -8.642 -4.905 -5.559 737 HB2 GLN 106 HB2 GLN 106 -7.958 -7.276 -5.660 738 HB3 GLN 106 HB3 GLN 106 -8.852 -6.794 -7.101 739 HG2 GLN 106 HG2 GLN 106 -6.680 -6.448 -8.286 740 HG3 GLN 106 HG3 GLN 106 -5.839 -7.052 -6.860 741 HE21 GLN 106 HE21 GLN 106 -5.381 -9.249 -6.954 742 HE22 GLN 106 HE22 GLN 106 -6.265 -10.394 -7.843 743 H LEU 107 H LEU 107 -6.441 -3.051 -5.806 744 HA LEU 107 HA LEU 107 -4.131 -4.266 -4.556 745 HB2 LEU 107 HB2 LEU 107 -4.810 -1.383 -5.202 746 HB3 LEU 107 HB3 LEU 107 -3.283 -1.908 -4.498 747 HG LEU 107 HG LEU 107 -4.363 -3.026 -7.101 748 HD11 LEU 107 HD11 LEU 107 -4.006 -0.727 -7.578 749 HD12 LEU 107 HD12 LEU 107 -2.515 -1.515 -8.087 750 HD13 LEU 107 HD13 LEU 107 -2.579 -0.651 -6.552 751 HD21 LEU 107 HD21 LEU 107 -2.715 -4.474 -6.087 752 HD22 LEU 107 HD22 LEU 107 -1.672 -3.107 -5.697 753 HD23 LEU 107 HD23 LEU 107 -1.896 -3.592 -7.378 754 H VAL 108 H VAL 108 -3.252 -2.670 -2.647 755 HA VAL 108 HA VAL 108 -5.398 -2.365 -0.650 756 HB VAL 108 HB VAL 108 -3.957 -3.402 1.082 757 HG11 VAL 108 HG11 VAL 108 -4.250 -5.745 0.300 758 HG12 VAL 108 HG12 VAL 108 -4.567 -5.142 -1.326 759 HG13 VAL 108 HG13 VAL 108 -5.676 -4.755 -0.010 760 HG21 VAL 108 HG21 VAL 108 -1.785 -3.014 -0.140 761 HG22 VAL 108 HG22 VAL 108 -2.235 -4.304 -1.253 762 HG23 VAL 108 HG23 VAL 108 -1.974 -4.663 0.453 763 H GLY 109 H GLY 109 -4.866 -0.947 1.115 764 HA2 GLY 109 HA2 GLY 109 -3.186 1.272 0.273 765 HA3 GLY 109 HA3 GLY 109 -4.242 1.229 1.684 766 H VAL 110 H VAL 110 -1.777 2.332 1.962 767 HA VAL 110 HA VAL 110 0.143 2.282 3.224 768 HB VAL 110 HB VAL 110 -1.184 -0.097 4.568 769 HG11 VAL 110 HG11 VAL 110 1.007 1.818 5.420 770 HG12 VAL 110 HG12 VAL 110 1.134 0.069 5.221 771 HG13 VAL 110 HG13 VAL 110 0.172 0.741 6.537 772 HG21 VAL 110 HG21 VAL 110 -1.328 2.856 5.270 773 HG22 VAL 110 HG22 VAL 110 -2.090 1.537 6.159 774 HG23 VAL 110 HG23 VAL 110 -2.635 1.933 4.527 775 H SER 111 H SER 111 1.728 1.776 1.778 776 HA SER 111 HA SER 111 2.128 -0.816 0.670 777 HB2 SER 111 HB2 SER 111 3.975 1.577 0.820 778 HB3 SER 111 HB3 SER 111 4.223 0.159 -0.194 779 HG SER 111 HG SER 111 2.827 2.305 -0.757 780 H ALA 112 H ALA 112 4.538 -1.655 0.813 781 HA ALA 112 HA ALA 112 5.514 -1.669 3.575 782 HB1 ALA 112 HB1 ALA 112 5.576 -4.109 3.691 783 HB2 ALA 112 HB2 ALA 112 4.869 -4.226 2.079 784 HB3 ALA 112 HB3 ALA 112 3.921 -3.567 3.413 785 H ALA 113 H ALA 113 6.181 -3.727 0.726 786 HA ALA 113 HA ALA 113 8.084 -4.078 -0.505 787 HB1 ALA 113 HB1 ALA 113 9.698 -1.930 -0.440 788 HB2 ALA 113 HB2 ALA 113 8.219 -1.177 0.155 789 HB3 ALA 113 HB3 ALA 113 8.229 -1.977 -1.415 790 H SER 114 H SER 114 8.156 -5.363 1.742 791 HA SER 114 HA SER 114 10.286 -4.745 3.538 792 HB2 SER 114 HB2 SER 114 9.892 -6.936 4.465 793 HB3 SER 114 HB3 SER 114 8.329 -6.224 4.070 794 HG SER 114 HG SER 114 8.925 -8.506 3.353 795 H ALA 115 H ALA 115 12.195 -6.143 3.866 796 HA ALA 115 HA ALA 115 13.214 -7.577 1.553 797 HB1 ALA 115 HB1 ALA 115 14.960 -6.170 1.014 798 HB2 ALA 115 HB2 ALA 115 15.021 -5.451 2.623 799 HB3 ALA 115 HB3 ALA 115 13.760 -4.967 1.487 800 H ALA 116 H ALA 116 15.125 -8.804 2.096 801 HA ALA 116 HA ALA 116 16.168 -8.766 4.752 802 HB1 ALA 116 HB1 ALA 116 15.293 -11.297 5.009 803 HB2 ALA 116 HB2 ALA 116 13.948 -10.622 4.091 804 HB3 ALA 116 HB3 ALA 116 14.404 -9.911 5.638 805 H ALA 117 H ALA 117 17.737 -8.512 2.737 806 HA ALA 117 HA ALA 117 18.588 -11.002 1.536 807 HB1 ALA 117 HB1 ALA 117 19.914 -8.276 1.515 808 HB2 ALA 117 HB2 ALA 117 18.769 -8.865 0.310 809 HB3 ALA 117 HB3 ALA 117 20.341 -9.643 0.486 810 H SER 118 H SER 118 20.423 -8.611 3.483 811 HA SER 118 HA SER 118 21.296 -10.481 5.433 812 HB2 SER 118 HB2 SER 118 22.600 -11.394 3.556 813 HB3 SER 118 HB3 SER 118 23.306 -9.807 3.268 814 HG SER 118 HG SER 118 24.718 -10.365 4.710 815 H ALA 119 H ALA 119 22.764 -7.776 3.621 816 HA ALA 119 HA ALA 119 23.625 -5.758 4.306 817 HB1 ALA 119 HB1 ALA 119 22.186 -4.426 5.568 818 HB2 ALA 119 HB2 ALA 119 21.695 -5.765 6.604 819 HB3 ALA 119 HB3 ALA 119 21.085 -5.659 4.953 820 H PHE 120 H PHE 120 24.309 -4.536 6.521 821 HA PHE 120 HA PHE 120 25.796 -4.479 8.259 822 HB2 PHE 120 HB2 PHE 120 24.647 -7.226 8.830 823 HB3 PHE 120 HB3 PHE 120 25.697 -6.327 9.925 824 HD1 PHE 120 HD1 PHE 120 22.341 -6.569 8.468 825 HD2 PHE 120 HD2 PHE 120 24.926 -4.232 10.980 826 HE1 PHE 120 HE1 PHE 120 20.376 -5.323 9.330 827 HE2 PHE 120 HE2 PHE 120 22.963 -2.987 11.842 828 HZ PHE 120 HZ PHE 120 20.687 -3.533 11.017 829 H GLY 121 H GLY 121 27.510 -4.423 6.742 830 HA2 GLY 121 HA2 GLY 121 28.855 -6.810 5.867 831 HA3 GLY 121 HA3 GLY 121 29.438 -5.157 5.687 832 H SER 122 H SER 122 31.355 -6.843 6.264 833 HA SER 122 HA SER 122 32.101 -6.172 9.009 834 HB2 SER 122 HB2 SER 122 31.043 -8.370 9.247 835 HB3 SER 122 HB3 SER 122 32.083 -9.022 7.984 836 HG SER 122 HG SER 122 33.766 -8.950 9.312 837 H LEU 123 H LEU 123 34.330 -6.156 9.367 838 HA LEU 123 HA LEU 123 36.541 -5.858 8.837 839 HB2 LEU 123 HB2 LEU 123 36.284 -8.308 8.221 840 HB3 LEU 123 HB3 LEU 123 36.070 -7.785 6.552 841 HG LEU 123 HG LEU 123 38.286 -6.557 6.764 842 HD11 LEU 123 HD11 LEU 123 39.791 -7.520 8.587 843 HD12 LEU 123 HD12 LEU 123 38.323 -8.127 9.354 844 HD13 LEU 123 HD13 LEU 123 38.554 -6.390 9.140 845 HD21 LEU 123 HD21 LEU 123 38.018 -8.775 5.651 846 HD22 LEU 123 HD22 LEU 123 38.366 -9.560 7.190 847 HD23 LEU 123 HD23 LEU 123 39.604 -8.582 6.400 848 H SER 124 H SER 124 37.052 -3.920 8.100 849 HA SER 124 HA SER 124 36.453 -3.258 5.277 850 HB2 SER 124 HB2 SER 124 36.433 -1.435 7.693 851 HB3 SER 124 HB3 SER 124 36.335 -0.873 6.025 852 HG SER 124 HG SER 124 34.515 -2.460 7.493 853 H SER 125 H SER 125 38.496 -2.098 7.982 854 HA SER 125 HA SER 125 40.903 -2.593 6.479 855 HB2 SER 125 HB2 SER 125 40.221 -0.446 5.510 856 HB3 SER 125 HB3 SER 125 40.079 0.250 7.121 857 HG SER 125 HG SER 125 42.094 0.775 6.591 858 H ALA 126 H ALA 126 42.772 -2.468 7.756 859 HA ALA 126 HA ALA 126 42.408 -3.045 10.498 860 HB1 ALA 126 HB1 ALA 126 44.351 -4.013 9.759 861 HB2 ALA 126 HB2 ALA 126 45.041 -2.524 10.406 862 HB3 ALA 126 HB3 ALA 126 44.731 -2.675 8.676 863 H LEU 127 H LEU 127 43.902 -1.832 12.148 864 HA LEU 127 HA LEU 127 44.309 0.942 11.919 865 HB2 LEU 127 HB2 LEU 127 41.771 0.891 11.893 866 HB3 LEU 127 HB3 LEU 127 41.840 0.281 13.544 867 HG LEU 127 HG LEU 127 43.237 2.320 14.131 868 HD11 LEU 127 HD11 LEU 127 44.033 3.028 11.980 869 HD12 LEU 127 HD12 LEU 127 42.900 4.268 12.518 870 HD13 LEU 127 HD13 LEU 127 42.398 3.075 11.319 871 HD21 LEU 127 HD21 LEU 127 40.895 2.253 14.734 872 HD22 LEU 127 HD22 LEU 127 40.411 2.675 13.091 873 HD23 LEU 127 HD23 LEU 127 41.243 3.860 14.097 874 H LEU 128 H LEU 128 46.106 -0.603 12.793 875 HA LEU 128 HA LEU 128 45.951 -0.908 15.711 876 HB2 LEU 128 HB2 LEU 128 47.662 -2.043 13.529 877 HB3 LEU 128 HB3 LEU 128 48.329 -1.958 15.159 878 HG LEU 128 HG LEU 128 46.164 -3.116 15.931 879 HD11 LEU 128 HD11 LEU 128 44.777 -2.791 13.988 880 HD12 LEU 128 HD12 LEU 128 45.116 -4.520 14.100 881 HD13 LEU 128 HD13 LEU 128 45.988 -3.523 12.934 882 HD21 LEU 128 HD21 LEU 128 47.015 -5.364 15.200 883 HD22 LEU 128 HD22 LEU 128 48.273 -4.321 15.859 884 HD23 LEU 128 HD23 LEU 128 48.132 -4.540 14.116 885 H MET 129 H MET 129 46.858 0.507 17.039 886 HA MET 129 HA MET 129 49.049 2.224 16.048 887 HB2 MET 129 HB2 MET 129 46.682 3.121 17.721 888 HB3 MET 129 HB3 MET 129 48.076 4.121 17.315 889 HG2 MET 129 HG2 MET 129 46.217 2.849 15.283 890 HG3 MET 129 HG3 MET 129 46.136 4.531 15.802 891 HE1 MET 129 HE1 MET 129 47.690 6.242 15.490 892 HE2 MET 129 HE2 MET 129 49.130 6.268 14.477 893 HE3 MET 129 HE3 MET 129 49.188 5.484 16.053 894 HA PRO 130 HA PRO 130 50.108 0.085 20.095 895 HB2 PRO 130 HB2 PRO 130 52.603 -0.757 19.401 896 HB3 PRO 130 HB3 PRO 130 51.138 -1.691 19.042 897 HG2 PRO 130 HG2 PRO 130 52.715 0.114 17.262 898 HG3 PRO 130 HG3 PRO 130 52.020 -1.482 16.919 899 HD2 PRO 130 HD2 PRO 130 50.814 0.818 16.117 900 HD3 PRO 130 HD3 PRO 130 49.888 -0.632 16.565 901 H LYS 131 H LYS 131 51.396 0.877 21.747 902 HA LYS 131 HA LYS 131 52.346 3.562 21.509 903 HB2 LYS 131 HB2 LYS 131 52.625 1.548 23.752 904 HB3 LYS 131 HB3 LYS 131 53.046 3.254 23.877 905 HG2 LYS 131 HG2 LYS 131 50.284 2.278 23.098 906 HG3 LYS 131 HG3 LYS 131 50.743 2.657 24.756 907 HD2 LYS 131 HD2 LYS 131 51.339 4.970 24.031 908 HD3 LYS 131 HD3 LYS 131 50.776 4.580 22.406 909 HE2 LYS 131 HE2 LYS 131 48.530 4.086 23.292 910 HE3 LYS 131 HE3 LYS 131 49.087 4.477 24.919 911 HZ1 LYS 131 HZ1 LYS 131 48.826 6.292 22.597 912 HZ2 LYS 131 HZ2 LYS 131 49.733 6.705 23.972 913 HZ3 LYS 131 HZ3 LYS 131 48.065 6.409 24.108 914 H ASP 132 H ASP 132 53.857 0.442 21.230 915 HA ASP 132 HA ASP 132 56.534 1.150 21.824 916 HB2 ASP 132 HB2 ASP 132 55.386 -1.013 20.049 917 HB3 ASP 132 HB3 ASP 132 57.094 -0.882 20.465 918 H GLY 133 H GLY 133 58.238 1.761 20.512 919 HA2 GLY 133 HA2 GLY 133 58.904 1.983 18.048 920 HA3 GLY 133 HA3 GLY 133 57.471 3.001 17.941 921 H LEU 134 H LEU 134 60.409 2.656 19.938 922 HA LEU 134 HA LEU 134 60.477 5.330 20.860 923 HB2 LEU 134 HB2 LEU 134 62.602 3.200 20.597 924 HB3 LEU 134 HB3 LEU 134 62.958 4.802 21.239 925 HG LEU 134 HG LEU 134 60.993 4.402 22.859 926 HD11 LEU 134 HD11 LEU 134 60.729 1.873 23.321 927 HD12 LEU 134 HD12 LEU 134 61.390 1.638 21.702 928 HD13 LEU 134 HD13 LEU 134 59.884 2.527 21.919 929 HD21 LEU 134 HD21 LEU 134 63.309 4.368 23.617 930 HD22 LEU 134 HD22 LEU 134 63.516 2.721 23.016 931 HD23 LEU 134 HD23 LEU 134 62.443 3.033 24.382 932 H GLU 135 H GLU 135 61.925 3.738 18.051 933 HA GLU 135 HA GLU 135 62.959 4.548 16.171 934 HB2 GLU 135 HB2 GLU 135 61.224 6.955 16.790 935 HB3 GLU 135 HB3 GLU 135 62.033 6.654 15.254 936 HG2 GLU 135 HG2 GLU 135 60.771 4.536 15.012 937 HG3 GLU 135 HG3 GLU 135 59.945 4.864 16.534 938 H HIS 136 H HIS 136 64.370 4.872 18.643 939 HA HIS 136 HA HIS 136 66.036 7.221 17.963 940 HB2 HIS 136 HB2 HIS 136 64.599 7.579 20.020 941 HB3 HIS 136 HB3 HIS 136 65.500 6.270 20.783 942 HD2 HIS 136 HD2 HIS 136 65.961 10.027 19.894 943 HE1 HIS 136 HE1 HIS 136 69.592 8.678 21.568 944 HE2 HIS 136 HE2 HIS 136 68.306 10.727 20.805 945 H HIS 137 H HIS 137 67.821 6.322 17.126 946 HA HIS 137 HA HIS 137 69.062 4.042 18.560 947 HB2 HIS 137 HB2 HIS 137 69.184 4.711 15.609 948 HB3 HIS 137 HB3 HIS 137 70.066 3.401 16.389 949 HD2 HIS 137 HD2 HIS 137 66.650 3.971 14.777 950 HE1 HIS 137 HE1 HIS 137 66.241 0.495 17.139 951 HE2 HIS 137 HE2 HIS 137 65.144 1.913 15.340 952 H HIS 138 H HIS 138 69.415 7.106 18.753 953 HA HIS 138 HA HIS 138 72.227 7.384 17.974 954 HB2 HIS 138 HB2 HIS 138 70.217 9.345 19.093 955 HB3 HIS 138 HB3 HIS 138 71.903 9.748 18.764 956 HD2 HIS 138 HD2 HIS 138 72.497 10.188 16.059 957 HE1 HIS 138 HE1 HIS 138 68.686 9.209 14.526 958 HE2 HIS 138 HE2 HIS 138 70.971 10.151 13.941 959 H HIS 139 H HIS 139 73.887 7.339 19.358 960 HA HIS 139 HA HIS 139 73.543 7.770 22.197 961 HB2 HIS 139 HB2 HIS 139 74.437 5.557 22.868 962 HB3 HIS 139 HB3 HIS 139 72.867 5.434 22.080 963 HD2 HIS 139 HD2 HIS 139 72.860 3.922 19.721 964 HE1 HIS 139 HE1 HIS 139 77.022 3.248 19.515 965 HE2 HIS 139 HE2 HIS 139 74.777 2.645 18.493 966 H HIS 140 H HIS 140 75.586 7.764 23.364 967 HA HIS 140 HA HIS 140 77.636 9.107 21.945 968 HB2 HIS 140 HB2 HIS 140 77.521 7.898 24.711 969 HB3 HIS 140 HB3 HIS 140 78.931 8.769 24.111 970 HD2 HIS 140 HD2 HIS 140 78.671 11.557 24.123 971 HE1 HIS 140 HE1 HIS 140 74.618 11.705 25.292 972 HE2 HIS 140 HE2 HIS 140 76.696 13.098 24.858 973 H HIS 141 H HIS 141 77.317 5.766 23.082 974 HA HIS 141 HA HIS 141 79.920 4.872 22.581 975 HB2 HIS 141 HB2 HIS 141 78.039 3.620 23.756 976 HB3 HIS 141 HB3 HIS 141 77.430 3.210 22.153 977 HD2 HIS 141 HD2 HIS 141 80.257 2.120 24.586 978 HE1 HIS 141 HE1 HIS 141 80.805 -0.028 20.993 979 HE2 HIS 141 HE2 HIS 141 81.553 0.184 23.410 Start of MODEL 9 1 H1 MET 1 HT1 MET 1 -3.071 8.172 -13.386 2 H2 MET 1 HT2 MET 1 -3.190 7.749 -11.745 3 H3 MET 1 HT3 MET 1 -1.669 7.825 -12.495 4 HA MET 1 HA MET 1 -3.445 10.018 -11.662 5 HB2 MET 1 HB2 MET 1 -1.303 8.929 -10.453 6 HB3 MET 1 HB3 MET 1 -0.450 10.040 -11.525 7 HG2 MET 1 HG2 MET 1 -2.754 10.987 -9.816 8 HG3 MET 1 HG3 MET 1 -1.114 10.905 -9.173 9 HE1 MET 1 HE1 MET 1 -0.859 13.588 -8.757 10 HE2 MET 1 HE2 MET 1 -2.586 13.346 -9.008 11 HE3 MET 1 HE3 MET 1 -1.761 14.674 -9.821 12 H SER 2 H SER 2 -0.474 9.493 -13.580 13 HA SER 2 HA SER 2 -1.330 11.682 -15.388 14 HB2 SER 2 HB2 SER 2 1.473 10.852 -14.602 15 HB3 SER 2 HB3 SER 2 1.080 12.082 -15.800 16 HG SER 2 HG SER 2 -0.122 13.127 -14.072 17 H ASP 3 H ASP 3 -0.950 11.425 -17.608 18 HA ASP 3 HA ASP 3 -1.342 8.843 -18.659 19 HB2 ASP 3 HB2 ASP 3 -0.432 11.423 -19.947 20 HB3 ASP 3 HB3 ASP 3 -0.751 9.957 -20.865 21 H GLN 4 H GLN 4 1.571 10.842 -18.384 22 HA GLN 4 HA GLN 4 3.346 9.232 -19.828 23 HB2 GLN 4 HB2 GLN 4 3.830 11.536 -18.959 24 HB3 GLN 4 HB3 GLN 4 4.011 10.845 -17.350 25 HG2 GLN 4 HG2 GLN 4 6.213 11.075 -18.378 26 HG3 GLN 4 HG3 GLN 4 5.819 9.366 -18.222 27 HE21 GLN 4 HE21 GLN 4 6.491 8.270 -20.068 28 HE22 GLN 4 HE22 GLN 4 6.371 8.865 -21.653 29 H SER 5 H SER 5 2.461 9.127 -16.376 30 HA SER 5 HA SER 5 2.806 7.538 -14.758 31 HB2 SER 5 HB2 SER 5 2.528 5.746 -17.181 32 HB3 SER 5 HB3 SER 5 2.416 5.205 -15.510 33 HG SER 5 HG SER 5 0.384 5.756 -16.616 34 H GLN 6 H GLN 6 5.122 8.644 -15.020 35 HA GLN 6 HA GLN 6 7.171 6.665 -15.741 36 HB2 GLN 6 HB2 GLN 6 7.377 9.073 -16.464 37 HB3 GLN 6 HB3 GLN 6 7.539 9.508 -14.764 38 HG2 GLN 6 HG2 GLN 6 9.759 9.292 -15.763 39 HG3 GLN 6 HG3 GLN 6 9.511 7.996 -14.594 40 HE21 GLN 6 HE21 GLN 6 10.371 6.083 -15.404 41 HE22 GLN 6 HE22 GLN 6 10.277 5.578 -17.022 42 H GLU 7 H GLU 7 5.877 8.481 -13.031 43 HA GLU 7 HA GLU 7 7.192 6.612 -11.163 44 HB2 GLU 7 HB2 GLU 7 6.990 9.617 -10.789 45 HB3 GLU 7 HB3 GLU 7 7.579 8.479 -9.580 46 HG2 GLU 7 HG2 GLU 7 9.387 7.781 -11.113 47 HG3 GLU 7 HG3 GLU 7 8.804 8.928 -12.319 48 HA PRO 8 HA PRO 8 2.572 7.154 -10.446 49 HB2 PRO 8 HB2 PRO 8 1.793 4.572 -10.734 50 HB3 PRO 8 HB3 PRO 8 1.957 5.673 -12.114 51 HG2 PRO 8 HG2 PRO 8 3.817 3.555 -11.149 52 HG3 PRO 8 HG3 PRO 8 3.361 3.991 -12.806 53 HD2 PRO 8 HD2 PRO 8 5.710 4.793 -11.628 54 HD3 PRO 8 HD3 PRO 8 4.901 5.701 -12.923 55 H THR 9 H THR 9 2.380 7.466 -8.303 56 HA THR 9 HA THR 9 3.660 5.805 -6.341 57 HB THR 9 HB THR 9 1.516 7.916 -5.952 58 HG1 THR 9 HG1 THR 9 3.076 9.343 -6.092 59 HG21 THR 9 HG21 THR 9 3.683 7.109 -4.012 60 HG22 THR 9 HG22 THR 9 2.135 6.265 -4.047 61 HG23 THR 9 HG23 THR 9 2.190 7.992 -3.688 62 H MET 10 H MET 10 2.862 4.203 -5.160 63 HA MET 10 HA MET 10 0.893 2.514 -5.984 64 HB2 MET 10 HB2 MET 10 1.883 2.998 -3.173 65 HB3 MET 10 HB3 MET 10 0.832 1.650 -3.608 66 HG2 MET 10 HG2 MET 10 2.490 0.854 -5.234 67 HG3 MET 10 HG3 MET 10 3.532 2.229 -4.866 68 HE1 MET 10 HE1 MET 10 4.489 -0.379 -5.025 69 HE2 MET 10 HE2 MET 10 5.066 -1.143 -3.544 70 HE3 MET 10 HE3 MET 10 5.711 0.424 -4.027 71 H GLU 11 H GLU 11 0.420 5.132 -3.589 72 HA GLU 11 HA GLU 11 -2.324 4.526 -3.063 73 HB2 GLU 11 HB2 GLU 11 -0.733 7.087 -2.791 74 HB3 GLU 11 HB3 GLU 11 -2.418 6.942 -2.294 75 HG2 GLU 11 HG2 GLU 11 -1.215 6.489 -0.315 76 HG3 GLU 11 HG3 GLU 11 -1.643 4.894 -0.917 77 H GLU 12 H GLU 12 -0.717 6.771 -5.213 78 HA GLU 12 HA GLU 12 -2.943 7.961 -6.433 79 HB2 GLU 12 HB2 GLU 12 -0.166 7.441 -7.502 80 HB3 GLU 12 HB3 GLU 12 -1.372 8.391 -8.372 81 HG2 GLU 12 HG2 GLU 12 -1.519 9.987 -6.556 82 HG3 GLU 12 HG3 GLU 12 -0.497 8.984 -5.531 83 H ILE 13 H ILE 13 -1.222 4.989 -7.288 84 HA ILE 13 HA ILE 13 -2.540 4.443 -9.710 85 HB ILE 13 HB ILE 13 -1.201 2.611 -7.692 86 HG12 ILE 13 HG12 ILE 13 -0.227 3.548 -10.403 87 HG13 ILE 13 HG13 ILE 13 0.116 4.440 -8.924 88 HG21 ILE 13 HG21 ILE 13 -1.086 0.971 -9.583 89 HG22 ILE 13 HG22 ILE 13 -2.129 2.031 -10.532 90 HG23 ILE 13 HG23 ILE 13 -2.745 1.273 -9.064 91 HD11 ILE 13 HD11 ILE 13 0.756 1.498 -9.174 92 HD12 ILE 13 HD12 ILE 13 1.400 2.662 -8.018 93 HD13 ILE 13 HD13 ILE 13 1.889 2.738 -9.708 94 H LEU 14 H LEU 14 -3.299 3.489 -6.343 95 HA LEU 14 HA LEU 14 -5.420 1.767 -6.925 96 HB2 LEU 14 HB2 LEU 14 -4.204 2.295 -4.675 97 HB3 LEU 14 HB3 LEU 14 -5.460 3.520 -4.488 98 HG LEU 14 HG LEU 14 -6.162 0.654 -5.170 99 HD11 LEU 14 HD11 LEU 14 -5.635 1.871 -2.451 100 HD12 LEU 14 HD12 LEU 14 -4.913 0.420 -3.146 101 HD13 LEU 14 HD13 LEU 14 -6.612 0.419 -2.673 102 HD21 LEU 14 HD21 LEU 14 -8.021 2.098 -5.458 103 HD22 LEU 14 HD22 LEU 14 -7.614 3.050 -4.038 104 HD23 LEU 14 HD23 LEU 14 -8.258 1.421 -3.852 105 H ALA 15 H ALA 15 -5.392 5.233 -6.231 106 HA ALA 15 HA ALA 15 -8.186 5.666 -6.434 107 HB1 ALA 15 HB1 ALA 15 -5.749 7.393 -6.492 108 HB2 ALA 15 HB2 ALA 15 -7.131 7.435 -5.400 109 HB3 ALA 15 HB3 ALA 15 -7.280 8.083 -7.034 110 H SER 16 H SER 16 -5.548 5.808 -8.758 111 HA SER 16 HA SER 16 -6.871 7.002 -10.909 112 HB2 SER 16 HB2 SER 16 -4.483 6.470 -11.009 113 HB3 SER 16 HB3 SER 16 -4.852 4.749 -11.054 114 HG SER 16 HG SER 16 -5.229 4.937 -13.105 115 H ILE 17 H ILE 17 -6.481 3.367 -10.677 116 HA ILE 17 HA ILE 17 -9.302 3.117 -11.424 117 HB ILE 17 HB ILE 17 -7.131 1.803 -13.106 118 HG12 ILE 17 HG12 ILE 17 -9.003 4.067 -13.922 119 HG13 ILE 17 HG13 ILE 17 -7.324 4.317 -13.467 120 HG21 ILE 17 HG21 ILE 17 -10.162 1.833 -13.166 121 HG22 ILE 17 HG22 ILE 17 -9.090 0.438 -13.110 122 HG23 ILE 17 HG23 ILE 17 -9.212 1.390 -14.584 123 HD11 ILE 17 HD11 ILE 17 -6.560 2.885 -15.291 124 HD12 ILE 17 HD12 ILE 17 -7.589 4.168 -15.926 125 HD13 ILE 17 HD13 ILE 17 -8.231 2.536 -15.738 126 H ARG 18 H ARG 18 -9.003 2.369 -9.065 127 HA ARG 18 HA ARG 18 -8.879 -0.556 -9.138 128 HB2 ARG 18 HB2 ARG 18 -7.296 0.981 -7.070 129 HB3 ARG 18 HB3 ARG 18 -7.533 -0.756 -7.095 130 HG2 ARG 18 HG2 ARG 18 -6.226 0.764 -9.369 131 HG3 ARG 18 HG3 ARG 18 -5.324 0.016 -8.060 132 HD2 ARG 18 HD2 ARG 18 -6.271 -2.181 -8.641 133 HD3 ARG 18 HD3 ARG 18 -7.190 -1.451 -9.950 134 HE ARG 18 HE ARG 18 -4.354 -0.935 -10.127 135 HH11 ARG 18 HH11 ARG 18 -6.903 -3.200 -10.936 136 HH12 ARG 18 HH12 ARG 18 -6.009 -3.920 -12.235 137 HH21 ARG 18 HH21 ARG 18 -3.224 -1.908 -11.810 138 HH22 ARG 18 HH22 ARG 18 -3.942 -3.192 -12.723 139 H ARG 19 H ARG 19 -10.902 1.637 -8.813 140 HA ARG 19 HA ARG 19 -11.882 1.413 -6.107 141 HB2 ARG 19 HB2 ARG 19 -13.798 2.725 -6.941 142 HB3 ARG 19 HB3 ARG 19 -12.263 3.469 -7.379 143 HG2 ARG 19 HG2 ARG 19 -12.420 2.535 -9.640 144 HG3 ARG 19 HG3 ARG 19 -13.913 1.696 -9.211 145 HD2 ARG 19 HD2 ARG 19 -13.562 4.702 -9.084 146 HD3 ARG 19 HD3 ARG 19 -14.284 3.852 -10.448 147 HE ARG 19 HE ARG 19 -15.654 3.014 -8.169 148 HH11 ARG 19 HH11 ARG 19 -15.131 6.024 -9.886 149 HH12 ARG 19 HH12 ARG 19 -16.653 6.696 -9.404 150 HH21 ARG 19 HH21 ARG 19 -17.625 3.922 -7.575 151 HH22 ARG 19 HH22 ARG 19 -18.052 5.514 -8.107 152 H ILE 20 H ILE 20 -12.312 -0.325 -9.078 153 HA ILE 20 HA ILE 20 -14.842 -1.522 -8.433 154 HB ILE 20 HB ILE 20 -12.727 -2.369 -10.448 155 HG12 ILE 20 HG12 ILE 20 -15.312 -0.855 -10.931 156 HG13 ILE 20 HG13 ILE 20 -13.774 -0.038 -10.675 157 HG21 ILE 20 HG21 ILE 20 -14.691 -3.530 -11.531 158 HG22 ILE 20 HG22 ILE 20 -15.640 -3.165 -10.089 159 HG23 ILE 20 HG23 ILE 20 -14.235 -4.225 -9.976 160 HD11 ILE 20 HD11 ILE 20 -14.277 -2.103 -12.840 161 HD12 ILE 20 HD12 ILE 20 -12.807 -1.154 -12.619 162 HD13 ILE 20 HD13 ILE 20 -14.306 -0.357 -13.098 163 H ILE 21 H ILE 21 -15.254 -3.233 -7.216 164 HA ILE 21 HA ILE 21 -13.089 -5.106 -6.525 165 HB ILE 21 HB ILE 21 -13.284 -3.457 -4.689 166 HG12 ILE 21 HG12 ILE 21 -14.489 -6.077 -3.769 167 HG13 ILE 21 HG13 ILE 21 -12.821 -5.966 -4.330 168 HG21 ILE 21 HG21 ILE 21 -16.111 -4.493 -4.334 169 HG22 ILE 21 HG22 ILE 21 -15.720 -2.949 -5.092 170 HG23 ILE 21 HG23 ILE 21 -15.314 -3.228 -3.398 171 HD11 ILE 21 HD11 ILE 21 -14.000 -4.305 -2.080 172 HD12 ILE 21 HD12 ILE 21 -12.318 -4.298 -2.611 173 HD13 ILE 21 HD13 ILE 21 -12.998 -5.738 -1.856 174 H SER 22 H SER 22 -13.731 -7.225 -6.281 175 HA SER 22 HA SER 22 -16.514 -7.973 -6.114 176 HB2 SER 22 HB2 SER 22 -14.980 -8.491 -8.670 177 HB3 SER 22 HB3 SER 22 -16.528 -9.227 -8.261 178 HG SER 22 HG SER 22 -17.463 -7.440 -8.834 179 H GLU 23 H GLU 23 -16.050 -9.267 -4.392 180 HA GLU 23 HA GLU 23 -13.832 -11.077 -4.285 181 HB2 GLU 23 HB2 GLU 23 -14.947 -10.157 -2.260 182 HB3 GLU 23 HB3 GLU 23 -16.396 -11.074 -2.663 183 HG2 GLU 23 HG2 GLU 23 -15.099 -12.308 -1.003 184 HG3 GLU 23 HG3 GLU 23 -15.071 -13.180 -2.532 185 H ASP 24 H ASP 24 -17.259 -11.353 -5.052 186 HA ASP 24 HA ASP 24 -16.781 -13.796 -6.580 187 HB2 ASP 24 HB2 ASP 24 -17.431 -14.204 -4.020 188 HB3 ASP 24 HB3 ASP 24 -19.055 -13.942 -4.652 189 H ASP 25 H ASP 25 -19.108 -14.571 -7.396 190 HA ASP 25 HA ASP 25 -20.347 -12.183 -8.603 191 HB2 ASP 25 HB2 ASP 25 -20.538 -15.098 -9.402 192 HB3 ASP 25 HB3 ASP 25 -21.253 -13.743 -10.273 193 H ALA 26 H ALA 26 -21.106 -15.176 -6.881 194 HA ALA 26 HA ALA 26 -23.941 -14.595 -6.735 195 HB1 ALA 26 HB1 ALA 26 -23.601 -16.884 -6.772 196 HB2 ALA 26 HB2 ALA 26 -23.738 -16.604 -5.036 197 HB3 ALA 26 HB3 ALA 26 -22.147 -16.789 -5.776 198 HA PRO 27 HA PRO 27 -23.699 -12.378 -2.874 199 HB2 PRO 27 HB2 PRO 27 -26.199 -12.620 -1.898 200 HB3 PRO 27 HB3 PRO 27 -25.873 -11.726 -3.397 201 HG2 PRO 27 HG2 PRO 27 -26.944 -14.481 -3.029 202 HG3 PRO 27 HG3 PRO 27 -27.427 -13.228 -4.185 203 HD2 PRO 27 HD2 PRO 27 -25.742 -15.347 -4.793 204 HD3 PRO 27 HD3 PRO 27 -25.796 -13.816 -5.693 205 H ALA 28 H ALA 28 -22.259 -14.484 -2.388 206 HA ALA 28 HA ALA 28 -23.194 -16.469 -0.623 207 HB1 ALA 28 HB1 ALA 28 -21.131 -16.970 -1.566 208 HB2 ALA 28 HB2 ALA 28 -20.665 -16.473 0.061 209 HB3 ALA 28 HB3 ALA 28 -20.494 -15.348 -1.286 210 H GLU 29 H GLU 29 -21.799 -13.266 -0.035 211 HA GLU 29 HA GLU 29 -23.105 -13.064 2.509 212 HB2 GLU 29 HB2 GLU 29 -20.935 -14.494 2.858 213 HB3 GLU 29 HB3 GLU 29 -20.096 -12.953 2.689 214 HG2 GLU 29 HG2 GLU 29 -22.328 -13.485 4.675 215 HG3 GLU 29 HG3 GLU 29 -20.612 -13.531 5.069 216 HA PRO 30 HA PRO 30 -22.033 -9.174 0.009 217 HB2 PRO 30 HB2 PRO 30 -24.897 -8.625 0.645 218 HB3 PRO 30 HB3 PRO 30 -24.018 -8.388 -0.880 219 HG2 PRO 30 HG2 PRO 30 -25.731 -10.373 -0.632 220 HG3 PRO 30 HG3 PRO 30 -24.184 -10.624 -1.466 221 HD2 PRO 30 HD2 PRO 30 -24.961 -11.421 1.333 222 HD3 PRO 30 HD3 PRO 30 -24.051 -12.344 0.112 223 H ALA 31 H ALA 31 -21.387 -7.280 0.999 224 HA ALA 31 HA ALA 31 -22.611 -6.324 3.431 225 HB1 ALA 31 HB1 ALA 31 -21.255 -7.947 4.514 226 HB2 ALA 31 HB2 ALA 31 -20.387 -6.420 4.683 227 HB3 ALA 31 HB3 ALA 31 -19.874 -7.597 3.474 228 H ALA 32 H ALA 32 -21.981 -4.224 3.963 229 HA ALA 32 HA ALA 32 -19.854 -2.893 2.521 230 HB1 ALA 32 HB1 ALA 32 -21.874 -1.150 1.878 231 HB2 ALA 32 HB2 ALA 32 -22.662 -2.712 1.650 232 HB3 ALA 32 HB3 ALA 32 -21.182 -2.335 0.772 233 H GLU 33 H GLU 33 -19.311 -0.888 3.425 234 HA GLU 33 HA GLU 33 -20.884 0.014 5.747 235 HB2 GLU 33 HB2 GLU 33 -17.903 -0.520 5.794 236 HB3 GLU 33 HB3 GLU 33 -18.814 0.260 7.086 237 HG2 GLU 33 HG2 GLU 33 -20.212 -1.770 7.318 238 HG3 GLU 33 HG3 GLU 33 -19.276 -2.551 6.044 239 H ALA 34 H ALA 34 -21.547 1.824 4.589 240 HA ALA 34 HA ALA 34 -19.568 3.612 3.426 241 HB1 ALA 34 HB1 ALA 34 -21.820 3.203 2.370 242 HB2 ALA 34 HB2 ALA 34 -21.447 4.906 2.653 243 HB3 ALA 34 HB3 ALA 34 -22.545 4.050 3.737 244 H ALA 35 H ALA 35 -18.869 5.481 4.268 245 HA ALA 35 HA ALA 35 -20.118 6.575 6.673 246 HB1 ALA 35 HB1 ALA 35 -17.189 6.263 6.912 247 HB2 ALA 35 HB2 ALA 35 -18.123 4.767 7.006 248 HB3 ALA 35 HB3 ALA 35 -18.451 6.087 8.133 249 HA PRO 36 HA PRO 36 -18.800 10.399 4.814 250 HB2 PRO 36 HB2 PRO 36 -18.541 12.060 6.948 251 HB3 PRO 36 HB3 PRO 36 -20.119 11.486 6.377 252 HG2 PRO 36 HG2 PRO 36 -18.455 10.489 8.646 253 HG3 PRO 36 HG3 PRO 36 -20.201 10.792 8.577 254 HD2 PRO 36 HD2 PRO 36 -19.151 8.292 8.326 255 HD3 PRO 36 HD3 PRO 36 -20.647 8.785 7.502 256 HA PRO 37 HA PRO 37 -14.336 10.558 5.000 257 HB2 PRO 37 HB2 PRO 37 -13.773 13.093 4.171 258 HB3 PRO 37 HB3 PRO 37 -14.368 11.834 3.071 259 HG2 PRO 37 HG2 PRO 37 -15.871 14.039 4.411 260 HG3 PRO 37 HG3 PRO 37 -15.969 13.463 2.736 261 HD2 PRO 37 HD2 PRO 37 -17.796 12.740 4.613 262 HD3 PRO 37 HD3 PRO 37 -17.317 11.653 3.290 263 HA PRO 38 HA PRO 38 -13.266 12.317 8.973 264 HB2 PRO 38 HB2 PRO 38 -10.551 12.471 8.836 265 HB3 PRO 38 HB3 PRO 38 -11.417 10.929 8.983 266 HG2 PRO 38 HG2 PRO 38 -10.278 12.232 6.550 267 HG3 PRO 38 HG3 PRO 38 -10.196 10.535 7.063 268 HD2 PRO 38 HD2 PRO 38 -11.968 11.394 5.187 269 HD3 PRO 38 HD3 PRO 38 -12.337 10.060 6.302 270 HA PRO 39 HA PRO 39 -12.872 16.740 8.388 271 HB2 PRO 39 HB2 PRO 39 -12.019 17.581 10.830 272 HB3 PRO 39 HB3 PRO 39 -13.668 16.993 10.548 273 HG2 PRO 39 HG2 PRO 39 -11.319 15.552 11.699 274 HG3 PRO 39 HG3 PRO 39 -13.006 15.577 12.249 275 HD2 PRO 39 HD2 PRO 39 -12.001 13.519 10.788 276 HD3 PRO 39 HD3 PRO 39 -13.696 14.039 10.652 277 HA PRO 40 HA PRO 40 -8.605 17.576 7.349 278 HB2 PRO 40 HB2 PRO 40 -8.452 20.298 7.477 279 HB3 PRO 40 HB3 PRO 40 -9.308 19.439 6.181 280 HG2 PRO 40 HG2 PRO 40 -10.404 20.723 8.641 281 HG3 PRO 40 HG3 PRO 40 -11.008 20.784 6.976 282 HD2 PRO 40 HD2 PRO 40 -12.102 19.137 8.833 283 HD3 PRO 40 HD3 PRO 40 -12.012 18.692 7.114 284 H GLU 41 H GLU 41 -6.591 17.906 8.285 285 HA GLU 41 HA GLU 41 -6.545 18.820 11.099 286 HB2 GLU 41 HB2 GLU 41 -6.377 16.342 10.911 287 HB3 GLU 41 HB3 GLU 41 -4.936 16.543 9.915 288 HG2 GLU 41 HG2 GLU 41 -3.815 17.727 11.770 289 HG3 GLU 41 HG3 GLU 41 -5.253 17.530 12.767 290 HA PRO 42 HA PRO 42 -3.467 21.423 8.843 291 HB2 PRO 42 HB2 PRO 42 -3.234 23.381 10.727 292 HB3 PRO 42 HB3 PRO 42 -4.566 23.329 9.556 293 HG2 PRO 42 HG2 PRO 42 -4.514 22.431 12.403 294 HG3 PRO 42 HG3 PRO 42 -5.755 23.355 11.536 295 HD2 PRO 42 HD2 PRO 42 -6.013 20.694 11.985 296 HD3 PRO 42 HD3 PRO 42 -6.644 21.467 10.512 297 H GLU 43 H GLU 43 -1.225 21.743 9.114 298 HA GLU 43 HA GLU 43 -0.032 20.638 11.582 299 HB2 GLU 43 HB2 GLU 43 0.843 20.055 8.739 300 HB3 GLU 43 HB3 GLU 43 1.708 19.549 10.192 301 HG2 GLU 43 HG2 GLU 43 -0.254 18.254 10.921 302 HG3 GLU 43 HG3 GLU 43 -1.140 18.776 9.492 303 HA PRO 44 HA PRO 44 1.653 24.936 10.523 304 HB2 PRO 44 HB2 PRO 44 1.592 25.091 13.502 305 HB3 PRO 44 HB3 PRO 44 1.087 26.294 12.299 306 HG2 PRO 44 HG2 PRO 44 -0.716 24.946 13.676 307 HG3 PRO 44 HG3 PRO 44 -0.960 25.275 11.950 308 HD2 PRO 44 HD2 PRO 44 -0.074 22.718 13.266 309 HD3 PRO 44 HD3 PRO 44 -1.214 22.954 11.921 310 H GLU 45 H GLU 45 3.822 25.521 10.633 311 HA GLU 45 HA GLU 45 5.603 23.849 12.297 312 HB2 GLU 45 HB2 GLU 45 5.554 23.082 9.900 313 HB3 GLU 45 HB3 GLU 45 6.185 24.663 9.438 314 HG2 GLU 45 HG2 GLU 45 8.159 24.302 10.870 315 HG3 GLU 45 HG3 GLU 45 7.528 22.727 11.349 316 HA PRO 46 HA PRO 46 6.540 28.408 12.819 317 HB2 PRO 46 HB2 PRO 46 6.573 28.483 15.526 318 HB3 PRO 46 HB3 PRO 46 5.065 28.601 14.596 319 HG2 PRO 46 HG2 PRO 46 6.251 26.236 15.978 320 HG3 PRO 46 HG3 PRO 46 4.570 26.803 15.957 321 HD2 PRO 46 HD2 PRO 46 5.447 24.765 14.367 322 HD3 PRO 46 HD3 PRO 46 4.131 25.859 13.886 323 H VAL 47 H VAL 47 8.519 29.375 13.471 324 HA VAL 47 HA VAL 47 10.614 27.538 14.453 325 HB VAL 47 HB VAL 47 12.222 28.573 12.874 326 HG11 VAL 47 HG11 VAL 47 11.300 27.483 10.812 327 HG12 VAL 47 HG12 VAL 47 9.760 27.293 11.655 328 HG13 VAL 47 HG13 VAL 47 11.199 26.464 12.250 329 HG21 VAL 47 HG21 VAL 47 10.996 30.715 12.531 330 HG22 VAL 47 HG22 VAL 47 9.745 29.839 11.648 331 HG23 VAL 47 HG23 VAL 47 11.385 29.928 11.000 332 H SER 48 H SER 48 12.379 28.561 15.541 333 HA SER 48 HA SER 48 12.472 31.360 16.062 334 HB2 SER 48 HB2 SER 48 10.466 30.923 17.377 335 HB3 SER 48 HB3 SER 48 11.282 29.614 18.229 336 HG SER 48 HG SER 48 12.033 32.357 18.212 337 H PHE 49 H PHE 49 13.092 28.206 17.599 338 HA PHE 49 HA PHE 49 15.474 28.996 18.916 339 HB2 PHE 49 HB2 PHE 49 15.846 26.593 19.270 340 HB3 PHE 49 HB3 PHE 49 14.175 27.033 19.617 341 HD1 PHE 49 HD1 PHE 49 16.426 25.259 17.301 342 HD2 PHE 49 HD2 PHE 49 12.352 26.335 18.133 343 HE1 PHE 49 HE1 PHE 49 15.645 23.586 15.646 344 HE2 PHE 49 HE2 PHE 49 11.571 24.661 16.477 345 HZ PHE 49 HZ PHE 49 13.219 23.287 15.233 346 H ASP 50 H ASP 50 14.854 27.614 15.730 347 HA ASP 50 HA ASP 50 17.708 27.395 15.146 348 HB2 ASP 50 HB2 ASP 50 17.009 26.402 13.047 349 HB3 ASP 50 HB3 ASP 50 16.127 25.651 14.369 350 H ASP 51 H ASP 51 18.259 28.180 12.794 351 HA ASP 51 HA ASP 51 18.832 30.013 11.535 352 HB2 ASP 51 HB2 ASP 51 16.409 29.515 10.870 353 HB3 ASP 51 HB3 ASP 51 15.963 30.876 11.894 354 H GLU 52 H GLU 52 19.381 30.273 14.293 355 HA GLU 52 HA GLU 52 19.804 33.076 14.495 356 HB2 GLU 52 HB2 GLU 52 17.335 32.841 15.124 357 HB3 GLU 52 HB3 GLU 52 17.883 31.972 16.555 358 HG2 GLU 52 HG2 GLU 52 17.585 34.319 17.128 359 HG3 GLU 52 HG3 GLU 52 19.300 33.937 17.161 360 H VAL 53 H VAL 53 21.507 30.977 14.479 361 HA VAL 53 HA VAL 53 22.304 30.567 17.289 362 HB VAL 53 HB VAL 53 23.122 29.029 14.802 363 HG11 VAL 53 HG11 VAL 53 23.699 28.450 17.726 364 HG12 VAL 53 HG12 VAL 53 24.875 29.093 16.580 365 HG13 VAL 53 HG13 VAL 53 24.209 27.476 16.347 366 HG21 VAL 53 HG21 VAL 53 21.813 27.188 15.909 367 HG22 VAL 53 HG22 VAL 53 20.815 28.549 15.394 368 HG23 VAL 53 HG23 VAL 53 21.247 28.366 17.093 369 H LEU 54 H LEU 54 23.888 31.827 17.998 370 HA LEU 54 HA LEU 54 25.925 32.809 16.083 371 HB2 LEU 54 HB2 LEU 54 24.744 34.247 18.474 372 HB3 LEU 54 HB3 LEU 54 26.082 34.845 17.497 373 HG LEU 54 HG LEU 54 23.356 34.169 16.345 374 HD11 LEU 54 HD11 LEU 54 24.464 36.903 17.046 375 HD12 LEU 54 HD12 LEU 54 23.294 36.036 18.040 376 HD13 LEU 54 HD13 LEU 54 22.861 36.540 16.406 377 HD21 LEU 54 HD21 LEU 54 24.228 35.709 14.513 378 HD22 LEU 54 HD22 LEU 54 25.082 34.171 14.653 379 HD23 LEU 54 HD23 LEU 54 25.799 35.645 15.308 380 H GLU 55 H GLU 55 28.050 32.867 16.774 381 HA GLU 55 HA GLU 55 29.926 32.253 17.937 382 HB2 GLU 55 HB2 GLU 55 28.817 33.644 19.753 383 HB3 GLU 55 HB3 GLU 55 28.198 32.131 20.416 384 HG2 GLU 55 HG2 GLU 55 30.506 31.268 20.600 385 HG3 GLU 55 HG3 GLU 55 31.124 32.783 19.948 386 H LEU 56 H LEU 56 30.419 30.309 17.151 387 HA LEU 56 HA LEU 56 29.127 27.926 18.329 388 HB2 LEU 56 HB2 LEU 56 30.544 28.301 15.684 389 HB3 LEU 56 HB3 LEU 56 29.962 26.750 16.287 390 HG LEU 56 HG LEU 56 28.168 29.170 15.924 391 HD11 LEU 56 HD11 LEU 56 28.743 26.846 14.062 392 HD12 LEU 56 HD12 LEU 56 29.017 28.558 13.737 393 HD13 LEU 56 HD13 LEU 56 27.371 27.940 13.876 394 HD21 LEU 56 HD21 LEU 56 27.678 26.211 16.401 395 HD22 LEU 56 HD22 LEU 56 26.410 27.336 15.914 396 HD23 LEU 56 HD23 LEU 56 27.234 27.551 17.459 397 H THR 57 H THR 57 30.412 26.175 18.961 398 HA THR 57 HA THR 57 32.839 26.839 20.262 399 HB THR 57 HB THR 57 31.392 25.051 21.091 400 HG1 THR 57 HG1 THR 57 33.906 24.105 20.190 401 HG21 THR 57 HG21 THR 57 32.262 23.420 18.692 402 HG22 THR 57 HG22 THR 57 30.709 24.247 18.780 403 HG23 THR 57 HG23 THR 57 31.093 22.967 19.930 404 H ASP 58 H ASP 58 32.142 25.368 17.144 405 HA ASP 58 HA ASP 58 34.890 24.653 16.615 406 HB2 ASP 58 HB2 ASP 58 32.452 24.725 14.819 407 HB3 ASP 58 HB3 ASP 58 34.023 24.088 14.352 408 HA PRO 59 HA PRO 59 36.135 28.576 14.954 409 HB2 PRO 59 HB2 PRO 59 37.923 27.872 13.005 410 HB3 PRO 59 HB3 PRO 59 38.285 27.782 14.741 411 HG2 PRO 59 HG2 PRO 59 37.453 25.616 12.865 412 HG3 PRO 59 HG3 PRO 59 38.690 25.594 14.134 413 HD2 PRO 59 HD2 PRO 59 36.231 24.504 14.508 414 HD3 PRO 59 HD3 PRO 59 37.142 25.262 15.833 415 H ILE 60 H ILE 60 34.702 26.200 12.890 416 HA ILE 60 HA ILE 60 34.132 28.227 10.817 417 HB ILE 60 HB ILE 60 35.329 26.214 10.022 418 HG12 ILE 60 HG12 ILE 60 32.476 26.102 9.015 419 HG13 ILE 60 HG13 ILE 60 33.537 27.462 8.650 420 HG21 ILE 60 HG21 ILE 60 34.140 24.028 10.015 421 HG22 ILE 60 HG22 ILE 60 32.869 24.735 11.012 422 HG23 ILE 60 HG23 ILE 60 34.507 24.583 11.650 423 HD11 ILE 60 HD11 ILE 60 33.671 25.853 6.827 424 HD12 ILE 60 HD12 ILE 60 34.034 24.550 7.958 425 HD13 ILE 60 HD13 ILE 60 35.202 25.847 7.703 426 H ALA 61 H ALA 61 31.985 28.388 9.997 427 HA ALA 61 HA ALA 61 29.897 27.300 11.789 428 HB1 ALA 61 HB1 ALA 61 28.732 29.381 11.749 429 HB2 ALA 61 HB2 ALA 61 29.774 30.020 10.480 430 HB3 ALA 61 HB3 ALA 61 30.414 29.774 12.104 431 HA PRO 62 HA PRO 62 28.878 26.080 7.419 432 HB2 PRO 62 HB2 PRO 62 27.904 23.606 7.980 433 HB3 PRO 62 HB3 PRO 62 29.642 23.925 7.802 434 HG2 PRO 62 HG2 PRO 62 28.014 23.669 10.291 435 HG3 PRO 62 HG3 PRO 62 29.611 22.994 9.914 436 HD2 PRO 62 HD2 PRO 62 29.300 25.244 11.418 437 HD3 PRO 62 HD3 PRO 62 30.711 24.984 10.369 438 H GLU 63 H GLU 63 26.785 25.707 6.423 439 HA GLU 63 HA GLU 63 24.477 26.189 8.204 440 HB2 GLU 63 HB2 GLU 63 23.499 27.670 6.503 441 HB3 GLU 63 HB3 GLU 63 25.042 28.294 7.076 442 HG2 GLU 63 HG2 GLU 63 24.789 26.615 4.567 443 HG3 GLU 63 HG3 GLU 63 24.669 28.370 4.547 444 HA PRO 64 HA PRO 64 22.449 22.750 6.280 445 HB2 PRO 64 HB2 PRO 64 20.046 24.463 5.832 446 HB3 PRO 64 HB3 PRO 64 20.187 22.918 6.691 447 HG2 PRO 64 HG2 PRO 64 19.888 25.165 8.038 448 HG3 PRO 64 HG3 PRO 64 21.009 23.914 8.612 449 HD2 PRO 64 HD2 PRO 64 21.635 26.484 7.179 450 HD3 PRO 64 HD3 PRO 64 22.476 25.724 8.551 451 H GLU 65 H GLU 65 22.178 21.867 4.272 452 HA GLU 65 HA GLU 65 21.930 23.680 1.954 453 HB2 GLU 65 HB2 GLU 65 23.583 22.291 0.736 454 HB3 GLU 65 HB3 GLU 65 24.291 23.080 2.141 455 HG2 GLU 65 HG2 GLU 65 24.039 20.999 3.444 456 HG3 GLU 65 HG3 GLU 65 23.317 20.207 2.048 457 H LEU 66 H LEU 66 21.296 22.480 -0.057 458 HA LEU 66 HA LEU 66 19.672 21.264 -1.139 459 HB2 LEU 66 HB2 LEU 66 20.705 19.127 0.752 460 HB3 LEU 66 HB3 LEU 66 19.705 18.823 -0.666 461 HG LEU 66 HG LEU 66 22.373 20.256 -0.813 462 HD11 LEU 66 HD11 LEU 66 23.323 18.123 -1.555 463 HD12 LEU 66 HD12 LEU 66 21.760 17.332 -1.350 464 HD13 LEU 66 HD13 LEU 66 22.636 17.935 0.057 465 HD21 LEU 66 HD21 LEU 66 22.176 19.505 -3.222 466 HD22 LEU 66 HD22 LEU 66 20.950 20.676 -2.734 467 HD23 LEU 66 HD23 LEU 66 20.535 18.968 -2.858 468 HA PRO 67 HA PRO 67 16.767 22.061 2.554 469 HB2 PRO 67 HB2 PRO 67 15.363 23.577 0.396 470 HB3 PRO 67 HB3 PRO 67 15.641 24.022 2.092 471 HG2 PRO 67 HG2 PRO 67 17.036 25.169 0.173 472 HG3 PRO 67 HG3 PRO 67 17.815 24.698 1.694 473 HD2 PRO 67 HD2 PRO 67 17.921 23.324 -0.979 474 HD3 PRO 67 HD3 PRO 67 19.220 23.577 0.209 475 HA PRO 68 HA PRO 68 14.045 18.797 1.100 476 HB2 PRO 68 HB2 PRO 68 11.967 18.994 2.848 477 HB3 PRO 68 HB3 PRO 68 13.554 18.350 3.313 478 HG2 PRO 68 HG2 PRO 68 12.423 21.079 3.742 479 HG3 PRO 68 HG3 PRO 68 13.328 20.045 4.864 480 HD2 PRO 68 HD2 PRO 68 14.510 22.088 3.514 481 HD3 PRO 68 HD3 PRO 68 15.385 20.597 3.931 482 H LEU 69 H LEU 69 11.926 18.411 0.140 483 HA LEU 69 HA LEU 69 11.037 20.606 -1.479 484 HB2 LEU 69 HB2 LEU 69 10.399 17.700 -1.225 485 HB3 LEU 69 HB3 LEU 69 9.152 18.716 -1.928 486 HG LEU 69 HG LEU 69 10.602 17.725 -3.666 487 HD11 LEU 69 HD11 LEU 69 9.595 20.081 -3.856 488 HD12 LEU 69 HD12 LEU 69 10.893 19.667 -4.974 489 HD13 LEU 69 HD13 LEU 69 11.229 20.673 -3.566 490 HD21 LEU 69 HD21 LEU 69 12.678 17.719 -2.156 491 HD22 LEU 69 HD22 LEU 69 12.877 19.412 -2.606 492 HD23 LEU 69 HD23 LEU 69 12.937 18.158 -3.844 493 H GLU 70 H GLU 70 9.074 21.694 -1.426 494 HA GLU 70 HA GLU 70 7.924 22.148 1.149 495 HB2 GLU 70 HB2 GLU 70 7.116 23.018 -1.632 496 HB3 GLU 70 HB3 GLU 70 6.263 23.526 -0.173 497 HG2 GLU 70 HG2 GLU 70 7.802 25.272 -0.524 498 HG3 GLU 70 HG3 GLU 70 8.602 24.273 0.682 499 H THR 71 H THR 71 6.961 20.355 -1.716 500 HA THR 71 HA THR 71 5.060 18.798 -0.145 501 HB THR 71 HB THR 71 3.691 20.677 -0.923 502 HG1 THR 71 HG1 THR 71 3.177 18.327 -2.415 503 HG21 THR 71 HG21 THR 71 3.348 21.127 -3.283 504 HG22 THR 71 HG22 THR 71 4.399 19.782 -3.733 505 HG23 THR 71 HG23 THR 71 5.078 21.206 -2.948 506 H VAL 72 H VAL 72 4.249 16.919 -1.283 507 HA VAL 72 HA VAL 72 5.932 16.081 -3.568 508 HB VAL 72 HB VAL 72 6.008 13.797 -2.602 509 HG11 VAL 72 HG11 VAL 72 7.036 15.832 -0.611 510 HG12 VAL 72 HG12 VAL 72 7.787 15.564 -2.183 511 HG13 VAL 72 HG13 VAL 72 7.730 14.257 -0.999 512 HG21 VAL 72 HG21 VAL 72 5.321 13.397 -0.301 513 HG22 VAL 72 HG22 VAL 72 3.942 14.048 -1.184 514 HG23 VAL 72 HG23 VAL 72 4.867 15.088 -0.101 515 H GLY 73 H GLY 73 4.971 14.387 -4.897 516 HA2 GLY 73 HA2 GLY 73 2.272 14.923 -5.550 517 HA3 GLY 73 HA3 GLY 73 3.233 13.591 -6.182 518 H ASP 74 H ASP 74 0.457 14.200 -4.688 519 HA ASP 74 HA ASP 74 0.084 11.512 -3.770 520 HB2 ASP 74 HB2 ASP 74 1.319 12.893 -1.871 521 HB3 ASP 74 HB3 ASP 74 -0.303 13.512 -1.577 522 H ILE 75 H ILE 75 -2.144 11.127 -3.130 523 HA ILE 75 HA ILE 75 -4.010 12.620 -4.661 524 HB ILE 75 HB ILE 75 -4.424 10.513 -2.505 525 HG12 ILE 75 HG12 ILE 75 -4.662 10.252 -5.516 526 HG13 ILE 75 HG13 ILE 75 -3.159 9.919 -4.657 527 HG21 ILE 75 HG21 ILE 75 -6.690 10.269 -3.669 528 HG22 ILE 75 HG22 ILE 75 -6.356 11.810 -4.459 529 HG23 ILE 75 HG23 ILE 75 -6.495 11.731 -2.703 530 HD11 ILE 75 HD11 ILE 75 -4.395 7.830 -4.962 531 HD12 ILE 75 HD12 ILE 75 -5.823 8.539 -4.215 532 HD13 ILE 75 HD13 ILE 75 -4.375 8.251 -3.250 533 H ASP 76 H ASP 76 -3.260 12.394 -1.208 534 HA ASP 76 HA ASP 76 -4.390 15.034 -0.780 535 HB2 ASP 76 HB2 ASP 76 -6.135 13.111 -0.387 536 HB3 ASP 76 HB3 ASP 76 -5.237 12.869 1.111 537 H VAL 77 H VAL 77 -4.132 15.485 1.764 538 HA VAL 77 HA VAL 77 -1.363 15.550 2.282 539 HB VAL 77 HB VAL 77 -3.752 15.972 4.108 540 HG11 VAL 77 HG11 VAL 77 -1.822 15.471 5.510 541 HG12 VAL 77 HG12 VAL 77 -2.138 17.206 5.574 542 HG13 VAL 77 HG13 VAL 77 -0.816 16.587 4.582 543 HG21 VAL 77 HG21 VAL 77 -1.888 17.997 2.846 544 HG22 VAL 77 HG22 VAL 77 -3.417 18.307 3.666 545 HG23 VAL 77 HG23 VAL 77 -3.406 17.492 2.103 546 H TYR 78 H TYR 78 -3.954 13.430 3.474 547 HA TYR 78 HA TYR 78 -3.915 11.506 4.754 548 HB2 TYR 78 HB2 TYR 78 -3.038 10.826 2.482 549 HB3 TYR 78 HB3 TYR 78 -1.411 10.945 3.151 550 HD1 TYR 78 HD1 TYR 78 -4.663 9.174 3.424 551 HD2 TYR 78 HD2 TYR 78 -0.546 9.274 4.648 552 HE1 TYR 78 HE1 TYR 78 -4.893 6.900 4.387 553 HE2 TYR 78 HE2 TYR 78 -0.776 6.999 5.610 554 HH TYR 78 HH TYR 78 -2.264 4.997 5.254 555 H SER 79 H SER 79 -3.500 12.297 6.825 556 HA SER 79 HA SER 79 -0.929 12.973 7.798 557 HB2 SER 79 HB2 SER 79 -3.010 13.737 8.863 558 HB3 SER 79 HB3 SER 79 -3.384 12.078 9.319 559 HG SER 79 HG SER 79 -1.189 13.676 10.146 560 HA PRO 80 HA PRO 80 0.418 8.638 8.207 561 HB2 PRO 80 HB2 PRO 80 2.914 9.052 9.187 562 HB3 PRO 80 HB3 PRO 80 2.506 9.333 7.481 563 HG2 PRO 80 HG2 PRO 80 2.749 11.299 9.713 564 HG3 PRO 80 HG3 PRO 80 3.355 11.403 8.050 565 HD2 PRO 80 HD2 PRO 80 1.061 12.643 8.848 566 HD3 PRO 80 HD3 PRO 80 1.296 12.036 7.192 567 HA PRO 81 HA PRO 81 -0.443 7.573 12.461 568 HB2 PRO 81 HB2 PRO 81 1.940 5.770 12.452 569 HB3 PRO 81 HB3 PRO 81 0.248 5.399 12.836 570 HG2 PRO 81 HG2 PRO 81 1.298 4.608 10.550 571 HG3 PRO 81 HG3 PRO 81 -0.358 5.242 10.608 572 HD2 PRO 81 HD2 PRO 81 2.150 6.611 9.668 573 HD3 PRO 81 HD3 PRO 81 0.513 6.660 8.972 574 H GLU 82 H GLU 82 0.185 8.136 14.577 575 HA GLU 82 HA GLU 82 1.244 9.453 16.121 576 HB2 GLU 82 HB2 GLU 82 3.598 7.895 15.015 577 HB3 GLU 82 HB3 GLU 82 3.609 8.797 16.529 578 HG2 GLU 82 HG2 GLU 82 1.772 7.401 17.390 579 HG3 GLU 82 HG3 GLU 82 1.730 6.509 15.870 580 HA PRO 83 HA PRO 83 3.035 12.405 12.852 581 HB2 PRO 83 HB2 PRO 83 1.016 14.224 12.694 582 HB3 PRO 83 HB3 PRO 83 1.082 12.776 11.671 583 HG2 PRO 83 HG2 PRO 83 -0.520 13.286 14.124 584 HG3 PRO 83 HG3 PRO 83 -0.977 12.450 12.629 585 HD2 PRO 83 HD2 PRO 83 -0.261 11.137 14.936 586 HD3 PRO 83 HD3 PRO 83 -0.056 10.447 13.313 587 H GLU 84 H GLU 84 0.926 13.247 15.573 588 HA GLU 84 HA GLU 84 1.154 14.645 17.375 589 HB2 GLU 84 HB2 GLU 84 3.286 13.199 17.557 590 HB3 GLU 84 HB3 GLU 84 4.134 14.607 16.924 591 HG2 GLU 84 HG2 GLU 84 3.294 15.978 18.772 592 HG3 GLU 84 HG3 GLU 84 2.362 14.613 19.385 593 H SER 85 H SER 85 1.285 16.824 17.883 594 HA SER 85 HA SER 85 1.263 18.670 15.742 595 HB2 SER 85 HB2 SER 85 1.129 20.392 17.476 596 HB3 SER 85 HB3 SER 85 0.073 19.040 17.873 597 HG SER 85 HG SER 85 1.249 19.537 19.691 598 H GLU 86 H GLU 86 3.780 17.651 17.950 599 HA GLU 86 HA GLU 86 5.744 19.235 16.410 600 HB2 GLU 86 HB2 GLU 86 5.280 20.272 18.653 601 HB3 GLU 86 HB3 GLU 86 5.862 18.789 19.405 602 HG2 GLU 86 HG2 GLU 86 8.041 19.070 18.270 603 HG3 GLU 86 HG3 GLU 86 7.460 20.562 17.533 604 HA PRO 87 HA PRO 87 6.916 14.729 16.476 605 HB2 PRO 87 HB2 PRO 87 7.842 14.589 13.920 606 HB3 PRO 87 HB3 PRO 87 6.121 14.428 14.328 607 HG2 PRO 87 HG2 PRO 87 7.609 16.808 13.311 608 HG3 PRO 87 HG3 PRO 87 6.024 16.177 12.826 609 HD2 PRO 87 HD2 PRO 87 6.287 18.287 14.525 610 HD3 PRO 87 HD3 PRO 87 4.933 17.139 14.636 611 H ALA 88 H ALA 88 8.963 13.786 16.636 612 HA ALA 88 HA ALA 88 11.307 15.534 16.230 613 HB1 ALA 88 HB1 ALA 88 10.678 13.902 18.702 614 HB2 ALA 88 HB2 ALA 88 10.807 15.657 18.598 615 HB3 ALA 88 HB3 ALA 88 12.240 14.655 18.375 616 H TYR 89 H TYR 89 10.000 12.282 16.632 617 HA TYR 89 HA TYR 89 12.292 11.211 15.100 618 HB2 TYR 89 HB2 TYR 89 10.897 9.895 17.447 619 HB3 TYR 89 HB3 TYR 89 12.114 9.126 16.432 620 HD1 TYR 89 HD1 TYR 89 11.495 11.616 19.055 621 HD2 TYR 89 HD2 TYR 89 14.462 9.878 16.481 622 HE1 TYR 89 HE1 TYR 89 13.288 12.626 20.441 623 HE2 TYR 89 HE2 TYR 89 16.254 10.887 17.866 624 HH TYR 89 HH TYR 89 16.106 13.236 19.639 625 H THR 90 H THR 90 11.818 9.518 13.670 626 HA THR 90 HA THR 90 9.024 8.694 13.351 627 HB THR 90 HB THR 90 9.034 9.251 10.942 628 HG1 THR 90 HG1 THR 90 10.701 10.681 10.239 629 HG21 THR 90 HG21 THR 90 8.134 10.833 12.699 630 HG22 THR 90 HG22 THR 90 8.621 11.607 11.191 631 HG23 THR 90 HG23 THR 90 9.668 11.697 12.608 632 HA PRO 91 HA PRO 91 10.993 4.866 12.224 633 HB2 PRO 91 HB2 PRO 91 9.163 3.676 10.604 634 HB3 PRO 91 HB3 PRO 91 8.902 3.880 12.349 635 HG2 PRO 91 HG2 PRO 91 7.863 5.514 10.079 636 HG3 PRO 91 HG3 PRO 91 7.020 4.932 11.527 637 HD2 PRO 91 HD2 PRO 91 7.960 7.481 11.312 638 HD3 PRO 91 HD3 PRO 91 7.866 6.625 12.868 639 HA PRO 92 HA PRO 92 13.066 5.490 8.311 640 HB2 PRO 92 HB2 PRO 92 13.977 2.998 7.705 641 HB3 PRO 92 HB3 PRO 92 14.669 3.981 9.012 642 HG2 PRO 92 HG2 PRO 92 12.675 1.761 9.165 643 HG3 PRO 92 HG3 PRO 92 14.090 2.077 10.184 644 HD2 PRO 92 HD2 PRO 92 11.576 2.741 10.971 645 HD3 PRO 92 HD3 PRO 92 12.999 3.694 11.445 646 HA PRO 93 HA PRO 93 10.124 4.675 5.027 647 HB2 PRO 93 HB2 PRO 93 12.454 4.313 3.195 648 HB3 PRO 93 HB3 PRO 93 11.067 5.413 3.056 649 HG2 PRO 93 HG2 PRO 93 13.436 6.346 3.727 650 HG3 PRO 93 HG3 PRO 93 11.973 6.950 4.529 651 HD2 PRO 93 HD2 PRO 93 14.002 4.980 5.557 652 HD3 PRO 93 HD3 PRO 93 13.187 6.313 6.413 653 H ALA 94 H ALA 94 9.112 2.933 4.140 654 HA ALA 94 HA ALA 94 10.477 0.537 3.334 655 HB1 ALA 94 HB1 ALA 94 8.901 0.578 5.913 656 HB2 ALA 94 HB2 ALA 94 10.540 -0.023 5.647 657 HB3 ALA 94 HB3 ALA 94 9.159 -0.902 4.990 658 H ALA 95 H ALA 95 9.436 0.019 1.580 659 HA ALA 95 HA ALA 95 6.582 0.652 1.331 660 HB1 ALA 95 HB1 ALA 95 8.054 -0.272 -1.046 661 HB2 ALA 95 HB2 ALA 95 8.693 1.197 -0.302 662 HB3 ALA 95 HB3 ALA 95 7.008 1.136 -0.831 663 HA PRO 96 HA PRO 96 5.967 -3.873 1.874 664 HB2 PRO 96 HB2 PRO 96 3.155 -3.154 1.198 665 HB3 PRO 96 HB3 PRO 96 3.786 -4.075 2.579 666 HG2 PRO 96 HG2 PRO 96 2.896 -1.602 2.891 667 HG3 PRO 96 HG3 PRO 96 4.329 -2.176 3.769 668 HD2 PRO 96 HD2 PRO 96 4.192 -0.409 1.339 669 HD3 PRO 96 HD3 PRO 96 5.260 -0.293 2.758 670 H VAL 97 H VAL 97 5.156 -5.630 0.463 671 HA VAL 97 HA VAL 97 5.971 -5.370 -2.207 672 HB VAL 97 HB VAL 97 4.097 -7.424 -0.981 673 HG11 VAL 97 HG11 VAL 97 5.678 -7.430 -3.571 674 HG12 VAL 97 HG12 VAL 97 3.925 -7.534 -3.396 675 HG13 VAL 97 HG13 VAL 97 4.947 -8.871 -2.865 676 HG21 VAL 97 HG21 VAL 97 6.300 -7.282 0.134 677 HG22 VAL 97 HG22 VAL 97 7.100 -7.464 -1.428 678 HG23 VAL 97 HG23 VAL 97 6.142 -8.790 -0.769 679 H PHE 98 H PHE 98 4.987 -4.701 -4.010 680 HA PHE 98 HA PHE 98 2.458 -3.361 -3.840 681 HB2 PHE 98 HB2 PHE 98 2.820 -2.829 -6.222 682 HB3 PHE 98 HB3 PHE 98 4.245 -2.463 -5.251 683 HD1 PHE 98 HD1 PHE 98 2.795 -4.737 -7.766 684 HD2 PHE 98 HD2 PHE 98 6.296 -3.781 -5.466 685 HE1 PHE 98 HE1 PHE 98 4.155 -6.213 -9.223 686 HE2 PHE 98 HE2 PHE 98 7.655 -5.261 -6.922 687 HZ PHE 98 HZ PHE 98 6.583 -6.476 -8.800 688 H ASP 99 H ASP 99 0.604 -3.759 -5.105 689 HA ASP 99 HA ASP 99 0.197 -6.130 -6.622 690 HB2 ASP 99 HB2 ASP 99 0.201 -6.764 -4.012 691 HB3 ASP 99 HB3 ASP 99 -1.469 -6.227 -4.155 692 H ARG 100 H ARG 100 -2.212 -6.353 -7.168 693 HA ARG 100 HA ARG 100 -3.221 -4.005 -8.206 694 HB2 ARG 100 HB2 ARG 100 -3.972 -6.298 -8.816 695 HB3 ARG 100 HB3 ARG 100 -4.840 -6.400 -7.286 696 HG2 ARG 100 HG2 ARG 100 -6.235 -4.480 -7.927 697 HG3 ARG 100 HG3 ARG 100 -5.342 -4.323 -9.438 698 HD2 ARG 100 HD2 ARG 100 -6.897 -6.786 -8.611 699 HD3 ARG 100 HD3 ARG 100 -7.498 -5.552 -9.713 700 HE ARG 100 HE ARG 100 -5.049 -6.378 -10.737 701 HH11 ARG 100 HH11 ARG 100 -8.151 -7.856 -10.038 702 HH12 ARG 100 HH12 ARG 100 -7.995 -9.044 -11.289 703 HH21 ARG 100 HH21 ARG 100 -4.888 -7.942 -12.346 704 HH22 ARG 100 HH22 ARG 100 -6.163 -9.090 -12.584 705 H ASP 101 H ASP 101 -4.587 -5.651 -5.325 706 HA ASP 101 HA ASP 101 -5.709 -4.873 -3.494 707 HB2 ASP 101 HB2 ASP 101 -3.429 -3.493 -3.513 708 HB3 ASP 101 HB3 ASP 101 -4.536 -2.147 -3.771 709 H GLU 102 H GLU 102 -7.625 -3.895 -2.959 710 HA GLU 102 HA GLU 102 -8.728 -1.865 -4.783 711 HB2 GLU 102 HB2 GLU 102 -10.005 -4.522 -4.112 712 HB3 GLU 102 HB3 GLU 102 -10.911 -3.154 -4.761 713 HG2 GLU 102 HG2 GLU 102 -9.555 -3.116 -6.760 714 HG3 GLU 102 HG3 GLU 102 -8.452 -4.314 -6.098 715 H VAL 103 H VAL 103 -9.542 -3.859 -1.960 716 HA VAL 103 HA VAL 103 -11.352 -2.163 -0.715 717 HB VAL 103 HB VAL 103 -10.733 -3.272 1.417 718 HG11 VAL 103 HG11 VAL 103 -10.948 -5.031 -1.042 719 HG12 VAL 103 HG12 VAL 103 -12.275 -4.410 -0.059 720 HG13 VAL 103 HG13 VAL 103 -11.170 -5.612 0.607 721 HG21 VAL 103 HG21 VAL 103 -8.457 -4.340 -0.278 722 HG22 VAL 103 HG22 VAL 103 -8.978 -5.124 1.214 723 HG23 VAL 103 HG23 VAL 103 -8.346 -3.477 1.257 724 H ALA 104 H ALA 104 -11.217 -0.176 0.031 725 HA ALA 104 HA ALA 104 -10.431 1.795 0.889 726 HB1 ALA 104 HB1 ALA 104 -9.732 0.127 2.736 727 HB2 ALA 104 HB2 ALA 104 -8.954 1.711 2.712 728 HB3 ALA 104 HB3 ALA 104 -8.105 0.301 2.077 729 H GLU 105 H GLU 105 -9.137 3.468 0.276 730 HA GLU 105 HA GLU 105 -7.348 2.988 -1.962 731 HB2 GLU 105 HB2 GLU 105 -9.067 4.920 -1.688 732 HB3 GLU 105 HB3 GLU 105 -7.845 5.664 -0.662 733 HG2 GLU 105 HG2 GLU 105 -6.223 5.186 -2.683 734 HG3 GLU 105 HG3 GLU 105 -7.723 5.055 -3.604 735 H GLN 106 H GLN 106 -6.213 1.735 0.079 736 HA GLN 106 HA GLN 106 -4.042 3.515 1.021 737 HB2 GLN 106 HB2 GLN 106 -5.213 1.048 2.317 738 HB3 GLN 106 HB3 GLN 106 -3.756 1.866 2.879 739 HG2 GLN 106 HG2 GLN 106 -5.042 3.953 3.177 740 HG3 GLN 106 HG3 GLN 106 -6.501 3.128 2.631 741 HE21 GLN 106 HE21 GLN 106 -7.714 3.041 4.569 742 HE22 GLN 106 HE22 GLN 106 -7.157 2.307 5.993 743 H LEU 107 H LEU 107 -4.819 0.750 -0.874 744 HA LEU 107 HA LEU 107 -3.587 -0.948 -1.802 745 HB2 LEU 107 HB2 LEU 107 -3.008 1.301 -2.997 746 HB3 LEU 107 HB3 LEU 107 -1.433 1.114 -2.218 747 HG LEU 107 HG LEU 107 -2.694 -1.123 -3.823 748 HD11 LEU 107 HD11 LEU 107 -2.470 0.940 -5.231 749 HD12 LEU 107 HD12 LEU 107 -1.435 -0.384 -5.766 750 HD13 LEU 107 HD13 LEU 107 -0.748 0.961 -4.854 751 HD21 LEU 107 HD21 LEU 107 0.083 -0.464 -2.816 752 HD22 LEU 107 HD22 LEU 107 -0.186 -1.661 -4.083 753 HD23 LEU 107 HD23 LEU 107 -0.885 -1.901 -2.483 754 H VAL 108 H VAL 108 -3.228 -2.193 0.061 755 HA VAL 108 HA VAL 108 -0.534 -1.959 1.260 756 HB VAL 108 HB VAL 108 -1.428 -3.291 3.144 757 HG11 VAL 108 HG11 VAL 108 -3.013 -1.512 3.988 758 HG12 VAL 108 HG12 VAL 108 -2.932 -0.773 2.387 759 HG13 VAL 108 HG13 VAL 108 -1.478 -0.896 3.376 760 HG21 VAL 108 HG21 VAL 108 -4.029 -3.065 1.594 761 HG22 VAL 108 HG22 VAL 108 -3.929 -3.551 3.286 762 HG23 VAL 108 HG23 VAL 108 -3.184 -4.549 2.037 763 H GLY 109 H GLY 109 -2.385 -3.857 -0.879 764 HA2 GLY 109 HA2 GLY 109 -1.534 -5.624 -2.170 765 HA3 GLY 109 HA3 GLY 109 -0.279 -5.881 -0.965 766 H VAL 110 H VAL 110 -3.853 -6.013 -1.196 767 HA VAL 110 HA VAL 110 -3.855 -8.318 0.640 768 HB VAL 110 HB VAL 110 -6.184 -6.672 -0.415 769 HG11 VAL 110 HG11 VAL 110 -5.984 -8.873 1.661 770 HG12 VAL 110 HG12 VAL 110 -6.970 -8.860 0.198 771 HG13 VAL 110 HG13 VAL 110 -7.370 -7.786 1.540 772 HG21 VAL 110 HG21 VAL 110 -6.227 -5.861 2.005 773 HG22 VAL 110 HG22 VAL 110 -4.883 -5.265 1.028 774 HG23 VAL 110 HG23 VAL 110 -4.622 -6.575 2.180 775 H SER 111 H SER 111 -5.430 -7.307 -2.401 776 HA SER 111 HA SER 111 -6.052 -10.018 -3.166 777 HB2 SER 111 HB2 SER 111 -6.986 -9.034 -5.161 778 HB3 SER 111 HB3 SER 111 -7.447 -8.027 -3.792 779 HG SER 111 HG SER 111 -6.195 -6.469 -4.508 780 H ALA 112 H ALA 112 -5.343 -10.851 -5.352 781 HA ALA 112 HA ALA 112 -2.722 -9.936 -6.249 782 HB1 ALA 112 HB1 ALA 112 -1.779 -11.437 -4.781 783 HB2 ALA 112 HB2 ALA 112 -2.074 -12.515 -6.147 784 HB3 ALA 112 HB3 ALA 112 -3.194 -12.491 -4.785 785 H ALA 113 H ALA 113 -3.000 -9.749 -8.374 786 HA ALA 113 HA ALA 113 -3.768 -12.010 -9.970 787 HB1 ALA 113 HB1 ALA 113 -5.625 -10.541 -11.104 788 HB2 ALA 113 HB2 ALA 113 -5.684 -9.748 -9.530 789 HB3 ALA 113 HB3 ALA 113 -6.007 -11.478 -9.659 790 H SER 114 H SER 114 -3.280 -11.725 -12.176 791 HA SER 114 HA SER 114 -1.227 -9.810 -12.734 792 HB2 SER 114 HB2 SER 114 -1.179 -12.010 -13.781 793 HB3 SER 114 HB3 SER 114 -2.733 -11.706 -14.554 794 HG SER 114 HG SER 114 -1.702 -9.911 -15.609 795 H ALA 115 H ALA 115 -1.312 -7.909 -13.842 796 HA ALA 115 HA ALA 115 -3.666 -7.133 -15.341 797 HB1 ALA 115 HB1 ALA 115 -4.609 -6.326 -13.394 798 HB2 ALA 115 HB2 ALA 115 -3.645 -4.925 -13.859 799 HB3 ALA 115 HB3 ALA 115 -3.046 -6.038 -12.629 800 H ALA 116 H ALA 116 -3.332 -5.077 -16.463 801 HA ALA 116 HA ALA 116 -0.693 -3.909 -16.403 802 HB1 ALA 116 HB1 ALA 116 -1.600 -5.037 -19.043 803 HB2 ALA 116 HB2 ALA 116 -0.635 -6.010 -17.931 804 HB3 ALA 116 HB3 ALA 116 0.010 -4.496 -18.567 805 H ALA 117 H ALA 117 -0.698 -1.848 -17.321 806 HA ALA 117 HA ALA 117 -3.086 -0.978 -18.751 807 HB1 ALA 117 HB1 ALA 117 -2.216 0.130 -16.082 808 HB2 ALA 117 HB2 ALA 117 -3.799 -0.498 -16.537 809 HB3 ALA 117 HB3 ALA 117 -3.238 1.039 -17.195 810 H SER 118 H SER 118 -2.767 0.929 -19.993 811 HA SER 118 HA SER 118 -0.172 2.253 -19.894 812 HB2 SER 118 HB2 SER 118 0.189 0.379 -21.451 813 HB3 SER 118 HB3 SER 118 -1.231 0.865 -22.374 814 HG SER 118 HG SER 118 1.191 1.685 -22.745 815 H ALA 119 H ALA 119 -0.245 4.323 -20.818 816 HA ALA 119 HA ALA 119 -2.826 5.525 -20.810 817 HB1 ALA 119 HB1 ALA 119 -0.087 6.585 -21.527 818 HB2 ALA 119 HB2 ALA 119 -0.994 6.856 -20.038 819 HB3 ALA 119 HB3 ALA 119 -1.540 7.584 -21.549 820 H PHE 120 H PHE 120 -3.977 6.465 -22.495 821 HA PHE 120 HA PHE 120 -3.991 5.070 -24.958 822 HB2 PHE 120 HB2 PHE 120 -5.981 6.182 -23.948 823 HB3 PHE 120 HB3 PHE 120 -5.254 7.751 -24.303 824 HD1 PHE 120 HD1 PHE 120 -6.516 4.606 -25.855 825 HD2 PHE 120 HD2 PHE 120 -5.388 8.703 -26.491 826 HE1 PHE 120 HE1 PHE 120 -7.443 4.506 -28.153 827 HE2 PHE 120 HE2 PHE 120 -6.316 8.601 -28.789 828 HZ PHE 120 HZ PHE 120 -7.344 6.503 -29.619 829 H GLY 121 H GLY 121 -2.964 5.428 -26.831 830 HA2 GLY 121 HA2 GLY 121 -0.757 7.202 -26.994 831 HA3 GLY 121 HA3 GLY 121 -1.437 6.282 -28.332 832 H SER 122 H SER 122 -0.472 9.115 -28.089 833 HA SER 122 HA SER 122 -2.624 10.342 -29.595 834 HB2 SER 122 HB2 SER 122 -2.866 12.286 -28.164 835 HB3 SER 122 HB3 SER 122 -3.225 10.839 -27.228 836 HG SER 122 HG SER 122 -1.778 11.689 -25.940 837 H LEU 123 H LEU 123 -1.965 12.442 -30.505 838 HA LEU 123 HA LEU 123 0.838 13.164 -30.373 839 HB2 LEU 123 HB2 LEU 123 1.259 12.870 -32.781 840 HB3 LEU 123 HB3 LEU 123 0.954 11.329 -31.984 841 HG LEU 123 HG LEU 123 -1.344 12.816 -33.266 842 HD11 LEU 123 HD11 LEU 123 -0.909 11.835 -35.407 843 HD12 LEU 123 HD12 LEU 123 0.424 10.869 -34.769 844 HD13 LEU 123 HD13 LEU 123 0.590 12.621 -34.913 845 HD21 LEU 123 HD21 LEU 123 -2.083 10.915 -32.063 846 HD22 LEU 123 HD22 LEU 123 -0.684 9.954 -32.537 847 HD23 LEU 123 HD23 LEU 123 -1.951 10.310 -33.712 848 H SER 124 H SER 124 1.284 15.202 -31.240 849 HA SER 124 HA SER 124 -0.875 16.717 -32.494 850 HB2 SER 124 HB2 SER 124 -1.201 17.098 -30.088 851 HB3 SER 124 HB3 SER 124 0.486 17.565 -29.923 852 HG SER 124 HG SER 124 -1.367 19.202 -30.350 853 H SER 125 H SER 125 -0.092 18.618 -33.541 854 HA SER 125 HA SER 125 2.841 18.711 -33.770 855 HB2 SER 125 HB2 SER 125 1.730 17.615 -35.746 856 HB3 SER 125 HB3 SER 125 0.873 19.123 -36.044 857 HG SER 125 HG SER 125 2.615 19.829 -36.964 858 H ALA 126 H ALA 126 2.986 20.938 -35.474 859 HA ALA 126 HA ALA 126 1.400 23.076 -34.315 860 HB1 ALA 126 HB1 ALA 126 2.923 23.544 -32.712 861 HB2 ALA 126 HB2 ALA 126 3.916 24.180 -34.029 862 HB3 ALA 126 HB3 ALA 126 4.151 22.523 -33.461 863 H LEU 127 H LEU 127 1.582 25.058 -35.460 864 HA LEU 127 HA LEU 127 3.183 25.013 -37.912 865 HB2 LEU 127 HB2 LEU 127 0.633 24.254 -38.142 866 HB3 LEU 127 HB3 LEU 127 0.358 25.989 -38.120 867 HG LEU 127 HG LEU 127 0.536 25.203 -40.427 868 HD11 LEU 127 HD11 LEU 127 2.044 26.803 -41.265 869 HD12 LEU 127 HD12 LEU 127 3.151 26.611 -39.905 870 HD13 LEU 127 HD13 LEU 127 1.607 27.433 -39.676 871 HD21 LEU 127 HD21 LEU 127 2.043 23.224 -39.762 872 HD22 LEU 127 HD22 LEU 127 3.386 24.356 -39.899 873 HD23 LEU 127 HD23 LEU 127 2.383 24.006 -41.305 874 H LEU 128 H LEU 128 4.239 26.844 -38.163 875 HA LEU 128 HA LEU 128 3.259 29.274 -36.784 876 HB2 LEU 128 HB2 LEU 128 6.092 28.442 -37.475 877 HB3 LEU 128 HB3 LEU 128 5.641 29.981 -36.743 878 HG LEU 128 HG LEU 128 4.957 27.304 -35.497 879 HD11 LEU 128 HD11 LEU 128 7.354 27.406 -35.544 880 HD12 LEU 128 HD12 LEU 128 6.867 27.897 -33.923 881 HD13 LEU 128 HD13 LEU 128 7.353 29.112 -35.105 882 HD21 LEU 128 HD21 LEU 128 4.760 28.758 -33.444 883 HD22 LEU 128 HD22 LEU 128 3.572 29.135 -34.695 884 HD23 LEU 128 HD23 LEU 128 4.987 30.166 -34.484 885 H MET 129 H MET 129 3.329 31.241 -37.877 886 HA MET 129 HA MET 129 3.901 31.107 -40.781 887 HB2 MET 129 HB2 MET 129 1.572 32.488 -39.422 888 HB3 MET 129 HB3 MET 129 1.978 32.643 -41.131 889 HG2 MET 129 HG2 MET 129 1.741 30.174 -41.378 890 HG3 MET 129 HG3 MET 129 1.238 30.077 -39.691 891 HE1 MET 129 HE1 MET 129 -0.627 30.934 -38.672 892 HE2 MET 129 HE2 MET 129 -2.112 31.548 -39.393 893 HE3 MET 129 HE3 MET 129 -0.721 32.615 -39.214 894 HA PRO 130 HA PRO 130 6.358 34.746 -40.077 895 HB2 PRO 130 HB2 PRO 130 6.179 36.075 -42.444 896 HB3 PRO 130 HB3 PRO 130 7.093 34.564 -42.262 897 HG2 PRO 130 HG2 PRO 130 4.343 34.990 -43.344 898 HG3 PRO 130 HG3 PRO 130 5.654 33.973 -43.969 899 HD2 PRO 130 HD2 PRO 130 3.595 32.944 -42.524 900 HD3 PRO 130 HD3 PRO 130 5.236 32.263 -42.454 901 H LYS 131 H LYS 131 6.272 37.009 -39.667 902 HA LYS 131 HA LYS 131 3.832 37.996 -38.681 903 HB2 LYS 131 HB2 LYS 131 6.140 38.729 -37.980 904 HB3 LYS 131 HB3 LYS 131 6.238 39.647 -39.482 905 HG2 LYS 131 HG2 LYS 131 4.294 40.978 -38.853 906 HG3 LYS 131 HG3 LYS 131 4.054 40.000 -37.406 907 HD2 LYS 131 HD2 LYS 131 5.182 41.974 -36.671 908 HD3 LYS 131 HD3 LYS 131 6.408 40.710 -36.702 909 HE2 LYS 131 HE2 LYS 131 7.201 41.493 -38.887 910 HE3 LYS 131 HE3 LYS 131 5.935 42.720 -38.925 911 HZ1 LYS 131 HZ1 LYS 131 7.764 42.623 -36.631 912 HZ2 LYS 131 HZ2 LYS 131 6.943 43.950 -37.300 913 HZ3 LYS 131 HZ3 LYS 131 8.307 43.311 -38.084 914 H ASP 132 H ASP 132 2.224 39.148 -39.561 915 HA ASP 132 HA ASP 132 2.309 39.669 -42.446 916 HB2 ASP 132 HB2 ASP 132 0.374 38.449 -41.512 917 HB3 ASP 132 HB3 ASP 132 0.001 39.839 -40.493 918 H GLY 133 H GLY 133 3.363 41.549 -42.816 919 HA2 GLY 133 HA2 GLY 133 2.102 44.018 -42.433 920 HA3 GLY 133 HA3 GLY 133 3.312 43.846 -41.165 921 H LEU 134 H LEU 134 3.877 45.884 -42.621 922 HA LEU 134 HA LEU 134 6.319 45.249 -43.944 923 HB2 LEU 134 HB2 LEU 134 4.205 44.890 -45.622 924 HB3 LEU 134 HB3 LEU 134 4.502 46.599 -45.882 925 HG LEU 134 HG LEU 134 5.727 45.273 -47.533 926 HD11 LEU 134 HD11 LEU 134 6.768 47.366 -46.479 927 HD12 LEU 134 HD12 LEU 134 7.861 46.282 -47.340 928 HD13 LEU 134 HD13 LEU 134 7.803 46.260 -45.576 929 HD21 LEU 134 HD21 LEU 134 5.916 43.250 -45.947 930 HD22 LEU 134 HD22 LEU 134 7.357 44.041 -45.307 931 HD23 LEU 134 HD23 LEU 134 7.288 43.573 -47.006 932 H GLU 135 H GLU 135 7.350 46.785 -42.773 933 HA GLU 135 HA GLU 135 6.279 49.397 -42.283 934 HB2 GLU 135 HB2 GLU 135 7.923 48.221 -40.792 935 HB3 GLU 135 HB3 GLU 135 9.151 48.471 -42.030 936 HG2 GLU 135 HG2 GLU 135 8.836 50.905 -41.876 937 HG3 GLU 135 HG3 GLU 135 7.576 50.676 -40.666 938 H HIS 136 H HIS 136 6.445 51.197 -43.469 939 HA HIS 136 HA HIS 136 7.293 51.161 -46.153 940 HB2 HIS 136 HB2 HIS 136 5.618 52.746 -45.221 941 HB3 HIS 136 HB3 HIS 136 6.906 53.563 -44.341 942 HD2 HIS 136 HD2 HIS 136 8.108 55.580 -45.809 943 HE1 HIS 136 HE1 HIS 136 6.819 54.371 -49.645 944 HE2 HIS 136 HE2 HIS 136 8.072 56.165 -48.354 945 H HIS 137 H HIS 137 8.847 52.437 -43.219 946 HA HIS 137 HA HIS 137 11.126 53.545 -44.455 947 HB2 HIS 137 HB2 HIS 137 10.694 52.473 -41.661 948 HB3 HIS 137 HB3 HIS 137 12.150 53.330 -42.167 949 HD2 HIS 137 HD2 HIS 137 8.632 54.158 -40.896 950 HE1 HIS 137 HE1 HIS 137 10.142 57.727 -42.575 951 HE2 HIS 137 HE2 HIS 137 8.284 56.735 -41.156 952 H HIS 138 H HIS 138 10.487 50.297 -43.182 953 HA HIS 138 HA HIS 138 13.116 49.283 -43.469 954 HB2 HIS 138 HB2 HIS 138 11.232 48.242 -42.134 955 HB3 HIS 138 HB3 HIS 138 10.558 47.682 -43.665 956 HD2 HIS 138 HD2 HIS 138 13.386 46.727 -41.183 957 HE1 HIS 138 HE1 HIS 138 13.779 44.203 -44.543 958 HE2 HIS 138 HE2 HIS 138 14.580 44.627 -42.172 959 H HIS 139 H HIS 139 14.167 48.349 -45.143 960 HA HIS 139 HA HIS 139 12.778 47.709 -47.628 961 HB2 HIS 139 HB2 HIS 139 13.402 50.186 -47.668 962 HB3 HIS 139 HB3 HIS 139 15.084 49.666 -47.670 963 HD2 HIS 139 HD2 HIS 139 12.040 49.826 -50.110 964 HE1 HIS 139 HE1 HIS 139 15.288 48.168 -52.233 965 HE2 HIS 139 HE2 HIS 139 12.924 49.072 -52.445 966 H HIS 140 H HIS 140 13.760 46.032 -48.665 967 HA HIS 140 HA HIS 140 15.711 44.491 -47.358 968 HB2 HIS 140 HB2 HIS 140 14.046 43.658 -49.045 969 HB3 HIS 140 HB3 HIS 140 15.027 44.401 -50.305 970 HD2 HIS 140 HD2 HIS 140 15.041 41.219 -48.065 971 HE1 HIS 140 HE1 HIS 140 18.603 41.175 -50.333 972 HE2 HIS 140 HE2 HIS 140 17.132 39.818 -48.767 973 H HIS 141 H HIS 141 16.013 46.595 -50.215 974 HA HIS 141 HA HIS 141 18.910 46.282 -50.247 975 HB2 HIS 141 HB2 HIS 141 17.494 46.415 -52.344 976 HB3 HIS 141 HB3 HIS 141 17.217 48.114 -51.959 977 HD2 HIS 141 HD2 HIS 141 19.138 49.730 -53.095 978 HE1 HIS 141 HE1 HIS 141 22.242 46.884 -53.384 979 HE2 HIS 141 HE2 HIS 141 21.585 49.283 -53.888 Start of MODEL 10 1 H1 MET 1 HT1 MET 1 2.610 0.531 -9.417 2 H2 MET 1 HT2 MET 1 3.928 0.058 -10.377 3 H3 MET 1 HT3 MET 1 3.446 1.685 -10.334 4 HA MET 1 HA MET 1 5.201 1.793 -8.921 5 HB2 MET 1 HB2 MET 1 3.067 2.448 -7.758 6 HB3 MET 1 HB3 MET 1 2.996 0.821 -7.077 7 HG2 MET 1 HG2 MET 1 4.033 2.291 -5.440 8 HG3 MET 1 HG3 MET 1 5.261 1.199 -6.067 9 HE1 MET 1 HE1 MET 1 5.857 3.771 -4.487 10 HE2 MET 1 HE2 MET 1 7.181 4.501 -5.393 11 HE3 MET 1 HE3 MET 1 7.147 2.756 -5.148 12 H SER 2 H SER 2 6.087 -0.287 -10.061 13 HA SER 2 HA SER 2 6.039 -2.779 -8.735 14 HB2 SER 2 HB2 SER 2 8.091 -1.553 -10.589 15 HB3 SER 2 HB3 SER 2 8.124 -3.230 -10.052 16 HG SER 2 HG SER 2 6.114 -3.529 -11.022 17 H ASP 3 H ASP 3 8.208 0.017 -8.478 18 HA ASP 3 HA ASP 3 9.039 -0.851 -5.825 19 HB2 ASP 3 HB2 ASP 3 10.614 -1.958 -7.461 20 HB3 ASP 3 HB3 ASP 3 11.139 -0.349 -7.942 21 H GLN 4 H GLN 4 9.208 1.513 -8.439 22 HA GLN 4 HA GLN 4 8.740 3.722 -6.729 23 HB2 GLN 4 HB2 GLN 4 11.207 3.093 -6.230 24 HB3 GLN 4 HB3 GLN 4 11.551 3.763 -7.824 25 HG2 GLN 4 HG2 GLN 4 9.938 5.350 -5.826 26 HG3 GLN 4 HG3 GLN 4 11.698 5.335 -5.741 27 HE21 GLN 4 HE21 GLN 4 9.819 7.585 -6.523 28 HE22 GLN 4 HE22 GLN 4 10.346 8.074 -8.062 29 H SER 5 H SER 5 10.768 3.210 -9.617 30 HA SER 5 HA SER 5 10.744 4.227 -11.697 31 HB2 SER 5 HB2 SER 5 8.791 3.739 -12.918 32 HB3 SER 5 HB3 SER 5 8.792 2.540 -11.628 33 HG SER 5 HG SER 5 6.881 4.184 -12.186 34 H GLN 6 H GLN 6 9.122 5.887 -13.057 35 HA GLN 6 HA GLN 6 9.255 8.385 -11.507 36 HB2 GLN 6 HB2 GLN 6 8.877 7.937 -14.481 37 HB3 GLN 6 HB3 GLN 6 9.048 9.504 -13.696 38 HG2 GLN 6 HG2 GLN 6 11.128 7.293 -13.663 39 HG3 GLN 6 HG3 GLN 6 11.193 8.733 -14.675 40 HE21 GLN 6 HE21 GLN 6 12.470 7.513 -11.876 41 HE22 GLN 6 HE22 GLN 6 12.744 8.960 -11.032 42 H GLU 7 H GLU 7 7.007 6.186 -12.927 43 HA GLU 7 HA GLU 7 4.719 7.765 -13.315 44 HB2 GLU 7 HB2 GLU 7 4.751 4.936 -12.242 45 HB3 GLU 7 HB3 GLU 7 3.434 5.722 -13.094 46 HG2 GLU 7 HG2 GLU 7 6.148 5.127 -14.311 47 HG3 GLU 7 HG3 GLU 7 4.681 4.197 -14.597 48 HA PRO 8 HA PRO 8 3.120 8.861 -9.303 49 HB2 PRO 8 HB2 PRO 8 0.663 7.249 -9.889 50 HB3 PRO 8 HB3 PRO 8 0.799 8.936 -9.348 51 HG2 PRO 8 HG2 PRO 8 0.182 8.382 -11.854 52 HG3 PRO 8 HG3 PRO 8 1.286 9.713 -11.469 53 HD2 PRO 8 HD2 PRO 8 1.919 6.997 -12.554 54 HD3 PRO 8 HD3 PRO 8 2.683 8.559 -12.919 55 H THR 9 H THR 9 2.401 7.847 -7.224 56 HA THR 9 HA THR 9 3.807 5.395 -6.749 57 HB THR 9 HB THR 9 3.150 5.736 -4.402 58 HG1 THR 9 HG1 THR 9 1.605 7.072 -3.888 59 HG21 THR 9 HG21 THR 9 5.121 6.919 -5.105 60 HG22 THR 9 HG22 THR 9 4.173 8.033 -4.120 61 HG23 THR 9 HG23 THR 9 4.160 8.178 -5.877 62 H MET 10 H MET 10 2.732 3.697 -5.344 63 HA MET 10 HA MET 10 0.761 2.362 -6.774 64 HB2 MET 10 HB2 MET 10 0.539 0.896 -4.814 65 HB3 MET 10 HB3 MET 10 2.229 1.239 -5.167 66 HG2 MET 10 HG2 MET 10 2.216 3.004 -3.412 67 HG3 MET 10 HG3 MET 10 0.545 2.586 -3.032 68 HE1 MET 10 HE1 MET 10 0.558 -0.772 -1.444 69 HE2 MET 10 HE2 MET 10 0.319 -0.534 -3.175 70 HE3 MET 10 HE3 MET 10 -0.308 0.653 -2.034 71 H GLU 11 H GLU 11 0.443 4.575 -4.061 72 HA GLU 11 HA GLU 11 -2.326 4.194 -3.551 73 HB2 GLU 11 HB2 GLU 11 -0.509 6.568 -3.092 74 HB3 GLU 11 HB3 GLU 11 -2.185 6.519 -2.552 75 HG2 GLU 11 HG2 GLU 11 -1.756 4.593 -1.160 76 HG3 GLU 11 HG3 GLU 11 -0.136 4.414 -1.821 77 H GLU 12 H GLU 12 -0.635 6.663 -5.455 78 HA GLU 12 HA GLU 12 -2.860 8.038 -6.415 79 HB2 GLU 12 HB2 GLU 12 -0.136 7.615 -7.649 80 HB3 GLU 12 HB3 GLU 12 -1.337 8.719 -8.319 81 HG2 GLU 12 HG2 GLU 12 -1.416 9.951 -6.195 82 HG3 GLU 12 HG3 GLU 12 -0.249 8.836 -5.490 83 H ILE 13 H ILE 13 -1.108 5.352 -8.064 84 HA ILE 13 HA ILE 13 -2.755 5.266 -10.324 85 HB ILE 13 HB ILE 13 -1.934 2.948 -10.635 86 HG12 ILE 13 HG12 ILE 13 -0.499 3.375 -7.998 87 HG13 ILE 13 HG13 ILE 13 -1.956 2.405 -8.145 88 HG21 ILE 13 HG21 ILE 13 -0.586 4.892 -11.336 89 HG22 ILE 13 HG22 ILE 13 0.455 3.584 -10.773 90 HG23 ILE 13 HG23 ILE 13 0.143 4.973 -9.732 91 HD11 ILE 13 HD11 ILE 13 -0.725 1.075 -9.945 92 HD12 ILE 13 HD12 ILE 13 -0.163 0.848 -8.290 93 HD13 ILE 13 HD13 ILE 13 0.742 1.883 -9.395 94 H LEU 14 H LEU 14 -3.209 3.831 -7.159 95 HA LEU 14 HA LEU 14 -5.403 2.151 -7.837 96 HB2 LEU 14 HB2 LEU 14 -4.487 3.348 -5.223 97 HB3 LEU 14 HB3 LEU 14 -5.892 2.287 -5.343 98 HG LEU 14 HG LEU 14 -3.176 1.498 -6.423 99 HD11 LEU 14 HD11 LEU 14 -3.047 0.109 -4.309 100 HD12 LEU 14 HD12 LEU 14 -4.378 1.074 -3.676 101 HD13 LEU 14 HD13 LEU 14 -2.836 1.840 -4.065 102 HD21 LEU 14 HD21 LEU 14 -4.968 0.168 -7.326 103 HD22 LEU 14 HD22 LEU 14 -5.740 0.028 -5.748 104 HD23 LEU 14 HD23 LEU 14 -4.215 -0.802 -6.060 105 H ALA 15 H ALA 15 -5.133 5.497 -6.802 106 HA ALA 15 HA ALA 15 -7.873 6.019 -6.327 107 HB1 ALA 15 HB1 ALA 15 -7.228 8.193 -6.022 108 HB2 ALA 15 HB2 ALA 15 -6.182 8.200 -7.443 109 HB3 ALA 15 HB3 ALA 15 -5.630 7.451 -5.946 110 H SER 16 H SER 16 -5.867 6.296 -9.247 111 HA SER 16 HA SER 16 -7.819 7.464 -10.918 112 HB2 SER 16 HB2 SER 16 -5.398 5.778 -11.558 113 HB3 SER 16 HB3 SER 16 -6.359 6.622 -12.769 114 HG SER 16 HG SER 16 -5.143 8.265 -12.286 115 H ILE 17 H ILE 17 -6.970 4.063 -10.319 116 HA ILE 17 HA ILE 17 -8.682 2.979 -12.314 117 HB ILE 17 HB ILE 17 -7.514 1.731 -9.812 118 HG12 ILE 17 HG12 ILE 17 -5.817 2.530 -11.412 119 HG13 ILE 17 HG13 ILE 17 -5.840 0.776 -11.356 120 HG21 ILE 17 HG21 ILE 17 -8.994 0.490 -12.138 121 HG22 ILE 17 HG22 ILE 17 -9.329 0.312 -10.417 122 HG23 ILE 17 HG23 ILE 17 -7.898 -0.442 -11.118 123 HD11 ILE 17 HD11 ILE 17 -7.310 0.830 -13.433 124 HD12 ILE 17 HD12 ILE 17 -5.664 1.417 -13.677 125 HD13 ILE 17 HD13 ILE 17 -6.996 2.564 -13.521 126 H ARG 18 H ARG 18 -9.116 3.586 -8.828 127 HA ARG 18 HA ARG 18 -10.988 3.586 -7.495 128 HB2 ARG 18 HB2 ARG 18 -11.607 5.364 -9.186 129 HB3 ARG 18 HB3 ARG 18 -12.501 4.125 -10.063 130 HG2 ARG 18 HG2 ARG 18 -13.832 3.670 -8.007 131 HG3 ARG 18 HG3 ARG 18 -12.985 4.988 -7.197 132 HD2 ARG 18 HD2 ARG 18 -15.074 5.866 -8.029 133 HD3 ARG 18 HD3 ARG 18 -13.781 6.524 -9.028 134 HE ARG 18 HE ARG 18 -14.781 4.116 -10.171 135 HH11 ARG 18 HH11 ARG 18 -15.632 7.486 -9.716 136 HH12 ARG 18 HH12 ARG 18 -16.636 7.542 -11.127 137 HH21 ARG 18 HH21 ARG 18 -16.092 4.234 -11.997 138 HH22 ARG 18 HH22 ARG 18 -16.892 5.714 -12.407 139 H ARG 19 H ARG 19 -10.799 1.368 -7.019 140 HA ARG 19 HA ARG 19 -13.033 -0.244 -7.977 141 HB2 ARG 19 HB2 ARG 19 -11.112 -0.689 -9.546 142 HB3 ARG 19 HB3 ARG 19 -10.209 -1.312 -8.168 143 HG2 ARG 19 HG2 ARG 19 -11.901 -3.028 -7.782 144 HG3 ARG 19 HG3 ARG 19 -12.904 -2.369 -9.074 145 HD2 ARG 19 HD2 ARG 19 -10.102 -3.462 -9.452 146 HD3 ARG 19 HD3 ARG 19 -11.580 -4.350 -9.808 147 HE ARG 19 HE ARG 19 -11.744 -1.942 -11.205 148 HH11 ARG 19 HH11 ARG 19 -9.649 -4.753 -11.175 149 HH12 ARG 19 HH12 ARG 19 -9.237 -4.607 -12.852 150 HH21 ARG 19 HH21 ARG 19 -11.182 -1.791 -13.380 151 HH22 ARG 19 HH22 ARG 19 -10.100 -2.942 -14.089 152 H ILE 20 H ILE 20 -13.710 -1.754 -6.512 153 HA ILE 20 HA ILE 20 -12.122 -2.096 -4.046 154 HB ILE 20 HB ILE 20 -13.909 -0.438 -3.641 155 HG12 ILE 20 HG12 ILE 20 -14.686 -3.035 -2.298 156 HG13 ILE 20 HG13 ILE 20 -13.175 -2.210 -1.920 157 HG21 ILE 20 HG21 ILE 20 -15.791 -2.685 -4.426 158 HG22 ILE 20 HG22 ILE 20 -15.513 -1.206 -5.344 159 HG23 ILE 20 HG23 ILE 20 -16.277 -1.128 -3.756 160 HD11 ILE 20 HD11 ILE 20 -14.848 -1.491 -0.318 161 HD12 ILE 20 HD12 ILE 20 -15.980 -1.099 -1.612 162 HD13 ILE 20 HD13 ILE 20 -14.514 -0.141 -1.403 163 H ILE 21 H ILE 21 -11.892 -4.158 -3.415 164 HA ILE 21 HA ILE 21 -13.414 -6.225 -4.879 165 HB ILE 21 HB ILE 21 -10.749 -6.440 -3.434 166 HG12 ILE 21 HG12 ILE 21 -11.305 -6.575 -6.412 167 HG13 ILE 21 HG13 ILE 21 -10.856 -5.075 -5.605 168 HG21 ILE 21 HG21 ILE 21 -10.674 -8.644 -4.733 169 HG22 ILE 21 HG22 ILE 21 -12.394 -8.418 -5.040 170 HG23 ILE 21 HG23 ILE 21 -11.812 -8.597 -3.387 171 HD11 ILE 21 HD11 ILE 21 -8.937 -6.411 -6.657 172 HD12 ILE 21 HD12 ILE 21 -9.190 -7.591 -5.371 173 HD13 ILE 21 HD13 ILE 21 -8.721 -5.937 -4.973 174 H SER 22 H SER 22 -12.218 -5.379 -1.633 175 HA SER 22 HA SER 22 -13.252 -7.540 -0.217 176 HB2 SER 22 HB2 SER 22 -12.870 -4.674 0.660 177 HB3 SER 22 HB3 SER 22 -13.229 -6.003 1.760 178 HG SER 22 HG SER 22 -11.301 -6.924 1.278 179 H GLU 23 H GLU 23 -14.859 -4.400 -0.919 180 HA GLU 23 HA GLU 23 -17.417 -5.660 -0.120 181 HB2 GLU 23 HB2 GLU 23 -16.632 -3.745 1.319 182 HB3 GLU 23 HB3 GLU 23 -16.754 -2.706 -0.101 183 HG2 GLU 23 HG2 GLU 23 -19.149 -3.276 -0.314 184 HG3 GLU 23 HG3 GLU 23 -19.028 -4.315 1.103 185 H ASP 24 H ASP 24 -18.987 -5.756 -1.625 186 HA ASP 24 HA ASP 24 -19.963 -5.705 -3.711 187 HB2 ASP 24 HB2 ASP 24 -20.112 -3.255 -2.669 188 HB3 ASP 24 HB3 ASP 24 -19.093 -2.878 -4.061 189 H ASP 25 H ASP 25 -18.595 -7.078 -4.895 190 HA ASP 25 HA ASP 25 -16.197 -6.039 -6.095 191 HB2 ASP 25 HB2 ASP 25 -16.358 -8.397 -5.367 192 HB3 ASP 25 HB3 ASP 25 -17.616 -8.672 -6.569 193 H ALA 26 H ALA 26 -16.936 -4.322 -7.343 194 HA ALA 26 HA ALA 26 -18.980 -4.478 -9.297 195 HB1 ALA 26 HB1 ALA 26 -18.351 -2.323 -9.902 196 HB2 ALA 26 HB2 ALA 26 -16.641 -2.627 -9.601 197 HB3 ALA 26 HB3 ALA 26 -17.750 -2.410 -8.246 198 HA PRO 27 HA PRO 27 -17.182 -6.683 -12.707 199 HB2 PRO 27 HB2 PRO 27 -17.899 -4.379 -14.472 200 HB3 PRO 27 HB3 PRO 27 -18.304 -6.099 -14.641 201 HG2 PRO 27 HG2 PRO 27 -20.139 -4.383 -13.856 202 HG3 PRO 27 HG3 PRO 27 -20.018 -5.979 -13.087 203 HD2 PRO 27 HD2 PRO 27 -19.089 -3.314 -12.049 204 HD3 PRO 27 HD3 PRO 27 -19.882 -4.649 -11.178 205 H ALA 28 H ALA 28 -15.244 -6.859 -13.778 206 HA ALA 28 HA ALA 28 -13.553 -4.464 -14.062 207 HB1 ALA 28 HB1 ALA 28 -11.632 -5.689 -13.144 208 HB2 ALA 28 HB2 ALA 28 -12.669 -7.078 -12.812 209 HB3 ALA 28 HB3 ALA 28 -12.923 -5.560 -11.948 210 H GLU 29 H GLU 29 -11.736 -4.781 -15.530 211 HA GLU 29 HA GLU 29 -11.775 -7.110 -17.263 212 HB2 GLU 29 HB2 GLU 29 -13.534 -5.510 -18.172 213 HB3 GLU 29 HB3 GLU 29 -12.225 -4.365 -18.466 214 HG2 GLU 29 HG2 GLU 29 -12.615 -5.606 -20.511 215 HG3 GLU 29 HG3 GLU 29 -11.071 -6.117 -19.840 216 HA PRO 30 HA PRO 30 -7.724 -4.861 -16.473 217 HB2 PRO 30 HB2 PRO 30 -6.364 -6.866 -15.267 218 HB3 PRO 30 HB3 PRO 30 -7.440 -5.781 -14.373 219 HG2 PRO 30 HG2 PRO 30 -7.956 -8.540 -15.390 220 HG3 PRO 30 HG3 PRO 30 -8.352 -7.828 -13.815 221 HD2 PRO 30 HD2 PRO 30 -10.192 -8.067 -15.811 222 HD3 PRO 30 HD3 PRO 30 -10.234 -6.744 -14.625 223 H ALA 31 H ALA 31 -5.675 -5.208 -17.511 224 HA ALA 31 HA ALA 31 -5.260 -7.550 -19.164 225 HB1 ALA 31 HB1 ALA 31 -6.694 -6.436 -20.694 226 HB2 ALA 31 HB2 ALA 31 -5.055 -6.099 -21.256 227 HB3 ALA 31 HB3 ALA 31 -5.954 -4.869 -20.364 228 H ALA 32 H ALA 32 -3.144 -7.698 -19.971 229 HA ALA 32 HA ALA 32 -1.264 -5.538 -19.660 230 HB1 ALA 32 HB1 ALA 32 -0.469 -7.898 -18.033 231 HB2 ALA 32 HB2 ALA 32 -1.694 -6.836 -17.342 232 HB3 ALA 32 HB3 ALA 32 -0.116 -6.186 -17.791 233 H GLU 33 H GLU 33 -0.953 -5.962 -21.872 234 HA GLU 33 HA GLU 33 0.934 -8.136 -22.393 235 HB2 GLU 33 HB2 GLU 33 -1.351 -9.034 -22.901 236 HB3 GLU 33 HB3 GLU 33 -1.535 -7.760 -24.106 237 HG2 GLU 33 HG2 GLU 33 0.434 -8.600 -25.318 238 HG3 GLU 33 HG3 GLU 33 0.663 -9.853 -24.099 239 H ALA 34 H ALA 34 2.573 -7.390 -23.562 240 HA ALA 34 HA ALA 34 2.174 -5.418 -25.664 241 HB1 ALA 34 HB1 ALA 34 4.119 -4.040 -24.626 242 HB2 ALA 34 HB2 ALA 34 3.653 -4.819 -23.115 243 HB3 ALA 34 HB3 ALA 34 2.492 -3.815 -23.985 244 H ALA 35 H ALA 35 3.718 -5.491 -27.215 245 HA ALA 35 HA ALA 35 6.067 -7.220 -26.770 246 HB1 ALA 35 HB1 ALA 35 5.246 -7.697 -29.421 247 HB2 ALA 35 HB2 ALA 35 3.776 -7.783 -28.449 248 HB3 ALA 35 HB3 ALA 35 5.153 -8.813 -28.058 249 HA PRO 36 HA PRO 36 8.221 -3.984 -28.946 250 HB2 PRO 36 HB2 PRO 36 10.352 -5.285 -30.001 251 HB3 PRO 36 HB3 PRO 36 10.176 -5.019 -28.254 252 HG2 PRO 36 HG2 PRO 36 9.582 -7.463 -29.863 253 HG3 PRO 36 HG3 PRO 36 10.409 -7.315 -28.301 254 HD2 PRO 36 HD2 PRO 36 7.788 -8.045 -28.504 255 HD3 PRO 36 HD3 PRO 36 8.431 -7.145 -27.109 256 HA PRO 37 HA PRO 37 6.980 -3.998 -33.234 257 HB2 PRO 37 HB2 PRO 37 8.899 -2.522 -34.500 258 HB3 PRO 37 HB3 PRO 37 7.676 -1.806 -33.434 259 HG2 PRO 37 HG2 PRO 37 10.513 -2.516 -32.846 260 HG3 PRO 37 HG3 PRO 37 9.600 -1.063 -32.400 261 HD2 PRO 37 HD2 PRO 37 10.023 -3.078 -30.635 262 HD3 PRO 37 HD3 PRO 37 8.533 -2.109 -30.619 263 HA PRO 38 HA PRO 38 8.919 -7.414 -35.346 264 HB2 PRO 38 HB2 PRO 38 8.491 -5.943 -37.912 265 HB3 PRO 38 HB3 PRO 38 7.992 -7.583 -37.456 266 HG2 PRO 38 HG2 PRO 38 6.214 -5.645 -37.563 267 HG3 PRO 38 HG3 PRO 38 6.168 -6.833 -36.246 268 HD2 PRO 38 HD2 PRO 38 7.179 -4.001 -36.190 269 HD3 PRO 38 HD3 PRO 38 6.233 -4.884 -34.970 270 HA PRO 39 HA PRO 39 13.208 -6.122 -35.908 271 HB2 PRO 39 HB2 PRO 39 13.510 -8.531 -37.643 272 HB3 PRO 39 HB3 PRO 39 14.437 -8.049 -36.209 273 HG2 PRO 39 HG2 PRO 39 12.693 -10.023 -36.071 274 HG3 PRO 39 HG3 PRO 39 12.843 -8.856 -34.745 275 HD2 PRO 39 HD2 PRO 39 10.734 -9.012 -36.886 276 HD3 PRO 39 HD3 PRO 39 10.559 -8.657 -35.150 277 HA PRO 40 HA PRO 40 13.175 -4.007 -39.865 278 HB2 PRO 40 HB2 PRO 40 15.871 -3.616 -40.297 279 HB3 PRO 40 HB3 PRO 40 14.885 -2.634 -39.196 280 HG2 PRO 40 HG2 PRO 40 16.702 -4.915 -38.581 281 HG3 PRO 40 HG3 PRO 40 16.486 -3.380 -37.722 282 HD2 PRO 40 HD2 PRO 40 15.360 -5.664 -36.821 283 HD3 PRO 40 HD3 PRO 40 14.543 -4.092 -36.650 284 H GLU 41 H GLU 41 15.054 -6.921 -39.436 285 HA GLU 41 HA GLU 41 15.762 -8.567 -40.871 286 HB2 GLU 41 HB2 GLU 41 13.291 -7.633 -42.357 287 HB3 GLU 41 HB3 GLU 41 14.139 -9.144 -42.669 288 HG2 GLU 41 HG2 GLU 41 12.903 -8.365 -40.009 289 HG3 GLU 41 HG3 GLU 41 12.171 -9.461 -41.178 290 HA PRO 42 HA PRO 42 17.662 -5.306 -43.782 291 HB2 PRO 42 HB2 PRO 42 20.275 -5.756 -43.040 292 HB3 PRO 42 HB3 PRO 42 19.231 -4.528 -42.300 293 HG2 PRO 42 HG2 PRO 42 19.910 -7.262 -41.331 294 HG3 PRO 42 HG3 PRO 42 19.795 -5.741 -40.428 295 HD2 PRO 42 HD2 PRO 42 17.806 -7.565 -40.365 296 HD3 PRO 42 HD3 PRO 42 17.469 -5.819 -40.320 297 H GLU 43 H GLU 43 18.256 -8.655 -43.020 298 HA GLU 43 HA GLU 43 19.937 -9.300 -45.232 299 HB2 GLU 43 HB2 GLU 43 18.149 -11.006 -43.487 300 HB3 GLU 43 HB3 GLU 43 19.232 -11.660 -44.713 301 HG2 GLU 43 HG2 GLU 43 20.099 -9.930 -42.376 302 HG3 GLU 43 HG3 GLU 43 20.257 -11.682 -42.445 303 HA PRO 44 HA PRO 44 16.932 -9.461 -48.511 304 HB2 PRO 44 HB2 PRO 44 17.900 -11.432 -50.125 305 HB3 PRO 44 HB3 PRO 44 18.672 -9.841 -49.984 306 HG2 PRO 44 HG2 PRO 44 19.394 -12.417 -48.657 307 HG3 PRO 44 HG3 PRO 44 20.445 -11.211 -49.421 308 HD2 PRO 44 HD2 PRO 44 20.122 -11.338 -46.726 309 HD3 PRO 44 HD3 PRO 44 20.399 -9.800 -47.575 310 H GLU 45 H GLU 45 15.187 -10.693 -49.401 311 HA GLU 45 HA GLU 45 13.992 -12.534 -47.596 312 HB2 GLU 45 HB2 GLU 45 13.292 -11.750 -50.436 313 HB3 GLU 45 HB3 GLU 45 12.284 -12.789 -49.428 314 HG2 GLU 45 HG2 GLU 45 13.125 -9.961 -48.713 315 HG3 GLU 45 HG3 GLU 45 11.549 -10.413 -49.357 316 HA PRO 46 HA PRO 46 15.711 -16.366 -49.102 317 HB2 PRO 46 HB2 PRO 46 13.789 -18.166 -48.490 318 HB3 PRO 46 HB3 PRO 46 14.736 -17.345 -47.230 319 HG2 PRO 46 HG2 PRO 46 12.013 -16.686 -48.270 320 HG3 PRO 46 HG3 PRO 46 12.562 -16.825 -46.585 321 HD2 PRO 46 HD2 PRO 46 12.328 -14.418 -47.803 322 HD3 PRO 46 HD3 PRO 46 13.618 -14.740 -46.621 323 H VAL 47 H VAL 47 15.623 -17.837 -50.841 324 HA VAL 47 HA VAL 47 14.094 -16.986 -53.093 325 HB VAL 47 HB VAL 47 16.392 -17.896 -53.273 326 HG11 VAL 47 HG11 VAL 47 15.142 -20.604 -52.743 327 HG12 VAL 47 HG12 VAL 47 16.037 -19.696 -51.525 328 HG13 VAL 47 HG13 VAL 47 16.851 -20.240 -52.993 329 HG21 VAL 47 HG21 VAL 47 16.023 -19.139 -55.295 330 HG22 VAL 47 HG22 VAL 47 14.709 -17.967 -55.174 331 HG23 VAL 47 HG23 VAL 47 14.424 -19.655 -54.757 332 H SER 48 H SER 48 13.695 -19.499 -50.690 333 HA SER 48 HA SER 48 11.889 -21.185 -52.029 334 HB2 SER 48 HB2 SER 48 12.109 -20.526 -49.083 335 HB3 SER 48 HB3 SER 48 11.158 -21.853 -49.745 336 HG SER 48 HG SER 48 13.903 -21.557 -49.489 337 H PHE 49 H PHE 49 9.705 -21.191 -52.268 338 HA PHE 49 HA PHE 49 8.361 -18.627 -52.031 339 HB2 PHE 49 HB2 PHE 49 8.201 -20.096 -54.073 340 HB3 PHE 49 HB3 PHE 49 7.260 -21.234 -53.107 341 HD1 PHE 49 HD1 PHE 49 7.344 -17.777 -54.465 342 HD2 PHE 49 HD2 PHE 49 4.963 -20.799 -52.553 343 HE1 PHE 49 HE1 PHE 49 5.301 -16.436 -54.885 344 HE2 PHE 49 HE2 PHE 49 2.921 -19.456 -52.973 345 HZ PHE 49 HZ PHE 49 3.090 -17.273 -54.139 346 H ASP 50 H ASP 50 8.365 -18.591 -49.706 347 HA ASP 50 HA ASP 50 6.905 -20.516 -48.170 348 HB2 ASP 50 HB2 ASP 50 7.245 -19.011 -46.309 349 HB3 ASP 50 HB3 ASP 50 8.727 -19.092 -47.254 350 H ASP 51 H ASP 51 5.126 -19.518 -46.608 351 HA ASP 51 HA ASP 51 2.827 -19.081 -48.195 352 HB2 ASP 51 HB2 ASP 51 3.336 -18.757 -45.234 353 HB3 ASP 51 HB3 ASP 51 1.748 -18.541 -45.963 354 H GLU 52 H GLU 52 4.853 -16.879 -46.281 355 HA GLU 52 HA GLU 52 4.328 -14.637 -47.906 356 HB2 GLU 52 HB2 GLU 52 3.036 -13.267 -46.285 357 HB3 GLU 52 HB3 GLU 52 2.108 -14.645 -46.869 358 HG2 GLU 52 HG2 GLU 52 2.701 -15.903 -44.814 359 HG3 GLU 52 HG3 GLU 52 3.596 -14.505 -44.226 360 H VAL 53 H VAL 53 5.352 -12.662 -46.942 361 HA VAL 53 HA VAL 53 7.587 -13.525 -45.237 362 HB VAL 53 HB VAL 53 8.761 -11.493 -46.063 363 HG11 VAL 53 HG11 VAL 53 9.150 -13.549 -47.249 364 HG12 VAL 53 HG12 VAL 53 8.940 -12.285 -48.460 365 HG13 VAL 53 HG13 VAL 53 7.621 -13.404 -48.117 366 HG21 VAL 53 HG21 VAL 53 7.790 -10.204 -47.915 367 HG22 VAL 53 HG22 VAL 53 6.729 -10.120 -46.508 368 HG23 VAL 53 HG23 VAL 53 6.326 -11.186 -47.853 369 H LEU 54 H LEU 54 4.759 -12.519 -44.447 370 HA LEU 54 HA LEU 54 5.685 -10.504 -42.483 371 HB2 LEU 54 HB2 LEU 54 2.984 -10.674 -43.849 372 HB3 LEU 54 HB3 LEU 54 3.374 -9.577 -42.526 373 HG LEU 54 HG LEU 54 4.912 -9.633 -45.141 374 HD11 LEU 54 HD11 LEU 54 2.676 -7.773 -44.271 375 HD12 LEU 54 HD12 LEU 54 2.543 -9.006 -45.522 376 HD13 LEU 54 HD13 LEU 54 3.620 -7.628 -45.753 377 HD21 LEU 54 HD21 LEU 54 5.558 -7.318 -44.336 378 HD22 LEU 54 HD22 LEU 54 6.178 -8.629 -43.334 379 HD23 LEU 54 HD23 LEU 54 4.776 -7.698 -42.803 380 H GLU 55 H GLU 55 5.472 -11.110 -40.426 381 HA GLU 55 HA GLU 55 4.097 -13.604 -39.813 382 HB2 GLU 55 HB2 GLU 55 5.806 -11.777 -38.109 383 HB3 GLU 55 HB3 GLU 55 5.131 -13.310 -37.566 384 HG2 GLU 55 HG2 GLU 55 7.211 -14.031 -38.262 385 HG3 GLU 55 HG3 GLU 55 6.324 -14.233 -39.766 386 H LEU 56 H LEU 56 2.158 -13.763 -38.971 387 HA LEU 56 HA LEU 56 1.074 -11.749 -37.176 388 HB2 LEU 56 HB2 LEU 56 0.463 -10.925 -39.461 389 HB3 LEU 56 HB3 LEU 56 -0.381 -12.445 -39.746 390 HG LEU 56 HG LEU 56 -1.801 -11.955 -37.717 391 HD11 LEU 56 HD11 LEU 56 -0.311 -9.321 -37.886 392 HD12 LEU 56 HD12 LEU 56 -0.437 -10.398 -36.496 393 HD13 LEU 56 HD13 LEU 56 -1.851 -9.498 -37.046 394 HD21 LEU 56 HD21 LEU 56 -2.565 -11.474 -40.027 395 HD22 LEU 56 HD22 LEU 56 -1.855 -9.862 -39.915 396 HD23 LEU 56 HD23 LEU 56 -3.209 -10.305 -38.875 397 H THR 57 H THR 57 0.221 -12.901 -35.543 398 HA THR 57 HA THR 57 -0.803 -15.611 -36.131 399 HB THR 57 HB THR 57 1.097 -15.632 -34.609 400 HG1 THR 57 HG1 THR 57 -0.622 -17.097 -34.273 401 HG21 THR 57 HG21 THR 57 0.629 -13.280 -33.704 402 HG22 THR 57 HG22 THR 57 1.145 -14.482 -32.525 403 HG23 THR 57 HG23 THR 57 -0.556 -14.039 -32.644 404 H ASP 58 H ASP 58 -1.472 -12.767 -34.063 405 HA ASP 58 HA ASP 58 -4.160 -13.780 -33.539 406 HB2 ASP 58 HB2 ASP 58 -4.348 -11.900 -31.990 407 HB3 ASP 58 HB3 ASP 58 -2.861 -12.791 -31.695 408 HA PRO 59 HA PRO 59 -5.868 -10.987 -36.619 409 HB2 PRO 59 HB2 PRO 59 -8.476 -11.460 -36.305 410 HB3 PRO 59 HB3 PRO 59 -7.382 -12.772 -36.799 411 HG2 PRO 59 HG2 PRO 59 -8.606 -12.226 -34.147 412 HG3 PRO 59 HG3 PRO 59 -8.273 -13.774 -34.942 413 HD2 PRO 59 HD2 PRO 59 -6.650 -12.515 -32.986 414 HD3 PRO 59 HD3 PRO 59 -6.200 -13.906 -33.993 415 H ILE 60 H ILE 60 -4.953 -9.172 -35.131 416 HA ILE 60 HA ILE 60 -5.213 -7.096 -34.169 417 HB ILE 60 HB ILE 60 -8.129 -7.308 -34.972 418 HG12 ILE 60 HG12 ILE 60 -6.758 -7.798 -36.960 419 HG13 ILE 60 HG13 ILE 60 -7.498 -6.211 -37.110 420 HG21 ILE 60 HG21 ILE 60 -7.767 -4.774 -35.234 421 HG22 ILE 60 HG22 ILE 60 -6.285 -5.016 -34.311 422 HG23 ILE 60 HG23 ILE 60 -7.844 -5.416 -33.593 423 HD11 ILE 60 HD11 ILE 60 -5.339 -5.184 -36.335 424 HD12 ILE 60 HD12 ILE 60 -5.176 -6.074 -37.849 425 HD13 ILE 60 HD13 ILE 60 -4.615 -6.792 -36.338 426 H ALA 61 H ALA 61 -6.304 -5.955 -32.314 427 HA ALA 61 HA ALA 61 -7.647 -7.850 -30.484 428 HB1 ALA 61 HB1 ALA 61 -5.713 -5.843 -29.401 429 HB2 ALA 61 HB2 ALA 61 -5.087 -7.332 -30.107 430 HB3 ALA 61 HB3 ALA 61 -6.198 -7.405 -28.739 431 HA PRO 62 HA PRO 62 -10.639 -4.625 -29.757 432 HB2 PRO 62 HB2 PRO 62 -10.444 -5.183 -26.836 433 HB3 PRO 62 HB3 PRO 62 -11.861 -5.226 -27.903 434 HG2 PRO 62 HG2 PRO 62 -10.773 -7.464 -27.018 435 HG3 PRO 62 HG3 PRO 62 -11.371 -7.341 -28.684 436 HD2 PRO 62 HD2 PRO 62 -8.534 -7.218 -27.689 437 HD3 PRO 62 HD3 PRO 62 -9.190 -8.037 -29.127 438 H GLU 63 H GLU 63 -10.826 -2.465 -29.056 439 HA GLU 63 HA GLU 63 -8.386 -1.082 -28.588 440 HB2 GLU 63 HB2 GLU 63 -9.797 0.930 -28.458 441 HB3 GLU 63 HB3 GLU 63 -10.262 -0.074 -29.828 442 HG2 GLU 63 HG2 GLU 63 -12.116 -1.028 -28.498 443 HG3 GLU 63 HG3 GLU 63 -11.654 -0.016 -27.131 444 HA PRO 64 HA PRO 64 -8.172 -1.133 -24.156 445 HB2 PRO 64 HB2 PRO 64 -7.049 1.264 -23.537 446 HB3 PRO 64 HB3 PRO 64 -6.147 -0.040 -24.335 447 HG2 PRO 64 HG2 PRO 64 -7.420 2.383 -25.527 448 HG3 PRO 64 HG3 PRO 64 -5.830 1.669 -25.854 449 HD2 PRO 64 HD2 PRO 64 -7.970 1.259 -27.486 450 HD3 PRO 64 HD3 PRO 64 -6.695 0.042 -27.260 451 H GLU 65 H GLU 65 -9.197 -0.498 -22.271 452 HA GLU 65 HA GLU 65 -10.897 1.858 -22.186 453 HB2 GLU 65 HB2 GLU 65 -12.265 0.035 -23.306 454 HB3 GLU 65 HB3 GLU 65 -12.156 -0.863 -21.794 455 HG2 GLU 65 HG2 GLU 65 -13.134 1.996 -21.823 456 HG3 GLU 65 HG3 GLU 65 -14.229 0.662 -22.167 457 H LEU 66 H LEU 66 -10.813 2.670 -20.164 458 HA LEU 66 HA LEU 66 -10.296 0.821 -17.921 459 HB2 LEU 66 HB2 LEU 66 -8.902 3.459 -18.430 460 HB3 LEU 66 HB3 LEU 66 -8.751 2.512 -16.954 461 HG LEU 66 HG LEU 66 -8.087 1.408 -19.701 462 HD11 LEU 66 HD11 LEU 66 -6.638 3.354 -19.097 463 HD12 LEU 66 HD12 LEU 66 -5.746 1.836 -19.167 464 HD13 LEU 66 HD13 LEU 66 -6.196 2.522 -17.606 465 HD21 LEU 66 HD21 LEU 66 -6.752 -0.201 -18.253 466 HD22 LEU 66 HD22 LEU 66 -8.503 -0.338 -18.082 467 HD23 LEU 66 HD23 LEU 66 -7.559 0.501 -16.853 468 HA PRO 67 HA PRO 67 -13.595 2.908 -15.779 469 HB2 PRO 67 HB2 PRO 67 -11.872 3.024 -13.350 470 HB3 PRO 67 HB3 PRO 67 -13.474 2.291 -13.564 471 HG2 PRO 67 HG2 PRO 67 -11.314 0.782 -13.353 472 HG3 PRO 67 HG3 PRO 67 -12.612 0.362 -14.489 473 HD2 PRO 67 HD2 PRO 67 -9.947 1.635 -15.060 474 HD3 PRO 67 HD3 PRO 67 -10.819 0.381 -15.975 475 HA PRO 68 HA PRO 68 -12.832 7.314 -15.925 476 HB2 PRO 68 HB2 PRO 68 -14.492 7.538 -13.442 477 HB3 PRO 68 HB3 PRO 68 -14.649 8.405 -14.984 478 HG2 PRO 68 HG2 PRO 68 -16.329 6.471 -14.389 479 HG3 PRO 68 HG3 PRO 68 -15.680 6.614 -16.033 480 HD2 PRO 68 HD2 PRO 68 -14.903 4.683 -13.866 481 HD3 PRO 68 HD3 PRO 68 -15.072 4.405 -15.615 482 H LEU 69 H LEU 69 -11.422 8.813 -15.055 483 HA LEU 69 HA LEU 69 -9.422 7.963 -13.314 484 HB2 LEU 69 HB2 LEU 69 -9.151 9.811 -14.922 485 HB3 LEU 69 HB3 LEU 69 -10.263 10.800 -13.987 486 HG LEU 69 HG LEU 69 -8.683 10.643 -12.039 487 HD11 LEU 69 HD11 LEU 69 -6.853 9.367 -14.098 488 HD12 LEU 69 HD12 LEU 69 -7.523 8.564 -12.681 489 HD13 LEU 69 HD13 LEU 69 -6.368 9.881 -12.483 490 HD21 LEU 69 HD21 LEU 69 -6.994 12.187 -13.017 491 HD22 LEU 69 HD22 LEU 69 -8.636 12.593 -13.519 492 HD23 LEU 69 HD23 LEU 69 -7.556 11.749 -14.628 493 H GLU 70 H GLU 70 -12.190 10.137 -12.612 494 HA GLU 70 HA GLU 70 -12.510 9.142 -9.973 495 HB2 GLU 70 HB2 GLU 70 -11.801 11.149 -8.700 496 HB3 GLU 70 HB3 GLU 70 -10.447 10.341 -9.489 497 HG2 GLU 70 HG2 GLU 70 -10.586 11.985 -11.354 498 HG3 GLU 70 HG3 GLU 70 -11.890 12.812 -10.504 499 H THR 71 H THR 71 -14.505 9.572 -9.281 500 HA THR 71 HA THR 71 -15.965 11.840 -10.504 501 HB THR 71 HB THR 71 -17.191 9.195 -9.694 502 HG1 THR 71 HG1 THR 71 -17.275 8.955 -12.044 503 HG21 THR 71 HG21 THR 71 -18.253 11.324 -11.556 504 HG22 THR 71 HG22 THR 71 -18.586 11.340 -9.825 505 HG23 THR 71 HG23 THR 71 -19.136 9.988 -10.815 506 H VAL 72 H VAL 72 -16.416 9.505 -7.816 507 HA VAL 72 HA VAL 72 -16.716 11.777 -5.966 508 HB VAL 72 HB VAL 72 -18.648 10.657 -4.890 509 HG11 VAL 72 HG11 VAL 72 -18.852 12.400 -6.748 510 HG12 VAL 72 HG12 VAL 72 -20.271 11.386 -6.478 511 HG13 VAL 72 HG13 VAL 72 -19.196 11.055 -7.836 512 HG21 VAL 72 HG21 VAL 72 -19.815 8.847 -6.143 513 HG22 VAL 72 HG22 VAL 72 -18.213 8.345 -5.603 514 HG23 VAL 72 HG23 VAL 72 -18.475 8.797 -7.288 515 H GLY 73 H GLY 73 -16.525 11.142 -3.685 516 HA2 GLY 73 HA2 GLY 73 -15.714 9.838 -1.928 517 HA3 GLY 73 HA3 GLY 73 -15.343 8.557 -3.078 518 H ASP 74 H ASP 74 -13.424 8.740 -1.411 519 HA ASP 74 HA ASP 74 -11.182 9.785 -2.874 520 HB2 ASP 74 HB2 ASP 74 -12.184 11.743 -1.473 521 HB3 ASP 74 HB3 ASP 74 -11.479 10.897 -0.095 522 H ILE 75 H ILE 75 -9.118 9.371 -1.609 523 HA ILE 75 HA ILE 75 -9.279 6.695 -0.473 524 HB ILE 75 HB ILE 75 -6.868 8.466 -1.034 525 HG12 ILE 75 HG12 ILE 75 -7.840 6.012 -2.536 526 HG13 ILE 75 HG13 ILE 75 -8.288 7.650 -3.003 527 HG21 ILE 75 HG21 ILE 75 -6.292 6.852 0.687 528 HG22 ILE 75 HG22 ILE 75 -5.627 6.262 -0.835 529 HG23 ILE 75 HG23 ILE 75 -7.106 5.555 -0.190 530 HD11 ILE 75 HD11 ILE 75 -6.214 6.546 -4.147 531 HD12 ILE 75 HD12 ILE 75 -5.385 6.917 -2.636 532 HD13 ILE 75 HD13 ILE 75 -6.083 8.219 -3.601 533 H ASP 76 H ASP 76 -8.076 9.893 0.523 534 HA ASP 76 HA ASP 76 -8.893 9.423 3.264 535 HB2 ASP 76 HB2 ASP 76 -6.539 8.385 2.886 536 HB3 ASP 76 HB3 ASP 76 -5.985 10.059 2.857 537 H VAL 77 H VAL 77 -8.255 11.353 4.666 538 HA VAL 77 HA VAL 77 -8.482 13.827 3.061 539 HB VAL 77 HB VAL 77 -9.641 14.805 5.024 540 HG11 VAL 77 HG11 VAL 77 -10.855 13.635 3.141 541 HG12 VAL 77 HG12 VAL 77 -11.742 13.684 4.664 542 HG13 VAL 77 HG13 VAL 77 -10.926 12.202 4.165 543 HG21 VAL 77 HG21 VAL 77 -9.558 11.972 6.120 544 HG22 VAL 77 HG22 VAL 77 -10.379 13.348 6.857 545 HG23 VAL 77 HG23 VAL 77 -8.618 13.324 6.753 546 H TYR 78 H TYR 78 -7.856 15.784 4.678 547 HA TYR 78 HA TYR 78 -5.080 15.207 5.503 548 HB2 TYR 78 HB2 TYR 78 -6.407 17.810 4.699 549 HB3 TYR 78 HB3 TYR 78 -4.744 17.676 5.273 550 HD1 TYR 78 HD1 TYR 78 -7.047 17.035 2.495 551 HD2 TYR 78 HD2 TYR 78 -3.044 16.469 3.944 552 HE1 TYR 78 HE1 TYR 78 -6.305 16.422 0.208 553 HE2 TYR 78 HE2 TYR 78 -2.301 15.857 1.659 554 HH TYR 78 HH TYR 78 -3.364 14.929 -0.429 555 H SER 79 H SER 79 -6.082 14.280 7.473 556 HA SER 79 HA SER 79 -7.461 15.841 9.373 557 HB2 SER 79 HB2 SER 79 -5.794 13.345 9.652 558 HB3 SER 79 HB3 SER 79 -6.612 14.096 11.016 559 HG SER 79 HG SER 79 -8.493 13.510 10.217 560 HA PRO 80 HA PRO 80 -3.066 16.584 11.451 561 HB2 PRO 80 HB2 PRO 80 -1.410 16.846 8.986 562 HB3 PRO 80 HB3 PRO 80 -0.985 16.147 10.562 563 HG2 PRO 80 HG2 PRO 80 -1.433 14.581 8.490 564 HG3 PRO 80 HG3 PRO 80 -2.032 14.140 10.101 565 HD2 PRO 80 HD2 PRO 80 -3.555 15.306 7.783 566 HD3 PRO 80 HD3 PRO 80 -4.032 14.018 8.909 567 HA PRO 81 HA PRO 81 -3.930 20.949 10.701 568 HB2 PRO 81 HB2 PRO 81 -1.340 21.491 12.084 569 HB3 PRO 81 HB3 PRO 81 -2.959 22.116 12.439 570 HG2 PRO 81 HG2 PRO 81 -1.875 20.284 13.985 571 HG3 PRO 81 HG3 PRO 81 -3.594 20.189 13.553 572 HD2 PRO 81 HD2 PRO 81 -1.281 18.625 12.425 573 HD3 PRO 81 HD3 PRO 81 -2.911 18.065 12.868 574 H GLU 82 H GLU 82 -0.845 19.535 9.872 575 HA GLU 82 HA GLU 82 0.887 20.246 8.488 576 HB2 GLU 82 HB2 GLU 82 0.088 20.094 6.147 577 HB3 GLU 82 HB3 GLU 82 -0.548 18.810 7.171 578 HG2 GLU 82 HG2 GLU 82 -2.662 20.066 7.430 579 HG3 GLU 82 HG3 GLU 82 -2.032 21.348 6.406 580 HA PRO 83 HA PRO 83 -0.181 24.875 8.192 581 HB2 PRO 83 HB2 PRO 83 1.715 25.831 9.918 582 HB3 PRO 83 HB3 PRO 83 0.073 25.394 10.428 583 HG2 PRO 83 HG2 PRO 83 2.605 23.844 10.674 584 HG3 PRO 83 HG3 PRO 83 1.281 24.035 11.836 585 HD2 PRO 83 HD2 PRO 83 1.559 21.803 10.290 586 HD3 PRO 83 HD3 PRO 83 -0.022 22.410 10.823 587 H GLU 84 H GLU 84 2.967 23.331 8.675 588 HA GLU 84 HA GLU 84 3.907 24.242 6.078 589 HB2 GLU 84 HB2 GLU 84 5.941 25.323 6.973 590 HB3 GLU 84 HB3 GLU 84 4.476 26.167 7.471 591 HG2 GLU 84 HG2 GLU 84 4.555 24.985 9.655 592 HG3 GLU 84 HG3 GLU 84 6.047 24.191 9.156 593 H SER 85 H SER 85 5.880 23.228 5.395 594 HA SER 85 HA SER 85 7.041 21.124 7.017 595 HB2 SER 85 HB2 SER 85 6.498 19.320 5.491 596 HB3 SER 85 HB3 SER 85 4.996 20.074 6.018 597 HG SER 85 HG SER 85 4.762 20.994 4.073 598 H GLU 86 H GLU 86 8.745 19.922 5.569 599 HA GLU 86 HA GLU 86 9.902 21.827 3.628 600 HB2 GLU 86 HB2 GLU 86 11.049 21.946 5.864 601 HB3 GLU 86 HB3 GLU 86 11.494 20.251 5.665 602 HG2 GLU 86 HG2 GLU 86 12.674 20.806 3.567 603 HG3 GLU 86 HG3 GLU 86 12.238 22.501 3.774 604 HA PRO 87 HA PRO 87 9.622 17.528 1.819 605 HB2 PRO 87 HB2 PRO 87 8.561 18.199 -0.581 606 HB3 PRO 87 HB3 PRO 87 7.557 17.989 0.870 607 HG2 PRO 87 HG2 PRO 87 8.575 20.503 -0.376 608 HG3 PRO 87 HG3 PRO 87 6.962 20.137 0.258 609 HD2 PRO 87 HD2 PRO 87 8.810 21.550 1.685 610 HD3 PRO 87 HD3 PRO 87 7.588 20.514 2.456 611 H ALA 88 H ALA 88 10.870 16.583 0.129 612 HA ALA 88 HA ALA 88 13.345 17.855 -0.427 613 HB1 ALA 88 HB1 ALA 88 13.664 15.895 -1.996 614 HB2 ALA 88 HB2 ALA 88 12.033 15.380 -1.564 615 HB3 ALA 88 HB3 ALA 88 13.289 15.462 -0.329 616 H TYR 89 H TYR 89 14.166 18.690 -2.372 617 HA TYR 89 HA TYR 89 12.491 20.311 -3.892 618 HB2 TYR 89 HB2 TYR 89 14.384 20.527 -5.475 619 HB3 TYR 89 HB3 TYR 89 14.897 20.695 -3.800 620 HD1 TYR 89 HD1 TYR 89 14.957 18.530 -6.783 621 HD2 TYR 89 HD2 TYR 89 16.251 18.976 -2.711 622 HE1 TYR 89 HE1 TYR 89 16.575 16.675 -7.094 623 HE2 TYR 89 HE2 TYR 89 17.866 17.122 -3.020 624 HH TYR 89 HH TYR 89 17.810 15.077 -5.796 625 H THR 90 H THR 90 11.256 20.057 -5.646 626 HA THR 90 HA THR 90 11.321 17.452 -7.053 627 HB THR 90 HB THR 90 8.896 19.117 -6.298 628 HG1 THR 90 HG1 THR 90 9.504 18.059 -4.515 629 HG21 THR 90 HG21 THR 90 8.678 17.864 -8.459 630 HG22 THR 90 HG22 THR 90 7.570 17.296 -7.212 631 HG23 THR 90 HG23 THR 90 9.026 16.374 -7.582 632 HA PRO 91 HA PRO 91 11.829 19.895 -10.786 633 HB2 PRO 91 HB2 PRO 91 9.997 17.972 -12.138 634 HB3 PRO 91 HB3 PRO 91 11.652 18.445 -12.565 635 HG2 PRO 91 HG2 PRO 91 11.171 16.078 -11.507 636 HG3 PRO 91 HG3 PRO 91 12.602 17.009 -11.026 637 HD2 PRO 91 HD2 PRO 91 10.011 16.646 -9.551 638 HD3 PRO 91 HD3 PRO 91 11.672 16.639 -8.920 639 HA PRO 92 HA PRO 92 8.253 22.544 -11.042 640 HB2 PRO 92 HB2 PRO 92 8.347 23.463 -13.633 641 HB3 PRO 92 HB3 PRO 92 9.414 24.049 -12.344 642 HG2 PRO 92 HG2 PRO 92 9.951 22.025 -14.466 643 HG3 PRO 92 HG3 PRO 92 10.990 23.330 -13.863 644 HD2 PRO 92 HD2 PRO 92 11.344 20.772 -13.070 645 HD3 PRO 92 HD3 PRO 92 11.621 22.135 -11.963 646 HA PRO 93 HA PRO 93 4.829 20.185 -12.617 647 HB2 PRO 93 HB2 PRO 93 3.068 22.139 -13.488 648 HB3 PRO 93 HB3 PRO 93 3.279 21.653 -11.795 649 HG2 PRO 93 HG2 PRO 93 4.442 23.977 -13.255 650 HG3 PRO 93 HG3 PRO 93 3.776 23.891 -11.614 651 HD2 PRO 93 HD2 PRO 93 6.437 23.898 -12.031 652 HD3 PRO 93 HD3 PRO 93 5.710 22.927 -10.730 653 H ALA 94 H ALA 94 6.201 22.638 -14.729 654 HA ALA 94 HA ALA 94 5.735 20.867 -17.024 655 HB1 ALA 94 HB1 ALA 94 3.933 22.396 -17.300 656 HB2 ALA 94 HB2 ALA 94 5.196 22.947 -18.400 657 HB3 ALA 94 HB3 ALA 94 4.941 23.774 -16.865 658 H ALA 95 H ALA 95 7.502 20.555 -18.134 659 HA ALA 95 HA ALA 95 9.481 22.640 -18.527 660 HB1 ALA 95 HB1 ALA 95 11.086 20.520 -17.676 661 HB2 ALA 95 HB2 ALA 95 9.769 20.560 -16.499 662 HB3 ALA 95 HB3 ALA 95 10.751 22.000 -16.777 663 HA PRO 96 HA PRO 96 10.043 20.582 -22.430 664 HB2 PRO 96 HB2 PRO 96 12.989 20.486 -21.925 665 HB3 PRO 96 HB3 PRO 96 12.104 21.134 -23.322 666 HG2 PRO 96 HG2 PRO 96 13.168 22.774 -21.560 667 HG3 PRO 96 HG3 PRO 96 11.553 23.100 -22.222 668 HD2 PRO 96 HD2 PRO 96 12.294 21.984 -19.528 669 HD3 PRO 96 HD3 PRO 96 11.020 23.152 -19.952 670 H VAL 97 H VAL 97 9.727 18.500 -22.956 671 HA VAL 97 HA VAL 97 11.366 16.395 -21.735 672 HB VAL 97 HB VAL 97 9.345 15.003 -21.304 673 HG11 VAL 97 HG11 VAL 97 8.594 16.308 -19.289 674 HG12 VAL 97 HG12 VAL 97 9.531 17.675 -19.889 675 HG13 VAL 97 HG13 VAL 97 10.346 16.177 -19.440 676 HG21 VAL 97 HG21 VAL 97 7.137 16.037 -21.281 677 HG22 VAL 97 HG22 VAL 97 7.837 16.247 -22.886 678 HG23 VAL 97 HG23 VAL 97 7.821 17.594 -21.750 679 H PHE 98 H PHE 98 11.237 14.339 -22.882 680 HA PHE 98 HA PHE 98 11.360 14.657 -25.697 681 HB2 PHE 98 HB2 PHE 98 11.242 12.201 -23.936 682 HB3 PHE 98 HB3 PHE 98 11.450 12.124 -25.687 683 HD1 PHE 98 HD1 PHE 98 13.004 13.061 -22.493 684 HD2 PHE 98 HD2 PHE 98 13.485 12.984 -26.762 685 HE1 PHE 98 HE1 PHE 98 15.431 13.498 -22.228 686 HE2 PHE 98 HE2 PHE 98 15.912 13.422 -26.495 687 HZ PHE 98 HZ PHE 98 16.886 13.679 -24.229 688 H ASP 99 H ASP 99 8.892 13.299 -23.540 689 HA ASP 99 HA ASP 99 6.932 13.503 -25.738 690 HB2 ASP 99 HB2 ASP 99 7.138 11.215 -23.763 691 HB3 ASP 99 HB3 ASP 99 5.891 11.411 -24.992 692 H ARG 100 H ARG 100 4.743 13.811 -25.003 693 HA ARG 100 HA ARG 100 4.318 15.769 -23.137 694 HB2 ARG 100 HB2 ARG 100 2.438 13.535 -23.932 695 HB3 ARG 100 HB3 ARG 100 1.943 14.933 -22.978 696 HG2 ARG 100 HG2 ARG 100 2.664 16.442 -24.780 697 HG3 ARG 100 HG3 ARG 100 3.201 15.059 -25.734 698 HD2 ARG 100 HD2 ARG 100 0.987 15.754 -26.492 699 HD3 ARG 100 HD3 ARG 100 0.875 14.179 -25.718 700 HE ARG 100 HE ARG 100 -0.384 15.146 -24.012 701 HH11 ARG 100 HH11 ARG 100 1.067 17.667 -25.965 702 HH12 ARG 100 HH12 ARG 100 0.148 18.932 -25.218 703 HH21 ARG 100 HH21 ARG 100 -1.558 16.820 -23.072 704 HH22 ARG 100 HH22 ARG 100 -1.327 18.454 -23.595 705 H ASP 101 H ASP 101 3.387 12.375 -22.385 706 HA ASP 101 HA ASP 101 3.216 11.294 -20.357 707 HB2 ASP 101 HB2 ASP 101 5.712 11.378 -21.043 708 HB3 ASP 101 HB3 ASP 101 5.878 12.581 -19.770 709 H GLU 102 H GLU 102 1.776 13.691 -20.214 710 HA GLU 102 HA GLU 102 2.481 15.403 -18.089 711 HB2 GLU 102 HB2 GLU 102 -0.205 14.641 -19.248 712 HB3 GLU 102 HB3 GLU 102 -0.007 15.879 -18.007 713 HG2 GLU 102 HG2 GLU 102 1.423 17.193 -19.450 714 HG3 GLU 102 HG3 GLU 102 1.477 15.907 -20.649 715 H VAL 103 H VAL 103 0.413 12.489 -18.126 716 HA VAL 103 HA VAL 103 1.221 11.632 -15.553 717 HB VAL 103 HB VAL 103 -0.143 13.558 -14.813 718 HG11 VAL 103 HG11 VAL 103 -2.478 13.748 -15.288 719 HG12 VAL 103 HG12 VAL 103 -2.527 12.149 -16.030 720 HG13 VAL 103 HG13 VAL 103 -1.685 13.469 -16.837 721 HG21 VAL 103 HG21 VAL 103 -1.521 10.911 -14.255 722 HG22 VAL 103 HG22 VAL 103 -1.570 12.352 -13.237 723 HG23 VAL 103 HG23 VAL 103 -0.056 11.469 -13.448 724 H ALA 104 H ALA 104 0.862 9.471 -15.466 725 HA ALA 104 HA ALA 104 -1.421 8.332 -16.907 726 HB1 ALA 104 HB1 ALA 104 0.270 8.276 -18.606 727 HB2 ALA 104 HB2 ALA 104 0.091 6.635 -17.985 728 HB3 ALA 104 HB3 ALA 104 1.461 7.624 -17.479 729 H GLU 105 H GLU 105 -2.216 7.829 -14.837 730 HA GLU 105 HA GLU 105 -0.778 6.263 -12.928 731 HB2 GLU 105 HB2 GLU 105 -3.623 7.103 -13.306 732 HB3 GLU 105 HB3 GLU 105 -3.337 5.702 -12.281 733 HG2 GLU 105 HG2 GLU 105 -3.179 7.373 -10.689 734 HG3 GLU 105 HG3 GLU 105 -1.494 7.308 -11.201 735 H GLN 106 H GLN 106 -0.151 4.232 -13.178 736 HA GLN 106 HA GLN 106 -1.927 2.331 -14.578 737 HB2 GLN 106 HB2 GLN 106 1.058 2.586 -15.029 738 HB3 GLN 106 HB3 GLN 106 0.036 1.313 -15.687 739 HG2 GLN 106 HG2 GLN 106 -0.329 4.276 -16.230 740 HG3 GLN 106 HG3 GLN 106 0.454 3.141 -17.327 741 HE21 GLN 106 HE21 GLN 106 -1.114 1.009 -17.584 742 HE22 GLN 106 HE22 GLN 106 -2.718 1.407 -17.975 743 H LEU 107 H LEU 107 -2.045 0.333 -13.698 744 HA LEU 107 HA LEU 107 -0.250 -0.289 -11.428 745 HB2 LEU 107 HB2 LEU 107 -2.740 0.337 -10.935 746 HB3 LEU 107 HB3 LEU 107 -3.095 -1.273 -11.559 747 HG LEU 107 HG LEU 107 -0.940 -0.954 -9.467 748 HD11 LEU 107 HD11 LEU 107 -3.923 -0.841 -9.006 749 HD12 LEU 107 HD12 LEU 107 -2.671 0.215 -8.357 750 HD13 LEU 107 HD13 LEU 107 -2.819 -1.439 -7.766 751 HD21 LEU 107 HD21 LEU 107 -1.940 -3.225 -8.822 752 HD22 LEU 107 HD22 LEU 107 -1.130 -3.153 -10.385 753 HD23 LEU 107 HD23 LEU 107 -2.892 -3.115 -10.303 754 H VAL 108 H VAL 108 -2.359 -1.614 -13.959 755 HA VAL 108 HA VAL 108 -0.641 -4.028 -14.022 756 HB VAL 108 HB VAL 108 -2.903 -4.531 -13.165 757 HG11 VAL 108 HG11 VAL 108 -3.971 -3.696 -15.868 758 HG12 VAL 108 HG12 VAL 108 -3.997 -2.625 -14.468 759 HG13 VAL 108 HG13 VAL 108 -4.886 -4.148 -14.429 760 HG21 VAL 108 HG21 VAL 108 -2.697 -5.593 -15.989 761 HG22 VAL 108 HG22 VAL 108 -3.321 -6.413 -14.558 762 HG23 VAL 108 HG23 VAL 108 -1.592 -6.106 -14.715 763 H GLY 109 H GLY 109 0.423 -4.326 -15.860 764 HA2 GLY 109 HA2 GLY 109 0.900 -4.355 -18.135 765 HA3 GLY 109 HA3 GLY 109 -0.675 -3.624 -18.443 766 H VAL 110 H VAL 110 1.193 -2.581 -19.970 767 HA VAL 110 HA VAL 110 1.750 0.042 -18.746 768 HB VAL 110 HB VAL 110 3.929 0.128 -19.928 769 HG11 VAL 110 HG11 VAL 110 5.128 -1.314 -18.384 770 HG12 VAL 110 HG12 VAL 110 3.684 -2.294 -18.122 771 HG13 VAL 110 HG13 VAL 110 3.733 -0.627 -17.548 772 HG21 VAL 110 HG21 VAL 110 3.312 -2.783 -20.543 773 HG22 VAL 110 HG22 VAL 110 4.888 -2.024 -20.771 774 HG23 VAL 110 HG23 VAL 110 3.504 -1.485 -21.722 775 H SER 111 H SER 111 1.957 1.784 -20.304 776 HA SER 111 HA SER 111 0.738 1.201 -22.933 777 HB2 SER 111 HB2 SER 111 0.050 3.493 -21.079 778 HB3 SER 111 HB3 SER 111 -0.544 3.309 -22.725 779 HG SER 111 HG SER 111 -1.776 1.661 -22.114 780 H ALA 112 H ALA 112 1.417 2.500 -24.638 781 HA ALA 112 HA ALA 112 3.423 4.574 -24.122 782 HB1 ALA 112 HB1 ALA 112 4.956 2.844 -24.398 783 HB2 ALA 112 HB2 ALA 112 4.786 3.438 -26.050 784 HB3 ALA 112 HB3 ALA 112 3.930 1.983 -25.544 785 H ALA 113 H ALA 113 3.670 6.050 -25.808 786 HA ALA 113 HA ALA 113 2.146 5.715 -28.269 787 HB1 ALA 113 HB1 ALA 113 1.581 8.106 -26.513 788 HB2 ALA 113 HB2 ALA 113 0.572 6.660 -26.500 789 HB3 ALA 113 HB3 ALA 113 0.736 7.607 -27.978 790 H SER 114 H SER 114 2.683 7.277 -29.876 791 HA SER 114 HA SER 114 4.850 9.153 -29.291 792 HB2 SER 114 HB2 SER 114 6.025 7.081 -29.863 793 HB3 SER 114 HB3 SER 114 5.094 6.950 -31.352 794 HG SER 114 HG SER 114 6.977 8.932 -30.606 795 H ALA 115 H ALA 115 4.953 10.870 -30.704 796 HA ALA 115 HA ALA 115 3.409 10.891 -33.158 797 HB1 ALA 115 HB1 ALA 115 1.557 11.558 -31.948 798 HB2 ALA 115 HB2 ALA 115 2.318 13.124 -32.226 799 HB3 ALA 115 HB3 ALA 115 2.524 12.306 -30.677 800 H ALA 116 H ALA 116 3.987 12.610 -34.521 801 HA ALA 116 HA ALA 116 5.952 14.535 -33.550 802 HB1 ALA 116 HB1 ALA 116 6.582 12.933 -36.024 803 HB2 ALA 116 HB2 ALA 116 7.111 12.398 -34.427 804 HB3 ALA 116 HB3 ALA 116 7.659 13.948 -35.065 805 H ALA 117 H ALA 117 4.785 16.301 -34.049 806 HA ALA 117 HA ALA 117 3.403 16.473 -36.617 807 HB1 ALA 117 HB1 ALA 117 3.484 18.646 -34.540 808 HB2 ALA 117 HB2 ALA 117 2.465 17.220 -34.322 809 HB3 ALA 117 HB3 ALA 117 2.218 18.279 -35.711 810 H SER 118 H SER 118 3.903 17.945 -38.218 811 HA SER 118 HA SER 118 6.427 19.459 -37.891 812 HB2 SER 118 HB2 SER 118 6.936 18.961 -40.246 813 HB3 SER 118 HB3 SER 118 6.807 17.489 -39.287 814 HG SER 118 HG SER 118 5.151 16.921 -40.445 815 H ALA 119 H ALA 119 3.271 20.002 -38.022 816 HA ALA 119 HA ALA 119 3.024 21.808 -40.235 817 HB1 ALA 119 HB1 ALA 119 1.075 20.641 -39.280 818 HB2 ALA 119 HB2 ALA 119 0.866 22.391 -39.231 819 HB3 ALA 119 HB3 ALA 119 1.302 21.513 -37.764 820 H PHE 120 H PHE 120 3.181 24.015 -40.275 821 HA PHE 120 HA PHE 120 3.449 25.590 -37.889 822 HB2 PHE 120 HB2 PHE 120 5.731 26.426 -38.318 823 HB3 PHE 120 HB3 PHE 120 5.726 24.700 -37.957 824 HD1 PHE 120 HD1 PHE 120 6.180 27.246 -40.588 825 HD2 PHE 120 HD2 PHE 120 6.237 23.052 -39.680 826 HE1 PHE 120 HE1 PHE 120 7.326 26.796 -42.742 827 HE2 PHE 120 HE2 PHE 120 7.378 22.598 -41.834 828 HZ PHE 120 HZ PHE 120 7.925 24.471 -43.365 829 H GLY 121 H GLY 121 3.578 27.879 -38.324 830 HA2 GLY 121 HA2 GLY 121 3.149 28.706 -41.114 831 HA3 GLY 121 HA3 GLY 121 1.905 29.082 -39.922 832 H SER 122 H SER 122 2.922 31.201 -41.153 833 HA SER 122 HA SER 122 5.287 32.341 -40.122 834 HB2 SER 122 HB2 SER 122 4.152 33.233 -42.106 835 HB3 SER 122 HB3 SER 122 2.777 33.714 -41.118 836 HG SER 122 HG SER 122 3.855 35.404 -40.500 837 H LEU 123 H LEU 123 1.902 32.634 -39.091 838 HA LEU 123 HA LEU 123 2.701 33.065 -36.342 839 HB2 LEU 123 HB2 LEU 123 2.849 35.353 -37.352 840 HB3 LEU 123 HB3 LEU 123 1.145 35.235 -37.777 841 HG LEU 123 HG LEU 123 0.637 34.871 -35.331 842 HD11 LEU 123 HD11 LEU 123 2.744 34.096 -34.478 843 HD12 LEU 123 HD12 LEU 123 2.462 35.680 -33.752 844 HD13 LEU 123 HD13 LEU 123 3.588 35.515 -35.100 845 HD21 LEU 123 HD21 LEU 123 0.351 37.074 -36.346 846 HD22 LEU 123 HD22 LEU 123 2.062 37.430 -36.114 847 HD23 LEU 123 HD23 LEU 123 1.000 37.261 -34.716 848 H SER 124 H SER 124 1.365 31.740 -35.280 849 HA SER 124 HA SER 124 -1.486 31.966 -35.514 850 HB2 SER 124 HB2 SER 124 -1.914 29.660 -36.259 851 HB3 SER 124 HB3 SER 124 -1.059 30.584 -37.491 852 HG SER 124 HG SER 124 -0.293 28.363 -36.135 853 H SER 125 H SER 125 0.964 31.746 -33.580 854 HA SER 125 HA SER 125 -0.386 30.850 -31.338 855 HB2 SER 125 HB2 SER 125 -0.359 28.590 -32.112 856 HB3 SER 125 HB3 SER 125 1.326 28.705 -32.604 857 HG SER 125 HG SER 125 1.859 28.199 -30.644 858 H ALA 126 H ALA 126 2.951 30.109 -32.394 859 HA ALA 126 HA ALA 126 4.136 32.355 -31.106 860 HB1 ALA 126 HB1 ALA 126 4.115 31.602 -28.979 861 HB2 ALA 126 HB2 ALA 126 5.336 30.435 -29.499 862 HB3 ALA 126 HB3 ALA 126 3.630 29.978 -29.472 863 H LEU 127 H LEU 127 6.594 31.888 -30.785 864 HA LEU 127 HA LEU 127 7.592 29.969 -32.757 865 HB2 LEU 127 HB2 LEU 127 9.087 31.665 -33.760 866 HB3 LEU 127 HB3 LEU 127 7.387 32.045 -34.009 867 HG LEU 127 HG LEU 127 7.803 33.395 -31.667 868 HD11 LEU 127 HD11 LEU 127 10.267 32.702 -31.783 869 HD12 LEU 127 HD12 LEU 127 9.958 34.424 -31.589 870 HD13 LEU 127 HD13 LEU 127 10.404 33.780 -33.169 871 HD21 LEU 127 HD21 LEU 127 8.492 34.461 -34.426 872 HD22 LEU 127 HD22 LEU 127 8.030 35.431 -33.027 873 HD23 LEU 127 HD23 LEU 127 6.864 34.331 -33.762 874 H LEU 128 H LEU 128 9.478 29.026 -32.201 875 HA LEU 128 HA LEU 128 10.848 30.028 -29.768 876 HB2 LEU 128 HB2 LEU 128 9.912 27.291 -30.534 877 HB3 LEU 128 HB3 LEU 128 11.441 27.409 -29.667 878 HG LEU 128 HG LEU 128 10.187 28.881 -27.971 879 HD11 LEU 128 HD11 LEU 128 7.893 27.790 -29.614 880 HD12 LEU 128 HD12 LEU 128 8.197 29.459 -29.135 881 HD13 LEU 128 HD13 LEU 128 7.679 28.278 -27.933 882 HD21 LEU 128 HD21 LEU 128 9.114 26.833 -26.906 883 HD22 LEU 128 HD22 LEU 128 10.807 26.639 -27.363 884 HD23 LEU 128 HD23 LEU 128 9.535 25.949 -28.372 885 H MET 129 H MET 129 13.020 30.154 -29.802 886 HA MET 129 HA MET 129 14.378 30.060 -32.327 887 HB2 MET 129 HB2 MET 129 15.341 30.550 -29.501 888 HB3 MET 129 HB3 MET 129 16.410 30.582 -30.903 889 HG2 MET 129 HG2 MET 129 15.784 32.843 -30.604 890 HG3 MET 129 HG3 MET 129 14.737 32.280 -31.905 891 HE1 MET 129 HE1 MET 129 14.150 34.727 -30.794 892 HE2 MET 129 HE2 MET 129 12.606 34.823 -29.954 893 HE3 MET 129 HE3 MET 129 12.683 34.093 -31.554 894 HA PRO 130 HA PRO 130 15.915 25.891 -32.445 895 HB2 PRO 130 HB2 PRO 130 18.670 27.009 -32.774 896 HB3 PRO 130 HB3 PRO 130 17.812 25.820 -33.772 897 HG2 PRO 130 HG2 PRO 130 18.103 28.291 -34.628 898 HG3 PRO 130 HG3 PRO 130 16.559 27.446 -34.853 899 HD2 PRO 130 HD2 PRO 130 17.273 29.558 -32.836 900 HD3 PRO 130 HD3 PRO 130 15.764 29.343 -33.755 901 H LYS 131 H LYS 131 16.600 24.392 -30.971 902 HA LYS 131 HA LYS 131 18.077 25.371 -28.599 903 HB2 LYS 131 HB2 LYS 131 15.650 24.716 -28.258 904 HB3 LYS 131 HB3 LYS 131 16.114 23.070 -28.677 905 HG2 LYS 131 HG2 LYS 131 16.187 23.176 -26.291 906 HG3 LYS 131 HG3 LYS 131 17.864 23.233 -26.823 907 HD2 LYS 131 HD2 LYS 131 17.917 25.657 -26.554 908 HD3 LYS 131 HD3 LYS 131 16.202 25.675 -26.143 909 HE2 LYS 131 HE2 LYS 131 16.667 24.282 -24.155 910 HE3 LYS 131 HE3 LYS 131 18.382 24.277 -24.564 911 HZ1 LYS 131 HZ1 LYS 131 16.718 26.625 -23.846 912 HZ2 LYS 131 HZ2 LYS 131 18.304 26.741 -24.443 913 HZ3 LYS 131 HZ3 LYS 131 18.005 25.971 -22.958 914 H ASP 132 H ASP 132 19.927 24.365 -28.096 915 HA ASP 132 HA ASP 132 20.723 22.018 -29.694 916 HB2 ASP 132 HB2 ASP 132 23.021 22.645 -29.144 917 HB3 ASP 132 HB3 ASP 132 22.165 24.007 -29.856 918 H GLY 133 H GLY 133 18.991 21.819 -27.349 919 HA2 GLY 133 HA2 GLY 133 20.603 20.706 -25.206 920 HA3 GLY 133 HA3 GLY 133 18.845 20.828 -25.241 921 H LEU 134 H LEU 134 21.601 19.043 -26.504 922 HA LEU 134 HA LEU 134 19.845 16.720 -27.022 923 HB2 LEU 134 HB2 LEU 134 22.415 17.601 -28.344 924 HB3 LEU 134 HB3 LEU 134 21.696 16.010 -28.596 925 HG LEU 134 HG LEU 134 20.197 18.603 -29.075 926 HD11 LEU 134 HD11 LEU 134 20.696 18.319 -31.445 927 HD12 LEU 134 HD12 LEU 134 21.600 16.842 -31.109 928 HD13 LEU 134 HD13 LEU 134 22.211 18.396 -30.548 929 HD21 LEU 134 HD21 LEU 134 18.712 16.716 -28.795 930 HD22 LEU 134 HD22 LEU 134 19.726 15.697 -29.818 931 HD23 LEU 134 HD23 LEU 134 18.817 17.033 -30.527 932 H GLU 135 H GLU 135 20.653 14.638 -26.453 933 HA GLU 135 HA GLU 135 22.079 14.588 -23.971 934 HB2 GLU 135 HB2 GLU 135 21.087 12.419 -25.832 935 HB3 GLU 135 HB3 GLU 135 21.873 12.089 -24.288 936 HG2 GLU 135 HG2 GLU 135 20.159 13.276 -23.075 937 HG3 GLU 135 HG3 GLU 135 19.448 13.882 -24.565 938 H HIS 136 H HIS 136 24.182 14.192 -23.571 939 HA HIS 136 HA HIS 136 26.049 14.217 -25.773 940 HB2 HIS 136 HB2 HIS 136 26.443 15.474 -23.668 941 HB3 HIS 136 HB3 HIS 136 26.551 13.947 -22.796 942 HD2 HIS 136 HD2 HIS 136 29.116 12.910 -22.745 943 HE1 HIS 136 HE1 HIS 136 30.731 15.157 -25.933 944 HE2 HIS 136 HE2 HIS 136 31.267 13.466 -24.116 945 H HIS 137 H HIS 137 25.502 11.962 -23.040 946 HA HIS 137 HA HIS 137 25.866 9.652 -24.724 947 HB2 HIS 137 HB2 HIS 137 28.223 10.488 -24.289 948 HB3 HIS 137 HB3 HIS 137 27.955 10.115 -22.586 949 HD2 HIS 137 HD2 HIS 137 28.781 8.265 -25.897 950 HE1 HIS 137 HE1 HIS 137 28.182 5.313 -22.941 951 HE2 HIS 137 HE2 HIS 137 28.984 5.728 -25.314 952 H HIS 138 H HIS 138 25.332 7.700 -23.679 953 HA HIS 138 HA HIS 138 24.074 8.030 -21.016 954 HB2 HIS 138 HB2 HIS 138 23.300 6.225 -23.319 955 HB3 HIS 138 HB3 HIS 138 22.575 6.153 -21.714 956 HD2 HIS 138 HD2 HIS 138 20.673 8.151 -21.193 957 HE1 HIS 138 HE1 HIS 138 21.135 10.247 -24.829 958 HE2 HIS 138 HE2 HIS 138 19.749 10.066 -22.708 959 H HIS 139 H HIS 139 24.633 6.659 -19.417 960 HA HIS 139 HA HIS 139 26.632 4.570 -20.044 961 HB2 HIS 139 HB2 HIS 139 27.328 6.469 -18.533 962 HB3 HIS 139 HB3 HIS 139 26.129 5.899 -17.373 963 HD2 HIS 139 HD2 HIS 139 29.703 4.970 -18.596 964 HE1 HIS 139 HE1 HIS 139 28.515 2.009 -15.833 965 HE2 HIS 139 HE2 HIS 139 30.465 2.911 -17.185 966 H HIS 140 H HIS 140 25.914 2.555 -19.954 967 HA HIS 140 HA HIS 140 23.453 1.935 -18.480 968 HB2 HIS 140 HB2 HIS 140 23.775 1.241 -20.888 969 HB3 HIS 140 HB3 HIS 140 25.045 0.149 -20.335 970 HD2 HIS 140 HD2 HIS 140 21.158 0.334 -20.431 971 HE1 HIS 140 HE1 HIS 140 22.203 -3.214 -18.393 972 HE2 HIS 140 HE2 HIS 140 20.282 -1.911 -19.426 973 H HIS 141 H HIS 141 23.796 1.473 -16.396 974 HA HIS 141 HA HIS 141 24.657 0.556 -14.476 975 HB2 HIS 141 HB2 HIS 141 25.176 -1.593 -16.528 976 HB3 HIS 141 HB3 HIS 141 25.656 -1.808 -14.847 977 HD2 HIS 141 HD2 HIS 141 23.565 -2.500 -13.134 978 HE1 HIS 141 HE1 HIS 141 20.401 -1.906 -15.862 979 HE2 HIS 141 HE2 HIS 141 20.998 -2.755 -13.547 Start of MODEL 11 1 H1 MET 1 HT1 MET 1 -0.673 12.165 -8.910 2 H2 MET 1 HT2 MET 1 -1.057 10.954 -10.039 3 H3 MET 1 HT3 MET 1 -1.079 10.605 -8.376 4 HA MET 1 HA MET 1 -3.033 12.027 -10.015 5 HB2 MET 1 HB2 MET 1 -2.999 10.009 -7.772 6 HB3 MET 1 HB3 MET 1 -4.478 10.895 -8.142 7 HG2 MET 1 HG2 MET 1 -2.895 9.265 -10.155 8 HG3 MET 1 HG3 MET 1 -4.345 8.700 -9.328 9 HE1 MET 1 HE1 MET 1 -6.495 9.642 -9.371 10 HE2 MET 1 HE2 MET 1 -7.211 10.684 -10.598 11 HE3 MET 1 HE3 MET 1 -6.261 11.393 -9.296 12 H SER 2 H SER 2 -1.644 12.049 -6.742 13 HA SER 2 HA SER 2 -2.946 14.671 -6.276 14 HB2 SER 2 HB2 SER 2 -2.883 14.146 -3.887 15 HB3 SER 2 HB3 SER 2 -3.752 12.889 -4.760 16 HG SER 2 HG SER 2 -2.303 11.532 -4.098 17 H ASP 3 H ASP 3 -1.729 16.260 -5.142 18 HA ASP 3 HA ASP 3 1.115 16.149 -5.754 19 HB2 ASP 3 HB2 ASP 3 -0.271 18.156 -6.284 20 HB3 ASP 3 HB3 ASP 3 -0.499 18.410 -4.554 21 H GLN 4 H GLN 4 1.305 14.365 -4.098 22 HA GLN 4 HA GLN 4 1.620 15.432 -1.358 23 HB2 GLN 4 HB2 GLN 4 0.129 13.424 -1.710 24 HB3 GLN 4 HB3 GLN 4 1.565 12.530 -2.213 25 HG2 GLN 4 HG2 GLN 4 2.623 12.963 -0.044 26 HG3 GLN 4 HG3 GLN 4 1.233 13.921 0.462 27 HE21 GLN 4 HE21 GLN 4 2.401 11.221 1.451 28 HE22 GLN 4 HE22 GLN 4 1.049 10.193 1.479 29 H SER 5 H SER 5 3.179 13.492 -3.868 30 HA SER 5 HA SER 5 5.815 14.400 -3.020 31 HB2 SER 5 HB2 SER 5 5.458 12.378 -1.650 32 HB3 SER 5 HB3 SER 5 5.101 11.457 -3.105 33 HG SER 5 HG SER 5 7.160 11.327 -3.489 34 H GLN 6 H GLN 6 7.406 14.145 -4.689 35 HA GLN 6 HA GLN 6 6.357 14.207 -7.334 36 HB2 GLN 6 HB2 GLN 6 8.711 14.372 -8.032 37 HB3 GLN 6 HB3 GLN 6 8.362 15.475 -6.705 38 HG2 GLN 6 HG2 GLN 6 9.308 13.826 -5.108 39 HG3 GLN 6 HG3 GLN 6 9.700 12.763 -6.457 40 HE21 GLN 6 HE21 GLN 6 11.127 14.965 -4.441 41 HE22 GLN 6 HE22 GLN 6 12.348 15.544 -5.473 42 H GLU 7 H GLU 7 7.759 11.696 -5.340 43 HA GLU 7 HA GLU 7 8.233 9.817 -7.457 44 HB2 GLU 7 HB2 GLU 7 7.963 9.448 -4.461 45 HB3 GLU 7 HB3 GLU 7 8.454 8.179 -5.581 46 HG2 GLU 7 HG2 GLU 7 9.899 10.820 -5.208 47 HG3 GLU 7 HG3 GLU 7 10.405 9.288 -4.507 48 HA PRO 8 HA PRO 8 4.032 8.373 -7.856 49 HB2 PRO 8 HB2 PRO 8 4.369 5.855 -8.822 50 HB3 PRO 8 HB3 PRO 8 4.701 7.304 -9.796 51 HG2 PRO 8 HG2 PRO 8 6.597 5.515 -8.353 52 HG3 PRO 8 HG3 PRO 8 6.746 6.268 -9.948 53 HD2 PRO 8 HD2 PRO 8 7.973 7.252 -7.697 54 HD3 PRO 8 HD3 PRO 8 7.511 8.266 -9.083 55 H THR 9 H THR 9 2.803 7.944 -6.122 56 HA THR 9 HA THR 9 3.631 5.861 -4.219 57 HB THR 9 HB THR 9 1.920 6.863 -2.732 58 HG1 THR 9 HG1 THR 9 1.674 8.747 -4.833 59 HG21 THR 9 HG21 THR 9 3.906 8.807 -3.938 60 HG22 THR 9 HG22 THR 9 4.219 7.681 -2.618 61 HG23 THR 9 HG23 THR 9 3.100 9.023 -2.386 62 H MET 10 H MET 10 2.436 4.121 -3.754 63 HA MET 10 HA MET 10 0.826 2.904 -5.657 64 HB2 MET 10 HB2 MET 10 0.965 2.458 -2.671 65 HB3 MET 10 HB3 MET 10 0.047 1.416 -3.758 66 HG2 MET 10 HG2 MET 10 2.087 0.939 -5.047 67 HG3 MET 10 HG3 MET 10 3.013 2.005 -3.990 68 HE1 MET 10 HE1 MET 10 4.746 -0.219 -3.412 69 HE2 MET 10 HE2 MET 10 3.732 -0.720 -4.764 70 HE3 MET 10 HE3 MET 10 3.954 -1.801 -3.388 71 H GLU 11 H GLU 11 -0.088 5.152 -3.166 72 HA GLU 11 HA GLU 11 -2.893 4.680 -3.140 73 HB2 GLU 11 HB2 GLU 11 -1.270 7.161 -2.544 74 HB3 GLU 11 HB3 GLU 11 -3.023 7.099 -2.361 75 HG2 GLU 11 HG2 GLU 11 -2.108 6.588 -0.208 76 HG3 GLU 11 HG3 GLU 11 -2.684 5.066 -0.877 77 H GLU 12 H GLU 12 -0.877 6.915 -5.006 78 HA GLU 12 HA GLU 12 -2.868 8.210 -6.462 79 HB2 GLU 12 HB2 GLU 12 -0.016 7.555 -7.200 80 HB3 GLU 12 HB3 GLU 12 -1.051 8.579 -8.194 81 HG2 GLU 12 HG2 GLU 12 -1.338 10.161 -6.389 82 HG3 GLU 12 HG3 GLU 12 -0.527 9.089 -5.253 83 H ILE 13 H ILE 13 -0.998 5.312 -7.570 84 HA ILE 13 HA ILE 13 -2.363 5.001 -9.994 85 HB ILE 13 HB ILE 13 -0.290 3.793 -9.490 86 HG12 ILE 13 HG12 ILE 13 -2.426 1.703 -9.915 87 HG13 ILE 13 HG13 ILE 13 -2.067 2.910 -11.146 88 HG21 ILE 13 HG21 ILE 13 -1.983 2.235 -7.528 89 HG22 ILE 13 HG22 ILE 13 -0.605 3.270 -7.158 90 HG23 ILE 13 HG23 ILE 13 -0.364 1.767 -8.044 91 HD11 ILE 13 HD11 ILE 13 0.346 2.188 -11.044 92 HD12 ILE 13 HD12 ILE 13 -0.748 0.934 -11.625 93 HD13 ILE 13 HD13 ILE 13 -0.147 0.880 -9.968 94 H LEU 14 H LEU 14 -3.166 3.908 -6.767 95 HA LEU 14 HA LEU 14 -5.368 2.246 -7.447 96 HB2 LEU 14 HB2 LEU 14 -4.668 3.744 -4.915 97 HB3 LEU 14 HB3 LEU 14 -6.061 2.673 -5.039 98 HG LEU 14 HG LEU 14 -3.246 1.780 -5.723 99 HD11 LEU 14 HD11 LEU 14 -4.753 1.396 -3.116 100 HD12 LEU 14 HD12 LEU 14 -3.411 2.516 -3.341 101 HD13 LEU 14 HD13 LEU 14 -3.144 0.781 -3.496 102 HD21 LEU 14 HD21 LEU 14 -5.873 0.362 -5.175 103 HD22 LEU 14 HD22 LEU 14 -4.323 -0.478 -5.227 104 HD23 LEU 14 HD23 LEU 14 -4.936 0.336 -6.668 105 H ALA 15 H ALA 15 -5.105 5.691 -6.707 106 HA ALA 15 HA ALA 15 -7.855 6.306 -6.597 107 HB1 ALA 15 HB1 ALA 15 -5.724 7.763 -6.075 108 HB2 ALA 15 HB2 ALA 15 -7.203 8.537 -6.642 109 HB3 ALA 15 HB3 ALA 15 -5.880 8.236 -7.767 110 H SER 16 H SER 16 -5.569 6.095 -9.277 111 HA SER 16 HA SER 16 -7.220 7.104 -11.323 112 HB2 SER 16 HB2 SER 16 -4.922 5.152 -11.370 113 HB3 SER 16 HB3 SER 16 -5.682 5.782 -12.825 114 HG SER 16 HG SER 16 -5.018 7.808 -12.284 115 H ILE 17 H ILE 17 -6.744 3.747 -10.149 116 HA ILE 17 HA ILE 17 -9.404 3.039 -11.020 117 HB ILE 17 HB ILE 17 -7.100 1.481 -12.247 118 HG12 ILE 17 HG12 ILE 17 -9.149 3.233 -13.660 119 HG13 ILE 17 HG13 ILE 17 -7.490 3.727 -13.350 120 HG21 ILE 17 HG21 ILE 17 -10.108 1.255 -12.609 121 HG22 ILE 17 HG22 ILE 17 -9.121 0.161 -11.641 122 HG23 ILE 17 HG23 ILE 17 -8.889 0.242 -13.387 123 HD11 ILE 17 HD11 ILE 17 -8.420 1.465 -15.119 124 HD12 ILE 17 HD12 ILE 17 -6.744 1.647 -14.605 125 HD13 ILE 17 HD13 ILE 17 -7.506 2.899 -15.585 126 H ARG 18 H ARG 18 -9.476 2.834 -8.695 127 HA ARG 18 HA ARG 18 -7.969 1.327 -6.995 128 HB2 ARG 18 HB2 ARG 18 -10.011 2.649 -6.385 129 HB3 ARG 18 HB3 ARG 18 -10.996 1.319 -6.991 130 HG2 ARG 18 HG2 ARG 18 -9.927 -0.211 -5.369 131 HG3 ARG 18 HG3 ARG 18 -8.957 1.127 -4.752 132 HD2 ARG 18 HD2 ARG 18 -11.041 2.333 -4.152 133 HD3 ARG 18 HD3 ARG 18 -11.984 0.958 -4.716 134 HE ARG 18 HE ARG 18 -10.475 1.133 -2.238 135 HH11 ARG 18 HH11 ARG 18 -11.969 -1.015 -4.571 136 HH12 ARG 18 HH12 ARG 18 -12.118 -2.322 -3.444 137 HH21 ARG 18 HH21 ARG 18 -10.697 -0.587 -0.804 138 HH22 ARG 18 HH22 ARG 18 -11.404 -2.079 -1.330 139 H ARG 19 H ARG 19 -7.673 -0.778 -6.479 140 HA ARG 19 HA ARG 19 -9.309 -2.895 -7.586 141 HB2 ARG 19 HB2 ARG 19 -7.682 -2.287 -9.432 142 HB3 ARG 19 HB3 ARG 19 -6.386 -2.812 -8.358 143 HG2 ARG 19 HG2 ARG 19 -6.865 -4.727 -9.670 144 HG3 ARG 19 HG3 ARG 19 -7.694 -5.024 -8.145 145 HD2 ARG 19 HD2 ARG 19 -9.179 -5.561 -10.015 146 HD3 ARG 19 HD3 ARG 19 -9.802 -4.166 -9.142 147 HE ARG 19 HE ARG 19 -9.372 -2.842 -11.013 148 HH11 ARG 19 HH11 ARG 19 -7.841 -5.973 -11.410 149 HH12 ARG 19 HH12 ARG 19 -7.448 -5.696 -13.074 150 HH21 ARG 19 HH21 ARG 19 -8.839 -2.529 -13.177 151 HH22 ARG 19 HH22 ARG 19 -8.007 -3.762 -14.063 152 H ILE 20 H ILE 20 -9.233 -4.700 -6.336 153 HA ILE 20 HA ILE 20 -7.290 -4.697 -4.104 154 HB ILE 20 HB ILE 20 -8.947 -6.055 -2.863 155 HG12 ILE 20 HG12 ILE 20 -10.853 -5.433 -5.144 156 HG13 ILE 20 HG13 ILE 20 -10.026 -6.981 -4.991 157 HG21 ILE 20 HG21 ILE 20 -8.995 -3.699 -2.459 158 HG22 ILE 20 HG22 ILE 20 -10.677 -4.181 -2.686 159 HG23 ILE 20 HG23 ILE 20 -9.806 -3.379 -3.993 160 HD11 ILE 20 HD11 ILE 20 -12.063 -5.757 -3.122 161 HD12 ILE 20 HD12 ILE 20 -11.003 -7.068 -2.605 162 HD13 ILE 20 HD13 ILE 20 -12.130 -7.320 -3.938 163 H ILE 21 H ILE 21 -8.260 -6.421 -6.904 164 HA ILE 21 HA ILE 21 -7.724 -8.476 -7.782 165 HB ILE 21 HB ILE 21 -5.188 -7.991 -6.173 166 HG12 ILE 21 HG12 ILE 21 -5.745 -7.314 -9.081 167 HG13 ILE 21 HG13 ILE 21 -5.965 -6.146 -7.779 168 HG21 ILE 21 HG21 ILE 21 -4.229 -9.335 -8.182 169 HG22 ILE 21 HG22 ILE 21 -5.892 -9.855 -8.452 170 HG23 ILE 21 HG23 ILE 21 -5.084 -10.241 -6.936 171 HD11 ILE 21 HD11 ILE 21 -3.761 -5.778 -8.651 172 HD12 ILE 21 HD12 ILE 21 -3.391 -7.500 -8.626 173 HD13 ILE 21 HD13 ILE 21 -3.551 -6.611 -7.111 174 H SER 22 H SER 22 -9.511 -9.174 -6.195 175 HA SER 22 HA SER 22 -8.469 -11.438 -4.621 176 HB2 SER 22 HB2 SER 22 -10.016 -10.970 -2.795 177 HB3 SER 22 HB3 SER 22 -8.950 -9.591 -3.049 178 HG SER 22 HG SER 22 -10.692 -8.762 -4.426 179 H GLU 23 H GLU 23 -10.019 -10.883 -7.263 180 HA GLU 23 HA GLU 23 -11.774 -11.781 -8.460 181 HB2 GLU 23 HB2 GLU 23 -11.236 -14.072 -6.553 182 HB3 GLU 23 HB3 GLU 23 -12.157 -14.192 -8.051 183 HG2 GLU 23 HG2 GLU 23 -10.170 -13.456 -9.327 184 HG3 GLU 23 HG3 GLU 23 -9.248 -13.359 -7.827 185 H ASP 24 H ASP 24 -12.427 -10.281 -5.928 186 HA ASP 24 HA ASP 24 -14.840 -11.545 -4.920 187 HB2 ASP 24 HB2 ASP 24 -13.268 -10.131 -3.519 188 HB3 ASP 24 HB3 ASP 24 -13.867 -8.734 -4.418 189 H ASP 25 H ASP 25 -15.768 -11.638 -7.158 190 HA ASP 25 HA ASP 25 -16.768 -9.093 -8.169 191 HB2 ASP 25 HB2 ASP 25 -15.886 -10.835 -9.732 192 HB3 ASP 25 HB3 ASP 25 -17.209 -11.892 -9.253 193 H ALA 26 H ALA 26 -18.138 -8.556 -6.427 194 HA ALA 26 HA ALA 26 -20.302 -10.262 -5.604 195 HB1 ALA 26 HB1 ALA 26 -21.090 -8.026 -4.544 196 HB2 ALA 26 HB2 ALA 26 -19.522 -7.408 -5.061 197 HB3 ALA 26 HB3 ALA 26 -19.607 -8.765 -3.939 198 HA PRO 27 HA PRO 27 -23.366 -9.244 -8.655 199 HB2 PRO 27 HB2 PRO 27 -25.643 -8.804 -7.155 200 HB3 PRO 27 HB3 PRO 27 -25.000 -10.413 -7.543 201 HG2 PRO 27 HG2 PRO 27 -24.694 -8.805 -5.051 202 HG3 PRO 27 HG3 PRO 27 -24.995 -10.541 -5.246 203 HD2 PRO 27 HD2 PRO 27 -22.533 -9.603 -4.659 204 HD3 PRO 27 HD3 PRO 27 -22.761 -11.017 -5.714 205 H ALA 28 H ALA 28 -22.931 -7.062 -5.958 206 HA ALA 28 HA ALA 28 -23.271 -4.756 -7.709 207 HB1 ALA 28 HB1 ALA 28 -25.015 -5.296 -5.308 208 HB2 ALA 28 HB2 ALA 28 -25.508 -4.848 -6.940 209 HB3 ALA 28 HB3 ALA 28 -24.726 -3.659 -5.898 210 H GLU 29 H GLU 29 -22.229 -2.888 -6.926 211 HA GLU 29 HA GLU 29 -20.965 -2.880 -4.329 212 HB2 GLU 29 HB2 GLU 29 -19.458 -4.320 -5.775 213 HB3 GLU 29 HB3 GLU 29 -19.166 -2.888 -6.766 214 HG2 GLU 29 HG2 GLU 29 -18.328 -1.678 -4.793 215 HG3 GLU 29 HG3 GLU 29 -18.637 -3.094 -3.786 216 HA PRO 30 HA PRO 30 -21.850 1.205 -6.537 217 HB2 PRO 30 HB2 PRO 30 -23.890 2.128 -5.008 218 HB3 PRO 30 HB3 PRO 30 -24.153 1.056 -6.398 219 HG2 PRO 30 HG2 PRO 30 -24.055 0.395 -3.490 220 HG3 PRO 30 HG3 PRO 30 -25.183 -0.169 -4.737 221 HD2 PRO 30 HD2 PRO 30 -23.067 -1.670 -3.882 222 HD3 PRO 30 HD3 PRO 30 -23.716 -1.772 -5.533 223 H ALA 31 H ALA 31 -21.116 3.223 -5.837 224 HA ALA 31 HA ALA 31 -20.369 3.504 -2.995 225 HB1 ALA 31 HB1 ALA 31 -18.273 2.954 -3.824 226 HB2 ALA 31 HB2 ALA 31 -18.261 4.705 -4.017 227 HB3 ALA 31 HB3 ALA 31 -18.594 3.667 -5.404 228 H ALA 32 H ALA 32 -20.995 5.393 -2.174 229 HA ALA 32 HA ALA 32 -21.054 7.801 -3.780 230 HB1 ALA 32 HB1 ALA 32 -23.660 7.121 -2.483 231 HB2 ALA 32 HB2 ALA 32 -23.285 6.418 -4.058 232 HB3 ALA 32 HB3 ALA 32 -23.333 8.171 -3.863 233 H GLU 33 H GLU 33 -21.350 9.708 -2.536 234 HA GLU 33 HA GLU 33 -21.246 9.349 0.400 235 HB2 GLU 33 HB2 GLU 33 -19.559 11.249 -1.258 236 HB3 GLU 33 HB3 GLU 33 -19.605 11.201 0.505 237 HG2 GLU 33 HG2 GLU 33 -18.817 8.855 0.455 238 HG3 GLU 33 HG3 GLU 33 -18.744 8.922 -1.305 239 H ALA 34 H ALA 34 -22.328 10.914 1.604 240 HA ALA 34 HA ALA 34 -24.513 12.200 0.383 241 HB1 ALA 34 HB1 ALA 34 -24.554 11.602 2.749 242 HB2 ALA 34 HB2 ALA 34 -24.808 13.338 2.571 243 HB3 ALA 34 HB3 ALA 34 -23.233 12.724 3.073 244 H ALA 35 H ALA 35 -21.389 13.472 1.468 245 HA ALA 35 HA ALA 35 -20.366 15.512 1.080 246 HB1 ALA 35 HB1 ALA 35 -20.952 16.201 -1.453 247 HB2 ALA 35 HB2 ALA 35 -21.579 14.544 -1.458 248 HB3 ALA 35 HB3 ALA 35 -19.880 14.851 -1.065 249 HA PRO 36 HA PRO 36 -24.480 17.837 1.670 250 HB2 PRO 36 HB2 PRO 36 -24.008 18.779 4.202 251 HB3 PRO 36 HB3 PRO 36 -24.817 17.237 3.863 252 HG2 PRO 36 HG2 PRO 36 -21.976 17.759 4.604 253 HG3 PRO 36 HG3 PRO 36 -23.075 16.487 5.167 254 HD2 PRO 36 HD2 PRO 36 -21.186 16.011 3.281 255 HD3 PRO 36 HD3 PRO 36 -22.758 15.179 3.271 256 HA PRO 37 HA PRO 37 -22.094 21.571 0.693 257 HB2 PRO 37 HB2 PRO 37 -24.059 23.203 -0.118 258 HB3 PRO 37 HB3 PRO 37 -23.623 21.762 -1.061 259 HG2 PRO 37 HG2 PRO 37 -25.887 22.158 0.841 260 HG3 PRO 37 HG3 PRO 37 -25.880 21.380 -0.753 261 HD2 PRO 37 HD2 PRO 37 -25.747 19.990 1.631 262 HD3 PRO 37 HD3 PRO 37 -25.116 19.374 0.086 263 HA PRO 38 HA PRO 38 -22.386 24.176 4.330 264 HB2 PRO 38 HB2 PRO 38 -21.568 26.618 3.439 265 HB3 PRO 38 HB3 PRO 38 -20.452 25.253 3.645 266 HG2 PRO 38 HG2 PRO 38 -21.754 26.270 1.159 267 HG3 PRO 38 HG3 PRO 38 -20.080 25.749 1.422 268 HD2 PRO 38 HD2 PRO 38 -21.929 24.138 0.246 269 HD3 PRO 38 HD3 PRO 38 -20.610 23.496 1.250 270 HA PRO 39 HA PRO 39 -26.385 26.147 4.370 271 HB2 PRO 39 HB2 PRO 39 -25.986 28.345 6.024 272 HB3 PRO 39 HB3 PRO 39 -26.297 26.691 6.584 273 HG2 PRO 39 HG2 PRO 39 -23.719 28.156 6.348 274 HG3 PRO 39 HG3 PRO 39 -24.272 27.031 7.602 275 HD2 PRO 39 HD2 PRO 39 -22.524 26.262 5.694 276 HD3 PRO 39 HD3 PRO 39 -23.751 25.146 6.337 277 HA PRO 40 HA PRO 40 -25.439 29.384 1.224 278 HB2 PRO 40 HB2 PRO 40 -27.635 29.116 -0.312 279 HB3 PRO 40 HB3 PRO 40 -26.314 27.929 -0.364 280 HG2 PRO 40 HG2 PRO 40 -28.927 27.786 1.072 281 HG3 PRO 40 HG3 PRO 40 -28.101 26.543 0.118 282 HD2 PRO 40 HD2 PRO 40 -28.001 26.629 2.856 283 HD3 PRO 40 HD3 PRO 40 -26.705 25.939 1.856 284 H GLU 41 H GLU 41 -26.371 31.451 0.665 285 HA GLU 41 HA GLU 41 -27.825 32.680 2.805 286 HB2 GLU 41 HB2 GLU 41 -27.662 34.725 1.443 287 HB3 GLU 41 HB3 GLU 41 -26.108 33.903 1.524 288 HG2 GLU 41 HG2 GLU 41 -26.527 32.887 -0.691 289 HG3 GLU 41 HG3 GLU 41 -28.083 33.713 -0.774 290 HA PRO 42 HA PRO 42 -31.975 32.104 1.319 291 HB2 PRO 42 HB2 PRO 42 -33.245 34.424 1.988 292 HB3 PRO 42 HB3 PRO 42 -32.760 33.207 3.186 293 HG2 PRO 42 HG2 PRO 42 -31.410 35.756 2.427 294 HG3 PRO 42 HG3 PRO 42 -31.674 35.053 4.035 295 HD2 PRO 42 HD2 PRO 42 -29.287 34.863 2.741 296 HD3 PRO 42 HD3 PRO 42 -29.875 33.603 3.846 297 H GLU 43 H GLU 43 -33.151 32.342 -0.527 298 HA GLU 43 HA GLU 43 -33.108 34.735 -2.131 299 HB2 GLU 43 HB2 GLU 43 -32.067 33.706 -4.120 300 HB3 GLU 43 HB3 GLU 43 -30.936 33.785 -2.774 301 HG2 GLU 43 HG2 GLU 43 -31.389 31.421 -2.241 302 HG3 GLU 43 HG3 GLU 43 -32.545 31.337 -3.570 303 HA PRO 44 HA PRO 44 -36.971 32.935 -3.421 304 HB2 PRO 44 HB2 PRO 44 -37.329 33.892 -5.952 305 HB3 PRO 44 HB3 PRO 44 -37.491 34.909 -4.506 306 HG2 PRO 44 HG2 PRO 44 -35.187 34.645 -6.381 307 HG3 PRO 44 HG3 PRO 44 -35.888 36.103 -5.656 308 HD2 PRO 44 HD2 PRO 44 -33.624 34.955 -4.685 309 HD3 PRO 44 HD3 PRO 44 -34.784 35.798 -3.636 310 H GLU 45 H GLU 45 -37.802 31.131 -4.483 311 HA GLU 45 HA GLU 45 -36.414 29.933 -6.727 312 HB2 GLU 45 HB2 GLU 45 -35.921 27.809 -5.570 313 HB3 GLU 45 HB3 GLU 45 -35.026 29.150 -4.863 314 HG2 GLU 45 HG2 GLU 45 -36.696 29.323 -3.056 315 HG3 GLU 45 HG3 GLU 45 -37.613 27.998 -3.769 316 HA PRO 46 HA PRO 46 -40.521 28.380 -7.457 317 HB2 PRO 46 HB2 PRO 46 -40.107 26.093 -8.861 318 HB3 PRO 46 HB3 PRO 46 -39.794 27.700 -9.548 319 HG2 PRO 46 HG2 PRO 46 -37.874 25.750 -8.355 320 HG3 PRO 46 HG3 PRO 46 -37.726 26.708 -9.840 321 HD2 PRO 46 HD2 PRO 46 -36.519 27.451 -7.526 322 HD3 PRO 46 HD3 PRO 46 -37.124 28.640 -8.697 323 H VAL 47 H VAL 47 -42.074 26.827 -6.775 324 HA VAL 47 HA VAL 47 -41.211 25.242 -4.471 325 HB VAL 47 HB VAL 47 -43.632 25.030 -3.983 326 HG11 VAL 47 HG11 VAL 47 -42.804 27.888 -4.563 327 HG12 VAL 47 HG12 VAL 47 -42.252 26.960 -3.169 328 HG13 VAL 47 HG13 VAL 47 -43.964 27.347 -3.347 329 HG21 VAL 47 HG21 VAL 47 -44.348 25.169 -6.411 330 HG22 VAL 47 HG22 VAL 47 -44.029 26.903 -6.338 331 HG23 VAL 47 HG23 VAL 47 -45.279 26.192 -5.316 332 H SER 48 H SER 48 -41.800 24.693 -7.757 333 HA SER 48 HA SER 48 -42.252 21.810 -7.247 334 HB2 SER 48 HB2 SER 48 -43.329 23.478 -9.529 335 HB3 SER 48 HB3 SER 48 -43.484 21.729 -9.392 336 HG SER 48 HG SER 48 -45.317 22.832 -8.573 337 H PHE 49 H PHE 49 -41.148 20.365 -8.539 338 HA PHE 49 HA PHE 49 -39.582 21.039 -10.794 339 HB2 PHE 49 HB2 PHE 49 -38.260 22.213 -8.987 340 HB3 PHE 49 HB3 PHE 49 -37.921 20.624 -8.298 341 HD1 PHE 49 HD1 PHE 49 -37.454 22.784 -11.279 342 HD2 PHE 49 HD2 PHE 49 -36.354 19.117 -9.330 343 HE1 PHE 49 HE1 PHE 49 -35.611 22.472 -12.908 344 HE2 PHE 49 HE2 PHE 49 -34.510 18.807 -10.958 345 HZ PHE 49 HZ PHE 49 -34.137 20.483 -12.746 346 H ASP 50 H ASP 50 -40.928 19.119 -11.231 347 HA ASP 50 HA ASP 50 -40.219 16.607 -9.997 348 HB2 ASP 50 HB2 ASP 50 -41.821 15.641 -11.550 349 HB3 ASP 50 HB3 ASP 50 -42.506 17.082 -10.814 350 H ASP 51 H ASP 51 -39.847 14.715 -11.666 351 HA ASP 51 HA ASP 51 -37.259 15.168 -12.819 352 HB2 ASP 51 HB2 ASP 51 -37.997 13.015 -11.753 353 HB3 ASP 51 HB3 ASP 51 -39.036 12.743 -13.149 354 H GLU 52 H GLU 52 -40.279 13.947 -14.311 355 HA GLU 52 HA GLU 52 -40.252 15.753 -16.490 356 HB2 GLU 52 HB2 GLU 52 -39.607 14.171 -18.300 357 HB3 GLU 52 HB3 GLU 52 -38.261 14.535 -17.222 358 HG2 GLU 52 HG2 GLU 52 -38.729 12.422 -15.981 359 HG3 GLU 52 HG3 GLU 52 -39.998 12.046 -17.144 360 H VAL 53 H VAL 53 -42.215 15.108 -14.823 361 HA VAL 53 HA VAL 53 -43.943 13.215 -16.272 362 HB VAL 53 HB VAL 53 -43.567 12.659 -13.898 363 HG11 VAL 53 HG11 VAL 53 -44.544 14.163 -12.152 364 HG12 VAL 53 HG12 VAL 53 -44.782 15.390 -13.397 365 HG13 VAL 53 HG13 VAL 53 -43.152 14.865 -12.978 366 HG21 VAL 53 HG21 VAL 53 -46.371 13.657 -14.494 367 HG22 VAL 53 HG22 VAL 53 -45.949 12.509 -13.224 368 HG23 VAL 53 HG23 VAL 53 -45.724 12.072 -14.917 369 H LEU 54 H LEU 54 -45.877 13.892 -17.099 370 HA LEU 54 HA LEU 54 -46.858 16.578 -16.527 371 HB2 LEU 54 HB2 LEU 54 -45.166 16.770 -18.404 372 HB3 LEU 54 HB3 LEU 54 -46.244 15.772 -19.377 373 HG LEU 54 HG LEU 54 -48.073 17.469 -18.890 374 HD11 LEU 54 HD11 LEU 54 -47.164 19.775 -18.290 375 HD12 LEU 54 HD12 LEU 54 -45.685 18.962 -17.782 376 HD13 LEU 54 HD13 LEU 54 -47.209 18.610 -16.967 377 HD21 LEU 54 HD21 LEU 54 -45.587 18.364 -20.378 378 HD22 LEU 54 HD22 LEU 54 -47.173 19.112 -20.547 379 HD23 LEU 54 HD23 LEU 54 -46.933 17.437 -21.044 380 H GLU 55 H GLU 55 -49.050 16.802 -16.889 381 HA GLU 55 HA GLU 55 -50.650 14.475 -16.951 382 HB2 GLU 55 HB2 GLU 55 -51.316 17.391 -17.385 383 HB3 GLU 55 HB3 GLU 55 -52.538 16.122 -17.322 384 HG2 GLU 55 HG2 GLU 55 -51.894 15.520 -15.071 385 HG3 GLU 55 HG3 GLU 55 -50.502 16.596 -15.130 386 H LEU 56 H LEU 56 -49.772 16.810 -19.457 387 HA LEU 56 HA LEU 56 -51.370 15.527 -21.497 388 HB2 LEU 56 HB2 LEU 56 -50.384 18.063 -21.191 389 HB3 LEU 56 HB3 LEU 56 -49.183 17.389 -22.286 390 HG LEU 56 HG LEU 56 -51.160 16.596 -23.724 391 HD11 LEU 56 HD11 LEU 56 -52.936 16.817 -22.080 392 HD12 LEU 56 HD12 LEU 56 -53.245 17.949 -23.398 393 HD13 LEU 56 HD13 LEU 56 -52.580 18.531 -21.872 394 HD21 LEU 56 HD21 LEU 56 -51.487 18.897 -24.691 395 HD22 LEU 56 HD22 LEU 56 -49.794 18.482 -24.418 396 HD23 LEU 56 HD23 LEU 56 -50.633 19.552 -23.295 397 H THR 57 H THR 57 -49.574 15.517 -23.691 398 HA THR 57 HA THR 57 -47.812 13.262 -22.956 399 HB THR 57 HB THR 57 -49.018 13.972 -25.650 400 HG1 THR 57 HG1 THR 57 -50.628 12.809 -25.011 401 HG21 THR 57 HG21 THR 57 -46.820 12.756 -25.730 402 HG22 THR 57 HG22 THR 57 -48.162 11.818 -26.387 403 HG23 THR 57 HG23 THR 57 -47.547 11.466 -24.771 404 H ASP 58 H ASP 58 -45.688 13.563 -23.079 405 HA ASP 58 HA ASP 58 -44.596 16.059 -24.038 406 HB2 ASP 58 HB2 ASP 58 -42.483 15.221 -23.166 407 HB3 ASP 58 HB3 ASP 58 -43.754 14.960 -21.979 408 HA PRO 59 HA PRO 59 -43.450 14.596 -28.066 409 HB2 PRO 59 HB2 PRO 59 -41.134 15.916 -28.611 410 HB3 PRO 59 HB3 PRO 59 -42.709 16.739 -28.540 411 HG2 PRO 59 HG2 PRO 59 -40.563 16.579 -26.469 412 HG3 PRO 59 HG3 PRO 59 -41.530 17.973 -26.985 413 HD2 PRO 59 HD2 PRO 59 -42.099 16.556 -24.726 414 HD3 PRO 59 HD3 PRO 59 -43.357 17.357 -25.694 415 H ILE 60 H ILE 60 -42.085 13.146 -29.204 416 HA ILE 60 HA ILE 60 -40.768 11.202 -27.625 417 HB ILE 60 HB ILE 60 -41.862 10.708 -29.791 418 HG12 ILE 60 HG12 ILE 60 -38.914 10.062 -30.020 419 HG13 ILE 60 HG13 ILE 60 -39.935 9.315 -28.794 420 HG21 ILE 60 HG21 ILE 60 -40.913 11.375 -31.888 421 HG22 ILE 60 HG22 ILE 60 -39.472 12.024 -31.104 422 HG23 ILE 60 HG23 ILE 60 -41.024 12.836 -30.906 423 HD11 ILE 60 HD11 ILE 60 -41.496 8.620 -30.682 424 HD12 ILE 60 HD12 ILE 60 -39.924 7.819 -30.672 425 HD13 ILE 60 HD13 ILE 60 -40.236 9.138 -31.803 426 H ALA 61 H ALA 61 -38.682 10.908 -27.073 427 HA ALA 61 HA ALA 61 -36.626 12.675 -28.234 428 HB1 ALA 61 HB1 ALA 61 -37.330 12.332 -25.329 429 HB2 ALA 61 HB2 ALA 61 -37.023 13.820 -26.228 430 HB3 ALA 61 HB3 ALA 61 -35.685 12.749 -25.812 431 HA PRO 62 HA PRO 62 -34.289 8.889 -28.401 432 HB2 PRO 62 HB2 PRO 62 -31.713 9.754 -28.220 433 HB3 PRO 62 HB3 PRO 62 -32.712 10.012 -29.663 434 HG2 PRO 62 HG2 PRO 62 -32.083 11.899 -27.437 435 HG3 PRO 62 HG3 PRO 62 -32.120 12.191 -29.185 436 HD2 PRO 62 HD2 PRO 62 -34.177 12.906 -27.552 437 HD3 PRO 62 HD3 PRO 62 -34.429 12.411 -29.242 438 H GLU 63 H GLU 63 -33.342 7.335 -27.083 439 HA GLU 63 HA GLU 63 -32.386 8.101 -24.420 440 HB2 GLU 63 HB2 GLU 63 -34.861 7.675 -24.271 441 HB3 GLU 63 HB3 GLU 63 -34.555 6.023 -24.798 442 HG2 GLU 63 HG2 GLU 63 -33.069 5.674 -22.862 443 HG3 GLU 63 HG3 GLU 63 -33.369 7.328 -22.332 444 HA PRO 64 HA PRO 64 -30.022 4.613 -26.540 445 HB2 PRO 64 HB2 PRO 64 -27.512 5.636 -26.137 446 HB3 PRO 64 HB3 PRO 64 -28.501 6.007 -27.562 447 HG2 PRO 64 HG2 PRO 64 -28.064 7.614 -25.093 448 HG3 PRO 64 HG3 PRO 64 -28.131 8.140 -26.784 449 HD2 PRO 64 HD2 PRO 64 -30.236 8.445 -25.090 450 HD3 PRO 64 HD3 PRO 64 -30.452 8.154 -26.829 451 H GLU 65 H GLU 65 -29.346 6.391 -23.553 452 HA GLU 65 HA GLU 65 -28.461 5.740 -21.521 453 HB2 GLU 65 HB2 GLU 65 -30.430 3.553 -22.196 454 HB3 GLU 65 HB3 GLU 65 -29.666 3.699 -20.612 455 HG2 GLU 65 HG2 GLU 65 -30.601 5.905 -20.291 456 HG3 GLU 65 HG3 GLU 65 -31.204 5.944 -21.945 457 H LEU 66 H LEU 66 -26.666 5.106 -23.574 458 HA LEU 66 HA LEU 66 -25.422 2.654 -22.487 459 HB2 LEU 66 HB2 LEU 66 -26.566 2.392 -24.790 460 HB3 LEU 66 HB3 LEU 66 -25.255 3.390 -25.409 461 HG LEU 66 HG LEU 66 -24.767 0.870 -23.795 462 HD11 LEU 66 HD11 LEU 66 -24.731 1.166 -26.813 463 HD12 LEU 66 HD12 LEU 66 -26.058 0.429 -25.913 464 HD13 LEU 66 HD13 LEU 66 -24.457 -0.310 -25.889 465 HD21 LEU 66 HD21 LEU 66 -22.795 2.202 -23.831 466 HD22 LEU 66 HD22 LEU 66 -23.069 2.708 -25.497 467 HD23 LEU 66 HD23 LEU 66 -22.560 1.056 -25.148 468 HA PRO 67 HA PRO 67 -22.419 6.221 -22.353 469 HB2 PRO 67 HB2 PRO 67 -21.306 5.619 -19.942 470 HB3 PRO 67 HB3 PRO 67 -22.808 6.553 -20.093 471 HG2 PRO 67 HG2 PRO 67 -22.439 3.657 -19.482 472 HG3 PRO 67 HG3 PRO 67 -23.532 4.836 -18.734 473 HD2 PRO 67 HD2 PRO 67 -24.385 3.060 -20.612 474 HD3 PRO 67 HD3 PRO 67 -25.092 4.684 -20.446 475 HA PRO 68 HA PRO 68 -19.068 3.712 -23.922 476 HB2 PRO 68 HB2 PRO 68 -16.845 5.222 -23.263 477 HB3 PRO 68 HB3 PRO 68 -17.901 5.543 -24.651 478 HG2 PRO 68 HG2 PRO 68 -17.851 6.839 -21.972 479 HG3 PRO 68 HG3 PRO 68 -18.106 7.557 -23.573 480 HD2 PRO 68 HD2 PRO 68 -20.165 7.083 -21.877 481 HD3 PRO 68 HD3 PRO 68 -20.350 6.956 -23.641 482 H LEU 69 H LEU 69 -18.242 5.138 -20.744 483 HA LEU 69 HA LEU 69 -17.995 2.617 -19.445 484 HB2 LEU 69 HB2 LEU 69 -15.930 2.603 -20.895 485 HB3 LEU 69 HB3 LEU 69 -15.357 3.997 -19.985 486 HG LEU 69 HG LEU 69 -15.633 2.611 -17.878 487 HD11 LEU 69 HD11 LEU 69 -16.090 0.456 -19.956 488 HD12 LEU 69 HD12 LEU 69 -17.133 0.883 -18.601 489 HD13 LEU 69 HD13 LEU 69 -15.582 0.098 -18.306 490 HD21 LEU 69 HD21 LEU 69 -13.567 1.227 -18.365 491 HD22 LEU 69 HD22 LEU 69 -13.424 2.935 -18.783 492 HD23 LEU 69 HD23 LEU 69 -13.706 1.738 -20.048 493 H GLU 70 H GLU 70 -18.942 3.314 -17.618 494 HA GLU 70 HA GLU 70 -17.857 5.736 -16.306 495 HB2 GLU 70 HB2 GLU 70 -20.019 5.842 -15.093 496 HB3 GLU 70 HB3 GLU 70 -20.229 5.958 -16.840 497 HG2 GLU 70 HG2 GLU 70 -20.790 3.543 -16.921 498 HG3 GLU 70 HG3 GLU 70 -20.611 3.451 -15.169 499 H THR 71 H THR 71 -17.034 5.605 -14.290 500 HA THR 71 HA THR 71 -17.445 3.219 -12.662 501 HB THR 71 HB THR 71 -15.556 2.575 -14.082 502 HG1 THR 71 HG1 THR 71 -15.065 1.663 -12.271 503 HG21 THR 71 HG21 THR 71 -13.473 3.805 -14.095 504 HG22 THR 71 HG22 THR 71 -14.088 4.950 -12.904 505 HG23 THR 71 HG23 THR 71 -14.763 4.923 -14.533 506 H VAL 72 H VAL 72 -16.711 3.435 -10.486 507 HA VAL 72 HA VAL 72 -15.937 6.133 -9.626 508 HB VAL 72 HB VAL 72 -18.401 6.027 -9.491 509 HG11 VAL 72 HG11 VAL 72 -17.973 3.756 -7.528 510 HG12 VAL 72 HG12 VAL 72 -18.553 3.548 -9.181 511 HG13 VAL 72 HG13 VAL 72 -19.518 4.453 -8.014 512 HG21 VAL 72 HG21 VAL 72 -18.616 6.715 -7.161 513 HG22 VAL 72 HG22 VAL 72 -17.082 7.309 -7.799 514 HG23 VAL 72 HG23 VAL 72 -17.112 5.892 -6.747 515 H GLY 73 H GLY 73 -14.770 6.195 -7.688 516 HA2 GLY 73 HA2 GLY 73 -14.332 3.793 -6.124 517 HA3 GLY 73 HA3 GLY 73 -12.948 4.281 -7.095 518 H ASP 74 H ASP 74 -12.314 4.272 -4.610 519 HA ASP 74 HA ASP 74 -11.877 7.025 -3.905 520 HB2 ASP 74 HB2 ASP 74 -14.232 6.289 -2.987 521 HB3 ASP 74 HB3 ASP 74 -13.269 5.459 -1.762 522 H ILE 75 H ILE 75 -10.399 7.230 -2.087 523 HA ILE 75 HA ILE 75 -9.086 4.741 -1.245 524 HB ILE 75 HB ILE 75 -6.843 5.682 -1.704 525 HG12 ILE 75 HG12 ILE 75 -8.290 7.792 -3.334 526 HG13 ILE 75 HG13 ILE 75 -7.681 8.103 -1.711 527 HG21 ILE 75 HG21 ILE 75 -6.892 5.247 -4.096 528 HG22 ILE 75 HG22 ILE 75 -8.620 5.592 -4.161 529 HG23 ILE 75 HG23 ILE 75 -8.039 4.166 -3.303 530 HD11 ILE 75 HD11 ILE 75 -5.883 6.984 -3.869 531 HD12 ILE 75 HD12 ILE 75 -5.425 7.805 -2.374 532 HD13 ILE 75 HD13 ILE 75 -6.142 8.721 -3.700 533 H ASP 76 H ASP 76 -10.298 7.770 -0.413 534 HA ASP 76 HA ASP 76 -8.560 8.617 1.636 535 HB2 ASP 76 HB2 ASP 76 -11.524 9.013 1.201 536 HB3 ASP 76 HB3 ASP 76 -10.643 9.771 2.524 537 H VAL 77 H VAL 77 -8.580 8.296 3.851 538 HA VAL 77 HA VAL 77 -9.592 5.702 4.724 539 HB VAL 77 HB VAL 77 -7.945 7.771 6.224 540 HG11 VAL 77 HG11 VAL 77 -9.279 6.100 7.607 541 HG12 VAL 77 HG12 VAL 77 -7.534 6.057 7.852 542 HG13 VAL 77 HG13 VAL 77 -8.314 4.831 6.853 543 HG21 VAL 77 HG21 VAL 77 -6.758 6.865 4.259 544 HG22 VAL 77 HG22 VAL 77 -7.119 5.223 4.791 545 HG23 VAL 77 HG23 VAL 77 -6.050 6.246 5.751 546 H TYR 78 H TYR 78 -9.889 9.116 5.642 547 HA TYR 78 HA TYR 78 -12.479 8.492 6.945 548 HB2 TYR 78 HB2 TYR 78 -10.425 10.551 7.787 549 HB3 TYR 78 HB3 TYR 78 -12.028 10.377 8.496 550 HD1 TYR 78 HD1 TYR 78 -8.650 8.989 8.290 551 HD2 TYR 78 HD2 TYR 78 -12.629 8.337 9.776 552 HE1 TYR 78 HE1 TYR 78 -7.795 7.226 9.811 553 HE2 TYR 78 HE2 TYR 78 -11.774 6.574 11.295 554 HH TYR 78 HH TYR 78 -9.291 4.969 11.032 555 H SER 79 H SER 79 -14.187 9.747 6.446 556 HA SER 79 HA SER 79 -13.750 12.154 4.800 557 HB2 SER 79 HB2 SER 79 -14.291 10.175 3.344 558 HB3 SER 79 HB3 SER 79 -15.838 10.050 4.175 559 HG SER 79 HG SER 79 -15.972 11.306 2.261 560 HA PRO 80 HA PRO 80 -16.856 12.831 8.254 561 HB2 PRO 80 HB2 PRO 80 -15.762 15.078 9.315 562 HB3 PRO 80 HB3 PRO 80 -15.222 13.451 9.775 563 HG2 PRO 80 HG2 PRO 80 -13.996 15.376 7.850 564 HG3 PRO 80 HG3 PRO 80 -13.219 14.365 9.082 565 HD2 PRO 80 HD2 PRO 80 -13.270 13.676 6.442 566 HD3 PRO 80 HD3 PRO 80 -13.257 12.470 7.747 567 HA PRO 81 HA PRO 81 -19.096 15.803 5.749 568 HB2 PRO 81 HB2 PRO 81 -20.829 16.888 7.585 569 HB3 PRO 81 HB3 PRO 81 -21.047 15.286 6.854 570 HG2 PRO 81 HG2 PRO 81 -19.923 16.012 9.518 571 HG3 PRO 81 HG3 PRO 81 -21.029 14.697 9.077 572 HD2 PRO 81 HD2 PRO 81 -18.384 14.263 9.485 573 HD3 PRO 81 HD3 PRO 81 -19.315 13.337 8.283 574 H GLU 82 H GLU 82 -17.613 16.834 8.752 575 HA GLU 82 HA GLU 82 -17.161 19.519 7.596 576 HB2 GLU 82 HB2 GLU 82 -17.826 18.857 10.476 577 HB3 GLU 82 HB3 GLU 82 -17.323 20.445 9.901 578 HG2 GLU 82 HG2 GLU 82 -19.267 20.530 8.393 579 HG3 GLU 82 HG3 GLU 82 -19.769 18.931 8.939 580 HA PRO 83 HA PRO 83 -12.927 18.596 8.653 581 HB2 PRO 83 HB2 PRO 83 -11.760 21.015 8.465 582 HB3 PRO 83 HB3 PRO 83 -12.454 20.211 7.043 583 HG2 PRO 83 HG2 PRO 83 -13.571 22.416 8.702 584 HG3 PRO 83 HG3 PRO 83 -13.612 22.191 6.946 585 HD2 PRO 83 HD2 PRO 83 -15.712 21.574 8.664 586 HD3 PRO 83 HD3 PRO 83 -15.504 20.895 7.035 587 H GLU 84 H GLU 84 -13.806 18.076 10.920 588 HA GLU 84 HA GLU 84 -12.969 20.059 12.937 589 HB2 GLU 84 HB2 GLU 84 -14.680 17.575 13.205 590 HB3 GLU 84 HB3 GLU 84 -14.249 18.656 14.530 591 HG2 GLU 84 HG2 GLU 84 -15.348 20.532 13.358 592 HG3 GLU 84 HG3 GLU 84 -15.789 19.448 12.040 593 H SER 85 H SER 85 -11.337 17.932 11.294 594 HA SER 85 HA SER 85 -9.906 16.802 13.625 595 HB2 SER 85 HB2 SER 85 -10.302 15.559 10.895 596 HB3 SER 85 HB3 SER 85 -9.287 14.894 12.172 597 HG SER 85 HG SER 85 -11.969 14.754 11.841 598 H GLU 86 H GLU 86 -7.617 16.530 13.353 599 HA GLU 86 HA GLU 86 -6.433 18.343 11.331 600 HB2 GLU 86 HB2 GLU 86 -6.355 19.252 13.656 601 HB3 GLU 86 HB3 GLU 86 -5.428 17.833 14.145 602 HG2 GLU 86 HG2 GLU 86 -3.873 19.637 13.687 603 HG3 GLU 86 HG3 GLU 86 -3.711 18.429 12.416 604 HA PRO 87 HA PRO 87 -4.602 14.145 10.634 605 HB2 PRO 87 HB2 PRO 87 -4.106 14.422 7.978 606 HB3 PRO 87 HB3 PRO 87 -5.707 13.996 8.610 607 HG2 PRO 87 HG2 PRO 87 -4.673 16.649 7.716 608 HG3 PRO 87 HG3 PRO 87 -6.237 15.879 7.384 609 HD2 PRO 87 HD2 PRO 87 -5.939 17.790 9.300 610 HD3 PRO 87 HD3 PRO 87 -7.123 16.472 9.443 611 H ALA 88 H ALA 88 -2.456 13.458 10.177 612 HA ALA 88 HA ALA 88 -0.443 15.576 9.772 613 HB1 ALA 88 HB1 ALA 88 0.966 14.438 11.526 614 HB2 ALA 88 HB2 ALA 88 -0.457 13.496 11.970 615 HB3 ALA 88 HB3 ALA 88 -0.467 15.250 12.158 616 H TYR 89 H TYR 89 1.137 15.018 8.386 617 HA TYR 89 HA TYR 89 1.490 12.160 7.712 618 HB2 TYR 89 HB2 TYR 89 1.315 14.461 5.750 619 HB3 TYR 89 HB3 TYR 89 1.762 12.810 5.333 620 HD1 TYR 89 HD1 TYR 89 -0.977 15.056 6.265 621 HD2 TYR 89 HD2 TYR 89 0.113 10.973 5.498 622 HE1 TYR 89 HE1 TYR 89 -3.374 14.452 6.072 623 HE2 TYR 89 HE2 TYR 89 -2.285 10.369 5.307 624 HH TYR 89 HH TYR 89 -4.430 11.516 4.771 625 H THR 90 H THR 90 3.551 11.507 7.249 626 HA THR 90 HA THR 90 5.686 13.153 8.228 627 HB THR 90 HB THR 90 5.707 10.740 8.628 628 HG1 THR 90 HG1 THR 90 7.762 11.396 6.803 629 HG21 THR 90 HG21 THR 90 6.260 9.236 6.648 630 HG22 THR 90 HG22 THR 90 5.790 10.580 5.607 631 HG23 THR 90 HG23 THR 90 4.608 9.851 6.694 632 HA PRO 91 HA PRO 91 6.844 15.251 4.464 633 HB2 PRO 91 HB2 PRO 91 9.668 14.593 5.214 634 HB3 PRO 91 HB3 PRO 91 8.958 16.158 4.769 635 HG2 PRO 91 HG2 PRO 91 9.510 15.639 7.286 636 HG3 PRO 91 HG3 PRO 91 7.995 16.460 6.857 637 HD2 PRO 91 HD2 PRO 91 8.425 13.593 7.651 638 HD3 PRO 91 HD3 PRO 91 7.095 14.695 8.079 639 HA PRO 92 HA PRO 92 7.250 11.867 1.520 640 HB2 PRO 92 HB2 PRO 92 8.559 13.893 -0.249 641 HB3 PRO 92 HB3 PRO 92 7.211 12.794 -0.599 642 HG2 PRO 92 HG2 PRO 92 6.744 15.344 -0.180 643 HG3 PRO 92 HG3 PRO 92 5.674 14.117 0.524 644 HD2 PRO 92 HD2 PRO 92 7.826 15.731 1.868 645 HD3 PRO 92 HD3 PRO 92 6.216 15.274 2.473 646 HA PRO 93 HA PRO 93 11.595 10.731 2.137 647 HB2 PRO 93 HB2 PRO 93 11.678 8.365 0.821 648 HB3 PRO 93 HB3 PRO 93 10.838 8.551 2.376 649 HG2 PRO 93 HG2 PRO 93 9.712 8.524 -0.389 650 HG3 PRO 93 HG3 PRO 93 9.121 7.717 1.076 651 HD2 PRO 93 HD2 PRO 93 8.057 10.060 0.159 652 HD3 PRO 93 HD3 PRO 93 8.101 9.634 1.885 653 H ALA 94 H ALA 94 13.580 10.578 0.950 654 HA ALA 94 HA ALA 94 13.457 11.830 -1.684 655 HB1 ALA 94 HB1 ALA 94 15.661 11.311 0.300 656 HB2 ALA 94 HB2 ALA 94 15.080 12.855 -0.320 657 HB3 ALA 94 HB3 ALA 94 16.024 11.787 -1.357 658 H ALA 95 H ALA 95 13.878 10.846 -3.558 659 HA ALA 95 HA ALA 95 15.439 8.477 -3.810 660 HB1 ALA 95 HB1 ALA 95 12.869 7.579 -4.734 661 HB2 ALA 95 HB2 ALA 95 12.720 8.097 -3.052 662 HB3 ALA 95 HB3 ALA 95 13.907 6.867 -3.498 663 HA PRO 96 HA PRO 96 14.955 11.239 -7.584 664 HB2 PRO 96 HB2 PRO 96 17.726 10.189 -7.971 665 HB3 PRO 96 HB3 PRO 96 17.108 11.843 -8.162 666 HG2 PRO 96 HG2 PRO 96 18.572 11.219 -6.067 667 HG3 PRO 96 HG3 PRO 96 17.146 12.259 -5.883 668 HD2 PRO 96 HD2 PRO 96 17.443 9.339 -5.214 669 HD3 PRO 96 HD3 PRO 96 16.612 10.623 -4.304 670 H VAL 97 H VAL 97 14.276 10.546 -9.556 671 HA VAL 97 HA VAL 97 14.342 7.669 -10.091 672 HB VAL 97 HB VAL 97 12.673 8.187 -11.853 673 HG11 VAL 97 HG11 VAL 97 11.989 9.486 -9.201 674 HG12 VAL 97 HG12 VAL 97 12.026 7.744 -9.468 675 HG13 VAL 97 HG13 VAL 97 10.865 8.745 -10.339 676 HG21 VAL 97 HG21 VAL 97 13.549 10.516 -12.316 677 HG22 VAL 97 HG22 VAL 97 12.805 11.034 -10.802 678 HG23 VAL 97 HG23 VAL 97 11.798 10.431 -12.120 679 H PHE 98 H PHE 98 15.139 6.743 -11.960 680 HA PHE 98 HA PHE 98 16.256 8.212 -14.131 681 HB2 PHE 98 HB2 PHE 98 17.934 8.665 -12.289 682 HB3 PHE 98 HB3 PHE 98 18.292 6.936 -12.296 683 HD1 PHE 98 HD1 PHE 98 18.377 10.049 -14.311 684 HD2 PHE 98 HD2 PHE 98 19.557 5.925 -14.081 685 HE1 PHE 98 HE1 PHE 98 19.895 10.374 -16.245 686 HE2 PHE 98 HE2 PHE 98 21.075 6.250 -16.016 687 HZ PHE 98 HZ PHE 98 21.244 8.476 -17.097 688 H ASP 99 H ASP 99 16.565 5.235 -12.233 689 HA ASP 99 HA ASP 99 17.294 3.519 -14.345 690 HB2 ASP 99 HB2 ASP 99 15.961 2.992 -11.683 691 HB3 ASP 99 HB3 ASP 99 16.433 1.708 -12.790 692 H ARG 100 H ARG 100 14.108 4.177 -12.835 693 HA ARG 100 HA ARG 100 12.655 2.536 -14.678 694 HB2 ARG 100 HB2 ARG 100 11.815 4.711 -12.751 695 HB3 ARG 100 HB3 ARG 100 10.674 3.796 -13.738 696 HG2 ARG 100 HG2 ARG 100 11.356 1.714 -12.719 697 HG3 ARG 100 HG3 ARG 100 12.681 2.512 -11.865 698 HD2 ARG 100 HD2 ARG 100 9.765 3.220 -11.461 699 HD3 ARG 100 HD3 ARG 100 10.636 2.073 -10.448 700 HE ARG 100 HE ARG 100 12.140 4.439 -10.530 701 HH11 ARG 100 HH11 ARG 100 9.011 3.381 -9.353 702 HH12 ARG 100 HH12 ARG 100 8.976 4.542 -8.067 703 HH21 ARG 100 HH21 ARG 100 12.062 5.913 -8.832 704 HH22 ARG 100 HH22 ARG 100 10.691 5.964 -7.777 705 H ASP 101 H ASP 101 13.434 5.953 -14.395 706 HA ASP 101 HA ASP 101 13.207 7.731 -15.822 707 HB2 ASP 101 HB2 ASP 101 14.921 6.224 -16.877 708 HB3 ASP 101 HB3 ASP 101 13.647 5.620 -17.934 709 H GLU 102 H GLU 102 10.931 7.887 -15.227 710 HA GLU 102 HA GLU 102 8.808 8.492 -15.844 711 HB2 GLU 102 HB2 GLU 102 9.860 9.034 -18.112 712 HB3 GLU 102 HB3 GLU 102 9.303 7.444 -18.632 713 HG2 GLU 102 HG2 GLU 102 7.622 9.096 -19.236 714 HG3 GLU 102 HG3 GLU 102 6.983 8.078 -17.952 715 H VAL 103 H VAL 103 7.115 7.442 -15.201 716 HA VAL 103 HA VAL 103 6.677 4.651 -16.073 717 HB VAL 103 HB VAL 103 5.965 4.035 -13.780 718 HG11 VAL 103 HG11 VAL 103 8.779 5.096 -14.149 719 HG12 VAL 103 HG12 VAL 103 8.207 3.448 -14.415 720 HG13 VAL 103 HG13 VAL 103 8.292 4.098 -12.777 721 HG21 VAL 103 HG21 VAL 103 5.353 6.141 -12.809 722 HG22 VAL 103 HG22 VAL 103 6.932 6.840 -13.166 723 HG23 VAL 103 HG23 VAL 103 6.778 5.599 -11.926 724 H ALA 104 H ALA 104 4.522 3.934 -16.058 725 HA ALA 104 HA ALA 104 2.575 6.112 -16.341 726 HB1 ALA 104 HB1 ALA 104 2.543 3.224 -17.245 727 HB2 ALA 104 HB2 ALA 104 2.721 4.659 -18.252 728 HB3 ALA 104 HB3 ALA 104 1.185 4.329 -17.453 729 H GLU 105 H GLU 105 2.869 6.066 -13.820 730 HA GLU 105 HA GLU 105 1.658 4.103 -12.225 731 HB2 GLU 105 HB2 GLU 105 3.048 6.013 -11.379 732 HB3 GLU 105 HB3 GLU 105 1.674 7.079 -11.670 733 HG2 GLU 105 HG2 GLU 105 0.282 5.716 -10.121 734 HG3 GLU 105 HG3 GLU 105 1.667 4.659 -9.843 735 H GLN 106 H GLN 106 0.271 6.898 -13.896 736 HA GLN 106 HA GLN 106 -2.311 6.843 -12.792 737 HB2 GLN 106 HB2 GLN 106 -1.343 7.674 -15.535 738 HB3 GLN 106 HB3 GLN 106 -3.004 7.901 -14.987 739 HG2 GLN 106 HG2 GLN 106 -2.278 9.304 -13.156 740 HG3 GLN 106 HG3 GLN 106 -0.584 8.950 -13.493 741 HE21 GLN 106 HE21 GLN 106 -2.030 11.607 -13.532 742 HE22 GLN 106 HE22 GLN 106 -1.753 12.235 -15.084 743 H LEU 107 H LEU 107 -3.087 4.778 -12.530 744 HA LEU 107 HA LEU 107 -3.015 2.656 -14.282 745 HB2 LEU 107 HB2 LEU 107 -4.320 3.243 -11.831 746 HB3 LEU 107 HB3 LEU 107 -5.590 2.712 -12.928 747 HG LEU 107 HG LEU 107 -3.008 1.172 -12.570 748 HD11 LEU 107 HD11 LEU 107 -4.433 1.497 -10.424 749 HD12 LEU 107 HD12 LEU 107 -3.991 -0.147 -10.878 750 HD13 LEU 107 HD13 LEU 107 -5.612 0.455 -11.218 751 HD21 LEU 107 HD21 LEU 107 -5.735 0.205 -13.460 752 HD22 LEU 107 HD22 LEU 107 -4.185 -0.616 -13.637 753 HD23 LEU 107 HD23 LEU 107 -4.534 0.823 -14.595 754 H VAL 108 H VAL 108 -4.848 5.569 -14.645 755 HA VAL 108 HA VAL 108 -6.245 4.380 -16.971 756 HB VAL 108 HB VAL 108 -7.814 4.932 -15.119 757 HG11 VAL 108 HG11 VAL 108 -7.257 7.853 -15.606 758 HG12 VAL 108 HG12 VAL 108 -6.348 6.963 -14.390 759 HG13 VAL 108 HG13 VAL 108 -8.100 7.093 -14.256 760 HG21 VAL 108 HG21 VAL 108 -8.074 6.736 -17.543 761 HG22 VAL 108 HG22 VAL 108 -9.392 6.215 -16.496 762 HG23 VAL 108 HG23 VAL 108 -8.536 5.036 -17.487 763 H GLY 109 H GLY 109 -6.206 5.528 -18.871 764 HA2 GLY 109 HA2 GLY 109 -5.076 8.219 -18.956 765 HA3 GLY 109 HA3 GLY 109 -4.132 6.959 -19.744 766 H VAL 110 H VAL 110 -5.123 9.123 -21.155 767 HA VAL 110 HA VAL 110 -6.223 9.661 -23.096 768 HB VAL 110 HB VAL 110 -6.757 6.678 -23.313 769 HG11 VAL 110 HG11 VAL 110 -6.859 7.165 -25.741 770 HG12 VAL 110 HG12 VAL 110 -6.647 8.881 -25.399 771 HG13 VAL 110 HG13 VAL 110 -8.103 8.049 -24.855 772 HG21 VAL 110 HG21 VAL 110 -4.704 6.642 -24.709 773 HG22 VAL 110 HG22 VAL 110 -4.347 7.132 -23.053 774 HG23 VAL 110 HG23 VAL 110 -4.429 8.345 -24.332 775 H SER 111 H SER 111 -8.299 10.120 -23.883 776 HA SER 111 HA SER 111 -10.638 8.955 -22.616 777 HB2 SER 111 HB2 SER 111 -11.471 11.023 -21.661 778 HB3 SER 111 HB3 SER 111 -9.886 10.672 -20.976 779 HG SER 111 HG SER 111 -10.500 12.461 -23.098 780 H ALA 112 H ALA 112 -12.638 9.717 -23.550 781 HA ALA 112 HA ALA 112 -12.513 11.369 -25.942 782 HB1 ALA 112 HB1 ALA 112 -11.988 9.407 -27.085 783 HB2 ALA 112 HB2 ALA 112 -13.748 9.439 -27.194 784 HB3 ALA 112 HB3 ALA 112 -12.956 8.402 -26.009 785 H ALA 113 H ALA 113 -14.581 11.979 -26.728 786 HA ALA 113 HA ALA 113 -16.950 11.137 -25.264 787 HB1 ALA 113 HB1 ALA 113 -15.896 13.968 -25.118 788 HB2 ALA 113 HB2 ALA 113 -16.193 12.865 -23.774 789 HB3 ALA 113 HB3 ALA 113 -17.548 13.516 -24.696 790 H SER 114 H SER 114 -16.111 14.022 -27.213 791 HA SER 114 HA SER 114 -17.834 13.012 -29.382 792 HB2 SER 114 HB2 SER 114 -18.028 15.771 -28.148 793 HB3 SER 114 HB3 SER 114 -18.867 15.252 -29.608 794 HG SER 114 HG SER 114 -19.982 15.088 -27.461 795 H ALA 115 H ALA 115 -17.146 13.522 -31.412 796 HA ALA 115 HA ALA 115 -15.171 15.598 -31.864 797 HB1 ALA 115 HB1 ALA 115 -13.476 14.106 -31.457 798 HB2 ALA 115 HB2 ALA 115 -13.808 13.664 -33.133 799 HB3 ALA 115 HB3 ALA 115 -14.484 12.703 -31.816 800 H ALA 116 H ALA 116 -14.992 16.163 -34.051 801 HA ALA 116 HA ALA 116 -16.715 14.703 -35.936 802 HB1 ALA 116 HB1 ALA 116 -16.706 17.713 -35.860 803 HB2 ALA 116 HB2 ALA 116 -17.834 16.777 -34.881 804 HB3 ALA 116 HB3 ALA 116 -17.862 16.632 -36.638 805 H ALA 117 H ALA 117 -13.996 16.817 -35.339 806 HA ALA 117 HA ALA 117 -13.251 17.505 -37.920 807 HB1 ALA 117 HB1 ALA 117 -11.267 16.785 -35.762 808 HB2 ALA 117 HB2 ALA 117 -12.204 18.279 -35.732 809 HB3 ALA 117 HB3 ALA 117 -11.082 17.970 -37.056 810 H SER 118 H SER 118 -12.357 14.556 -36.071 811 HA SER 118 HA SER 118 -12.166 13.047 -38.510 812 HB2 SER 118 HB2 SER 118 -9.831 12.408 -38.274 813 HB3 SER 118 HB3 SER 118 -9.935 14.161 -38.425 814 HG SER 118 HG SER 118 -9.816 14.260 -36.130 815 H ALA 119 H ALA 119 -12.201 10.825 -38.094 816 HA ALA 119 HA ALA 119 -12.047 9.925 -35.333 817 HB1 ALA 119 HB1 ALA 119 -14.344 10.598 -35.387 818 HB2 ALA 119 HB2 ALA 119 -14.320 8.838 -35.506 819 HB3 ALA 119 HB3 ALA 119 -14.599 9.815 -36.947 820 H PHE 120 H PHE 120 -11.867 7.642 -35.125 821 HA PHE 120 HA PHE 120 -10.578 6.330 -37.291 822 HB2 PHE 120 HB2 PHE 120 -10.528 4.367 -35.817 823 HB3 PHE 120 HB3 PHE 120 -10.044 5.822 -34.948 824 HD1 PHE 120 HD1 PHE 120 -12.667 3.271 -35.363 825 HD2 PHE 120 HD2 PHE 120 -11.498 6.819 -33.242 826 HE1 PHE 120 HE1 PHE 120 -14.460 2.866 -33.698 827 HE2 PHE 120 HE2 PHE 120 -13.291 6.415 -31.579 828 HZ PHE 120 HZ PHE 120 -14.773 4.438 -31.806 829 H GLY 121 H GLY 121 -13.893 6.624 -36.410 830 HA2 GLY 121 HA2 GLY 121 -14.771 5.182 -38.737 831 HA3 GLY 121 HA3 GLY 121 -15.136 4.325 -37.240 832 H SER 122 H SER 122 -17.273 4.983 -38.650 833 HA SER 122 HA SER 122 -18.412 7.331 -37.250 834 HB2 SER 122 HB2 SER 122 -18.981 6.417 -40.078 835 HB3 SER 122 HB3 SER 122 -19.831 7.711 -39.240 836 HG SER 122 HG SER 122 -18.256 8.951 -39.842 837 H LEU 123 H LEU 123 -20.553 7.161 -36.569 838 HA LEU 123 HA LEU 123 -21.533 4.399 -36.315 839 HB2 LEU 123 HB2 LEU 123 -21.190 6.171 -34.359 840 HB3 LEU 123 HB3 LEU 123 -22.773 6.724 -34.880 841 HG LEU 123 HG LEU 123 -23.009 5.124 -33.046 842 HD11 LEU 123 HD11 LEU 123 -24.662 3.713 -33.969 843 HD12 LEU 123 HD12 LEU 123 -23.834 3.618 -35.524 844 HD13 LEU 123 HD13 LEU 123 -24.632 5.114 -35.040 845 HD21 LEU 123 HD21 LEU 123 -20.813 3.922 -33.651 846 HD22 LEU 123 HD22 LEU 123 -21.782 2.979 -34.782 847 HD23 LEU 123 HD23 LEU 123 -22.138 2.924 -33.055 848 H SER 124 H SER 124 -22.847 3.836 -37.944 849 HA SER 124 HA SER 124 -25.214 5.466 -38.463 850 HB2 SER 124 HB2 SER 124 -23.302 4.604 -40.650 851 HB3 SER 124 HB3 SER 124 -24.889 5.320 -40.915 852 HG SER 124 HG SER 124 -24.180 7.212 -40.120 853 H SER 125 H SER 125 -24.783 2.987 -37.083 854 HA SER 125 HA SER 125 -26.422 1.218 -38.744 855 HB2 SER 125 HB2 SER 125 -24.135 0.348 -38.858 856 HB3 SER 125 HB3 SER 125 -24.024 0.376 -37.101 857 HG SER 125 HG SER 125 -24.832 -1.603 -38.515 858 H ALA 126 H ALA 126 -27.872 -0.076 -37.558 859 HA ALA 126 HA ALA 126 -27.952 0.311 -34.655 860 HB1 ALA 126 HB1 ALA 126 -29.509 1.935 -34.921 861 HB2 ALA 126 HB2 ALA 126 -30.607 0.587 -35.234 862 HB3 ALA 126 HB3 ALA 126 -29.866 1.457 -36.581 863 H LEU 127 H LEU 127 -29.112 -1.267 -33.531 864 HA LEU 127 HA LEU 127 -30.389 -3.410 -35.036 865 HB2 LEU 127 HB2 LEU 127 -27.996 -4.070 -34.895 866 HB3 LEU 127 HB3 LEU 127 -28.076 -3.939 -33.143 867 HG LEU 127 HG LEU 127 -29.890 -5.686 -33.157 868 HD11 LEU 127 HD11 LEU 127 -29.147 -5.803 -36.095 869 HD12 LEU 127 HD12 LEU 127 -30.740 -5.496 -35.405 870 HD13 LEU 127 HD13 LEU 127 -30.012 -7.095 -35.260 871 HD21 LEU 127 HD21 LEU 127 -27.250 -6.469 -34.429 872 HD22 LEU 127 HD22 LEU 127 -28.347 -7.570 -33.598 873 HD23 LEU 127 HD23 LEU 127 -27.546 -6.279 -32.701 874 H LEU 128 H LEU 128 -32.204 -3.986 -34.025 875 HA LEU 128 HA LEU 128 -32.744 -3.004 -31.341 876 HB2 LEU 128 HB2 LEU 128 -34.368 -4.299 -33.517 877 HB3 LEU 128 HB3 LEU 128 -34.993 -4.251 -31.870 878 HG LEU 128 HG LEU 128 -34.486 -1.730 -31.920 879 HD11 LEU 128 HD11 LEU 128 -33.034 -1.615 -33.838 880 HD12 LEU 128 HD12 LEU 128 -34.530 -0.785 -34.273 881 HD13 LEU 128 HD13 LEU 128 -34.225 -2.420 -34.859 882 HD21 LEU 128 HD21 LEU 128 -36.767 -2.758 -32.135 883 HD22 LEU 128 HD22 LEU 128 -36.558 -2.758 -33.885 884 HD23 LEU 128 HD23 LEU 128 -36.608 -1.231 -33.003 885 H MET 129 H MET 129 -32.894 -4.189 -29.520 886 HA MET 129 HA MET 129 -31.679 -6.782 -29.454 887 HB2 MET 129 HB2 MET 129 -32.110 -6.674 -27.034 888 HB3 MET 129 HB3 MET 129 -31.407 -5.168 -27.614 889 HG2 MET 129 HG2 MET 129 -33.691 -4.177 -27.727 890 HG3 MET 129 HG3 MET 129 -34.349 -5.673 -27.059 891 HE1 MET 129 HE1 MET 129 -32.286 -6.594 -24.755 892 HE2 MET 129 HE2 MET 129 -34.032 -6.613 -24.992 893 HE3 MET 129 HE3 MET 129 -33.357 -5.900 -23.531 894 HA PRO 130 HA PRO 130 -35.290 -9.350 -29.862 895 HB2 PRO 130 HB2 PRO 130 -34.762 -11.468 -28.237 896 HB3 PRO 130 HB3 PRO 130 -33.898 -11.194 -29.763 897 HG2 PRO 130 HG2 PRO 130 -33.053 -10.559 -26.972 898 HG3 PRO 130 HG3 PRO 130 -32.118 -11.280 -28.296 899 HD2 PRO 130 HD2 PRO 130 -31.906 -8.650 -27.640 900 HD3 PRO 130 HD3 PRO 130 -31.708 -9.232 -29.307 901 H LYS 131 H LYS 131 -37.256 -9.995 -28.840 902 HA LYS 131 HA LYS 131 -38.154 -8.350 -26.739 903 HB2 LYS 131 HB2 LYS 131 -39.596 -9.467 -28.477 904 HB3 LYS 131 HB3 LYS 131 -39.367 -10.983 -27.608 905 HG2 LYS 131 HG2 LYS 131 -40.398 -10.053 -25.608 906 HG3 LYS 131 HG3 LYS 131 -40.506 -8.464 -26.364 907 HD2 LYS 131 HD2 LYS 131 -42.682 -9.429 -26.575 908 HD3 LYS 131 HD3 LYS 131 -41.940 -9.562 -28.168 909 HE2 LYS 131 HE2 LYS 131 -41.334 -11.897 -27.721 910 HE3 LYS 131 HE3 LYS 131 -41.997 -11.774 -26.091 911 HZ1 LYS 131 HZ1 LYS 131 -43.668 -11.149 -28.436 912 HZ2 LYS 131 HZ2 LYS 131 -44.148 -11.630 -26.880 913 HZ3 LYS 131 HZ3 LYS 131 -43.454 -12.757 -27.945 914 H ASP 132 H ASP 132 -38.045 -8.531 -24.594 915 HA ASP 132 HA ASP 132 -37.270 -11.129 -23.407 916 HB2 ASP 132 HB2 ASP 132 -35.353 -9.552 -23.451 917 HB3 ASP 132 HB3 ASP 132 -36.311 -8.391 -22.541 918 H GLY 133 H GLY 133 -38.966 -11.830 -22.277 919 HA2 GLY 133 HA2 GLY 133 -40.831 -9.951 -21.042 920 HA3 GLY 133 HA3 GLY 133 -41.040 -11.695 -21.187 921 H LEU 134 H LEU 134 -41.323 -12.372 -19.133 922 HA LEU 134 HA LEU 134 -40.896 -12.850 -16.931 923 HB2 LEU 134 HB2 LEU 134 -38.265 -12.715 -18.258 924 HB3 LEU 134 HB3 LEU 134 -38.173 -12.413 -16.531 925 HG LEU 134 HG LEU 134 -37.844 -14.803 -17.038 926 HD11 LEU 134 HD11 LEU 134 -40.565 -14.558 -15.754 927 HD12 LEU 134 HD12 LEU 134 -39.104 -13.984 -14.951 928 HD13 LEU 134 HD13 LEU 134 -39.265 -15.689 -15.373 929 HD21 LEU 134 HD21 LEU 134 -39.351 -14.726 -19.116 930 HD22 LEU 134 HD22 LEU 134 -40.709 -14.912 -18.005 931 HD23 LEU 134 HD23 LEU 134 -39.476 -16.168 -18.108 932 H GLU 135 H GLU 135 -41.929 -11.325 -15.779 933 HA GLU 135 HA GLU 135 -41.262 -8.594 -15.626 934 HB2 GLU 135 HB2 GLU 135 -42.734 -8.541 -13.638 935 HB3 GLU 135 HB3 GLU 135 -43.472 -9.412 -14.979 936 HG2 GLU 135 HG2 GLU 135 -42.748 -11.561 -13.962 937 HG3 GLU 135 HG3 GLU 135 -42.063 -10.672 -12.603 938 H HIS 136 H HIS 136 -40.417 -7.396 -13.808 939 HA HIS 136 HA HIS 136 -37.896 -8.327 -12.934 940 HB2 HIS 136 HB2 HIS 136 -39.635 -6.022 -12.036 941 HB3 HIS 136 HB3 HIS 136 -38.022 -6.313 -11.386 942 HD2 HIS 136 HD2 HIS 136 -35.925 -5.509 -13.059 943 HE1 HIS 136 HE1 HIS 136 -38.289 -4.452 -16.394 944 HE2 HIS 136 HE2 HIS 136 -35.941 -4.414 -15.429 945 H HIS 137 H HIS 137 -41.056 -8.186 -11.342 946 HA HIS 137 HA HIS 137 -40.218 -8.940 -8.752 947 HB2 HIS 137 HB2 HIS 137 -42.463 -7.971 -9.365 948 HB3 HIS 137 HB3 HIS 137 -42.892 -9.541 -10.041 949 HD2 HIS 137 HD2 HIS 137 -44.045 -11.197 -8.159 950 HE1 HIS 137 HE1 HIS 137 -42.477 -9.363 -4.693 951 HE2 HIS 137 HE2 HIS 137 -44.004 -11.204 -5.549 952 H HIS 138 H HIS 138 -39.892 -10.891 -7.801 953 HA HIS 138 HA HIS 138 -40.599 -13.371 -9.121 954 HB2 HIS 138 HB2 HIS 138 -38.294 -14.244 -9.209 955 HB3 HIS 138 HB3 HIS 138 -38.493 -12.848 -10.263 956 HD2 HIS 138 HD2 HIS 138 -36.889 -10.637 -9.594 957 HE1 HIS 138 HE1 HIS 138 -35.170 -12.286 -6.109 958 HE2 HIS 138 HE2 HIS 138 -35.086 -10.331 -7.728 959 H HIS 139 H HIS 139 -39.974 -15.280 -7.793 960 HA HIS 139 HA HIS 139 -39.293 -14.807 -5.018 961 HB2 HIS 139 HB2 HIS 139 -41.375 -15.768 -4.111 962 HB3 HIS 139 HB3 HIS 139 -41.683 -14.271 -4.985 963 HD2 HIS 139 HD2 HIS 139 -43.343 -14.544 -7.241 964 HE1 HIS 139 HE1 HIS 139 -43.788 -18.737 -7.038 965 HE2 HIS 139 HE2 HIS 139 -44.589 -16.628 -8.201 966 H HIS 140 H HIS 140 -39.219 -16.856 -3.769 967 HA HIS 140 HA HIS 140 -39.109 -19.320 -5.328 968 HB2 HIS 140 HB2 HIS 140 -36.867 -18.220 -5.610 969 HB3 HIS 140 HB3 HIS 140 -36.657 -18.312 -3.863 970 HD2 HIS 140 HD2 HIS 140 -35.495 -20.688 -3.065 971 HE1 HIS 140 HE1 HIS 140 -36.418 -22.989 -6.483 972 HE2 HIS 140 HE2 HIS 140 -35.218 -23.001 -4.245 973 H HIS 141 H HIS 141 -39.479 -21.104 -4.097 974 HA HIS 141 HA HIS 141 -40.451 -20.724 -1.418 975 HB2 HIS 141 HB2 HIS 141 -40.015 -23.264 -3.012 976 HB3 HIS 141 HB3 HIS 141 -40.874 -23.164 -1.476 977 HD2 HIS 141 HD2 HIS 141 -41.655 -22.843 -5.200 978 HE1 HIS 141 HE1 HIS 141 -44.863 -20.976 -3.189 979 HE2 HIS 141 HE2 HIS 141 -44.060 -21.855 -5.432 Start of MODEL 12 1 H1 MET 1 HT1 MET 1 -1.465 6.180 -11.765 2 H2 MET 1 HT2 MET 1 -1.309 7.172 -13.134 3 H3 MET 1 HT3 MET 1 0.050 6.377 -12.498 4 HA MET 1 HA MET 1 -0.492 4.378 -13.384 5 HB2 MET 1 HB2 MET 1 -2.696 4.394 -12.149 6 HB3 MET 1 HB3 MET 1 -3.389 5.253 -13.523 7 HG2 MET 1 HG2 MET 1 -3.840 2.881 -13.794 8 HG3 MET 1 HG3 MET 1 -2.657 3.367 -15.006 9 HE1 MET 1 HE1 MET 1 -3.074 0.304 -14.282 10 HE2 MET 1 HE2 MET 1 -1.372 -0.137 -14.383 11 HE3 MET 1 HE3 MET 1 -2.032 1.063 -15.494 12 H SER 2 H SER 2 0.084 4.097 -15.426 13 HA SER 2 HA SER 2 0.531 4.555 -17.640 14 HB2 SER 2 HB2 SER 2 -1.933 3.848 -17.615 15 HB3 SER 2 HB3 SER 2 -2.311 5.561 -17.767 16 HG SER 2 HG SER 2 -1.102 3.807 -19.573 17 H ASP 3 H ASP 3 1.280 6.604 -15.844 18 HA ASP 3 HA ASP 3 1.319 8.880 -17.674 19 HB2 ASP 3 HB2 ASP 3 0.666 10.480 -15.939 20 HB3 ASP 3 HB3 ASP 3 -0.624 9.320 -16.223 21 H GLN 4 H GLN 4 2.714 10.697 -16.500 22 HA GLN 4 HA GLN 4 4.988 9.407 -15.117 23 HB2 GLN 4 HB2 GLN 4 5.088 11.299 -17.476 24 HB3 GLN 4 HB3 GLN 4 6.487 10.922 -16.468 25 HG2 GLN 4 HG2 GLN 4 6.353 8.577 -17.039 26 HG3 GLN 4 HG3 GLN 4 4.821 8.819 -17.874 27 HE21 GLN 4 HE21 GLN 4 7.448 7.813 -18.973 28 HE22 GLN 4 HE22 GLN 4 7.820 8.857 -20.258 29 H SER 5 H SER 5 5.592 10.432 -13.321 30 HA SER 5 HA SER 5 5.240 13.320 -13.068 31 HB2 SER 5 HB2 SER 5 3.114 12.445 -12.227 32 HB3 SER 5 HB3 SER 5 3.970 11.361 -11.136 33 HG SER 5 HG SER 5 3.965 12.982 -9.807 34 H GLN 6 H GLN 6 5.814 10.706 -10.680 35 HA GLN 6 HA GLN 6 8.612 10.915 -10.583 36 HB2 GLN 6 HB2 GLN 6 7.890 13.229 -9.675 37 HB3 GLN 6 HB3 GLN 6 7.321 12.352 -8.257 38 HG2 GLN 6 HG2 GLN 6 9.586 13.112 -7.830 39 HG3 GLN 6 HG3 GLN 6 9.608 11.359 -8.018 40 HE21 GLN 6 HE21 GLN 6 9.883 14.268 -10.158 41 HE22 GLN 6 HE22 GLN 6 11.147 13.628 -11.094 42 H GLU 7 H GLU 7 8.410 8.682 -10.406 43 HA GLU 7 HA GLU 7 8.129 6.641 -9.365 44 HB2 GLU 7 HB2 GLU 7 8.370 8.449 -6.953 45 HB3 GLU 7 HB3 GLU 7 8.435 6.684 -6.871 46 HG2 GLU 7 HG2 GLU 7 10.383 6.687 -8.389 47 HG3 GLU 7 HG3 GLU 7 10.317 8.446 -8.472 48 HA PRO 8 HA PRO 8 3.495 7.679 -9.093 49 HB2 PRO 8 HB2 PRO 8 2.988 5.043 -10.094 50 HB3 PRO 8 HB3 PRO 8 2.804 6.583 -10.953 51 HG2 PRO 8 HG2 PRO 8 5.022 4.638 -11.021 52 HG3 PRO 8 HG3 PRO 8 4.466 5.774 -12.263 53 HD2 PRO 8 HD2 PRO 8 6.752 6.202 -10.902 54 HD3 PRO 8 HD3 PRO 8 5.696 7.551 -11.382 55 H THR 9 H THR 9 2.945 7.573 -7.029 56 HA THR 9 HA THR 9 3.699 5.486 -5.233 57 HB THR 9 HB THR 9 2.201 6.618 -3.623 58 HG1 THR 9 HG1 THR 9 1.622 8.365 -5.771 59 HG21 THR 9 HG21 THR 9 4.543 7.463 -4.233 60 HG22 THR 9 HG22 THR 9 3.468 8.624 -3.452 61 HG23 THR 9 HG23 THR 9 3.728 8.697 -5.195 62 H MET 10 H MET 10 2.461 3.924 -4.246 63 HA MET 10 HA MET 10 0.732 2.443 -5.858 64 HB2 MET 10 HB2 MET 10 1.176 2.387 -2.872 65 HB3 MET 10 HB3 MET 10 0.187 1.201 -3.725 66 HG2 MET 10 HG2 MET 10 2.100 0.587 -5.136 67 HG3 MET 10 HG3 MET 10 3.097 1.802 -4.333 68 HE1 MET 10 HE1 MET 10 4.431 -1.696 -3.149 69 HE2 MET 10 HE2 MET 10 4.872 -0.150 -3.870 70 HE3 MET 10 HE3 MET 10 3.757 -1.223 -4.714 71 H GLU 11 H GLU 11 -0.044 4.746 -3.274 72 HA GLU 11 HA GLU 11 -2.846 4.260 -3.183 73 HB2 GLU 11 HB2 GLU 11 -1.236 6.759 -2.601 74 HB3 GLU 11 HB3 GLU 11 -2.975 6.644 -2.326 75 HG2 GLU 11 HG2 GLU 11 -2.620 4.729 -0.819 76 HG3 GLU 11 HG3 GLU 11 -0.881 4.824 -1.099 77 H GLU 12 H GLU 12 -0.941 6.661 -4.905 78 HA GLU 12 HA GLU 12 -2.866 7.967 -6.366 79 HB2 GLU 12 HB2 GLU 12 -0.426 8.519 -6.349 80 HB3 GLU 12 HB3 GLU 12 -0.155 7.182 -7.463 81 HG2 GLU 12 HG2 GLU 12 -1.680 8.233 -9.100 82 HG3 GLU 12 HG3 GLU 12 -1.953 9.569 -7.987 83 H ILE 13 H ILE 13 -1.214 4.923 -7.341 84 HA ILE 13 HA ILE 13 -2.442 4.617 -9.821 85 HB ILE 13 HB ILE 13 -1.485 2.513 -7.862 86 HG12 ILE 13 HG12 ILE 13 0.277 4.094 -8.531 87 HG13 ILE 13 HG13 ILE 13 0.575 2.516 -9.235 88 HG21 ILE 13 HG21 ILE 13 -1.194 1.148 -10.041 89 HG22 ILE 13 HG22 ILE 13 -2.340 2.288 -10.748 90 HG23 ILE 13 HG23 ILE 13 -2.822 1.292 -9.377 91 HD11 ILE 13 HD11 ILE 13 -0.404 5.028 -10.606 92 HD12 ILE 13 HD12 ILE 13 -0.613 3.441 -11.346 93 HD13 ILE 13 HD13 ILE 13 1.005 4.046 -11.000 94 H LEU 14 H LEU 14 -3.545 3.365 -6.620 95 HA LEU 14 HA LEU 14 -5.835 2.036 -7.606 96 HB2 LEU 14 HB2 LEU 14 -5.070 3.142 -4.913 97 HB3 LEU 14 HB3 LEU 14 -6.693 2.515 -5.187 98 HG LEU 14 HG LEU 14 -5.523 0.407 -6.120 99 HD11 LEU 14 HD11 LEU 14 -3.235 1.628 -4.554 100 HD12 LEU 14 HD12 LEU 14 -3.260 1.381 -6.298 101 HD13 LEU 14 HD13 LEU 14 -3.265 -0.003 -5.214 102 HD21 LEU 14 HD21 LEU 14 -6.672 0.672 -3.856 103 HD22 LEU 14 HD22 LEU 14 -5.073 0.955 -3.176 104 HD23 LEU 14 HD23 LEU 14 -5.445 -0.588 -3.942 105 H ALA 15 H ALA 15 -5.382 5.331 -6.380 106 HA ALA 15 HA ALA 15 -8.059 6.195 -6.573 107 HB1 ALA 15 HB1 ALA 15 -7.091 8.478 -6.554 108 HB2 ALA 15 HB2 ALA 15 -5.487 7.776 -6.777 109 HB3 ALA 15 HB3 ALA 15 -6.397 7.443 -5.303 110 H SER 16 H SER 16 -5.416 6.177 -8.895 111 HA SER 16 HA SER 16 -6.575 7.757 -10.910 112 HB2 SER 16 HB2 SER 16 -4.215 7.091 -10.961 113 HB3 SER 16 HB3 SER 16 -4.683 5.411 -11.199 114 HG SER 16 HG SER 16 -5.112 7.623 -12.921 115 H ILE 17 H ILE 17 -6.650 4.229 -10.431 116 HA ILE 17 HA ILE 17 -8.301 3.700 -12.676 117 HB ILE 17 HB ILE 17 -7.922 2.026 -10.176 118 HG12 ILE 17 HG12 ILE 17 -5.754 2.519 -11.233 119 HG13 ILE 17 HG13 ILE 17 -6.176 0.830 -11.474 120 HG21 ILE 17 HG21 ILE 17 -9.049 1.398 -12.908 121 HG22 ILE 17 HG22 ILE 17 -9.793 1.141 -11.331 122 HG23 ILE 17 HG23 ILE 17 -8.433 0.139 -11.839 123 HD11 ILE 17 HD11 ILE 17 -6.152 3.080 -13.489 124 HD12 ILE 17 HD12 ILE 17 -7.147 1.653 -13.769 125 HD13 ILE 17 HD13 ILE 17 -5.401 1.488 -13.599 126 H ARG 18 H ARG 18 -9.336 3.071 -9.296 127 HA ARG 18 HA ARG 18 -11.416 3.195 -8.317 128 HB2 ARG 18 HB2 ARG 18 -11.294 5.802 -9.834 129 HB3 ARG 18 HB3 ARG 18 -12.616 5.401 -8.741 130 HG2 ARG 18 HG2 ARG 18 -11.053 5.129 -6.886 131 HG3 ARG 18 HG3 ARG 18 -9.686 5.411 -7.964 132 HD2 ARG 18 HD2 ARG 18 -10.200 7.470 -6.751 133 HD3 ARG 18 HD3 ARG 18 -10.577 7.680 -8.460 134 HE ARG 18 HE ARG 18 -12.878 6.782 -7.032 135 HH11 ARG 18 HH11 ARG 18 -10.913 9.637 -7.560 136 HH12 ARG 18 HH12 ARG 18 -12.214 10.734 -7.236 137 HH21 ARG 18 HH21 ARG 18 -14.539 8.244 -6.616 138 HH22 ARG 18 HH22 ARG 18 -14.248 9.949 -6.704 139 H ARG 19 H ARG 19 -13.870 3.654 -8.794 140 HA ARG 19 HA ARG 19 -14.666 1.840 -10.843 141 HB2 ARG 19 HB2 ARG 19 -16.236 3.771 -9.129 142 HB3 ARG 19 HB3 ARG 19 -16.988 2.664 -10.277 143 HG2 ARG 19 HG2 ARG 19 -15.859 0.760 -9.115 144 HG3 ARG 19 HG3 ARG 19 -15.251 1.901 -7.914 145 HD2 ARG 19 HD2 ARG 19 -17.550 2.534 -7.325 146 HD3 ARG 19 HD3 ARG 19 -18.178 1.442 -8.556 147 HE ARG 19 HE ARG 19 -17.704 -0.365 -7.151 148 HH11 ARG 19 HH11 ARG 19 -16.307 2.565 -5.831 149 HH12 ARG 19 HH12 ARG 19 -15.940 1.836 -4.304 150 HH21 ARG 19 HH21 ARG 19 -17.198 -1.273 -5.159 151 HH22 ARG 19 HH22 ARG 19 -16.438 -0.321 -3.928 152 H ILE 20 H ILE 20 -14.712 5.371 -10.562 153 HA ILE 20 HA ILE 20 -14.481 5.778 -13.363 154 HB ILE 20 HB ILE 20 -16.847 5.063 -13.326 155 HG12 ILE 20 HG12 ILE 20 -17.818 7.205 -14.348 156 HG13 ILE 20 HG13 ILE 20 -16.283 7.973 -13.949 157 HG21 ILE 20 HG21 ILE 20 -17.357 7.512 -11.617 158 HG22 ILE 20 HG22 ILE 20 -17.300 5.867 -10.984 159 HG23 ILE 20 HG23 ILE 20 -18.542 6.320 -12.152 160 HD11 ILE 20 HD11 ILE 20 -16.458 5.419 -15.564 161 HD12 ILE 20 HD12 ILE 20 -15.063 6.480 -15.368 162 HD13 ILE 20 HD13 ILE 20 -16.454 7.018 -16.307 163 H ILE 21 H ILE 21 -13.848 7.847 -13.819 164 HA ILE 21 HA ILE 21 -13.920 9.808 -11.599 165 HB ILE 21 HB ILE 21 -11.657 9.370 -13.579 166 HG12 ILE 21 HG12 ILE 21 -11.668 9.011 -10.567 167 HG13 ILE 21 HG13 ILE 21 -11.963 7.680 -11.683 168 HG21 ILE 21 HG21 ILE 21 -12.109 11.399 -11.366 169 HG22 ILE 21 HG22 ILE 21 -11.742 11.717 -13.061 170 HG23 ILE 21 HG23 ILE 21 -10.503 11.038 -12.004 171 HD11 ILE 21 HD11 ILE 21 -9.466 9.406 -11.602 172 HD12 ILE 21 HD12 ILE 21 -9.761 8.093 -12.742 173 HD13 ILE 21 HD13 ILE 21 -9.591 7.746 -11.021 174 H SER 22 H SER 22 -14.527 9.167 -14.947 175 HA SER 22 HA SER 22 -15.420 10.429 -16.642 176 HB2 SER 22 HB2 SER 22 -16.198 12.268 -14.361 177 HB3 SER 22 HB3 SER 22 -16.841 12.348 -15.999 178 HG SER 22 HG SER 22 -17.854 10.443 -15.701 179 H GLU 23 H GLU 23 -12.794 10.609 -16.531 180 HA GLU 23 HA GLU 23 -11.573 13.097 -16.144 181 HB2 GLU 23 HB2 GLU 23 -10.879 10.910 -18.121 182 HB3 GLU 23 HB3 GLU 23 -9.827 12.262 -17.705 183 HG2 GLU 23 HG2 GLU 23 -9.853 11.547 -15.337 184 HG3 GLU 23 HG3 GLU 23 -10.885 10.184 -15.768 185 H ASP 24 H ASP 24 -10.828 14.647 -17.699 186 HA ASP 24 HA ASP 24 -11.127 16.196 -19.363 187 HB2 ASP 24 HB2 ASP 24 -10.795 14.035 -20.751 188 HB3 ASP 24 HB3 ASP 24 -12.544 14.089 -20.984 189 H ASP 25 H ASP 25 -13.046 16.029 -17.297 190 HA ASP 25 HA ASP 25 -15.552 16.745 -18.683 191 HB2 ASP 25 HB2 ASP 25 -16.689 16.283 -16.550 192 HB3 ASP 25 HB3 ASP 25 -15.796 14.875 -17.110 193 H ALA 26 H ALA 26 -14.407 18.818 -19.129 194 HA ALA 26 HA ALA 26 -13.748 20.604 -16.998 195 HB1 ALA 26 HB1 ALA 26 -14.085 20.861 -19.967 196 HB2 ALA 26 HB2 ALA 26 -12.648 21.132 -18.980 197 HB3 ALA 26 HB3 ALA 26 -13.960 22.312 -18.974 198 HA PRO 27 HA PRO 27 -17.846 22.109 -16.060 199 HB2 PRO 27 HB2 PRO 27 -17.349 24.630 -15.163 200 HB3 PRO 27 HB3 PRO 27 -16.929 23.180 -14.227 201 HG2 PRO 27 HG2 PRO 27 -15.189 24.887 -15.947 202 HG3 PRO 27 HG3 PRO 27 -14.865 24.208 -14.342 203 HD2 PRO 27 HD2 PRO 27 -13.891 23.077 -16.616 204 HD3 PRO 27 HD3 PRO 27 -14.328 22.114 -15.187 205 H ALA 28 H ALA 28 -19.526 23.354 -16.921 206 HA ALA 28 HA ALA 28 -18.991 24.539 -19.533 207 HB1 ALA 28 HB1 ALA 28 -21.635 24.080 -18.142 208 HB2 ALA 28 HB2 ALA 28 -20.848 22.919 -19.211 209 HB3 ALA 28 HB3 ALA 28 -21.394 24.471 -19.843 210 H GLU 29 H GLU 29 -19.016 25.764 -16.431 211 HA GLU 29 HA GLU 29 -19.556 28.458 -17.424 212 HB2 GLU 29 HB2 GLU 29 -20.918 28.983 -15.383 213 HB3 GLU 29 HB3 GLU 29 -21.707 27.854 -16.479 214 HG2 GLU 29 HG2 GLU 29 -20.955 25.962 -15.067 215 HG3 GLU 29 HG3 GLU 29 -20.189 27.097 -13.961 216 HA PRO 30 HA PRO 30 -15.892 27.778 -14.530 217 HB2 PRO 30 HB2 PRO 30 -13.900 28.506 -16.231 218 HB3 PRO 30 HB3 PRO 30 -14.505 26.847 -16.117 219 HG2 PRO 30 HG2 PRO 30 -15.153 28.970 -18.111 220 HG3 PRO 30 HG3 PRO 30 -14.820 27.246 -18.368 221 HD2 PRO 30 HD2 PRO 30 -17.350 28.232 -18.330 222 HD3 PRO 30 HD3 PRO 30 -16.961 26.598 -17.750 223 H ALA 31 H ALA 31 -14.677 29.416 -13.487 224 HA ALA 31 HA ALA 31 -14.652 32.130 -14.480 225 HB1 ALA 31 HB1 ALA 31 -16.195 33.115 -13.097 226 HB2 ALA 31 HB2 ALA 31 -16.012 31.894 -11.837 227 HB3 ALA 31 HB3 ALA 31 -16.968 31.540 -13.276 228 H ALA 32 H ALA 32 -13.341 33.527 -13.197 229 HA ALA 32 HA ALA 32 -11.892 32.298 -10.959 230 HB1 ALA 32 HB1 ALA 32 -10.378 33.710 -13.146 231 HB2 ALA 32 HB2 ALA 32 -10.670 31.972 -13.205 232 HB3 ALA 32 HB3 ALA 32 -9.750 32.667 -11.869 233 H GLU 33 H GLU 33 -11.461 33.693 -9.362 234 HA GLU 33 HA GLU 33 -10.913 36.442 -9.612 235 HB2 GLU 33 HB2 GLU 33 -13.373 36.452 -10.275 236 HB3 GLU 33 HB3 GLU 33 -13.729 35.949 -8.624 237 HG2 GLU 33 HG2 GLU 33 -12.573 37.951 -7.759 238 HG3 GLU 33 HG3 GLU 33 -12.213 38.456 -9.407 239 H ALA 34 H ALA 34 -9.843 36.981 -7.805 240 HA ALA 34 HA ALA 34 -10.062 35.259 -5.456 241 HB1 ALA 34 HB1 ALA 34 -7.814 35.828 -6.193 242 HB2 ALA 34 HB2 ALA 34 -8.117 36.599 -4.637 243 HB3 ALA 34 HB3 ALA 34 -8.191 37.549 -6.121 244 H ALA 35 H ALA 35 -11.150 35.758 -3.685 245 HA ALA 35 HA ALA 35 -11.837 38.560 -3.128 246 HB1 ALA 35 HB1 ALA 35 -14.066 36.676 -2.713 247 HB2 ALA 35 HB2 ALA 35 -13.620 36.920 -4.405 248 HB3 ALA 35 HB3 ALA 35 -14.067 38.303 -3.399 249 HA PRO 36 HA PRO 36 -11.059 37.568 1.130 250 HB2 PRO 36 HB2 PRO 36 -13.696 38.748 1.880 251 HB3 PRO 36 HB3 PRO 36 -12.068 39.165 2.453 252 HG2 PRO 36 HG2 PRO 36 -13.345 40.756 0.781 253 HG3 PRO 36 HG3 PRO 36 -11.605 40.463 0.598 254 HD2 PRO 36 HD2 PRO 36 -13.888 39.297 -0.977 255 HD3 PRO 36 HD3 PRO 36 -12.303 39.869 -1.549 256 HA PRO 37 HA PRO 37 -13.267 33.751 1.893 257 HB2 PRO 37 HB2 PRO 37 -12.792 33.331 4.555 258 HB3 PRO 37 HB3 PRO 37 -11.565 33.082 3.297 259 HG2 PRO 37 HG2 PRO 37 -11.968 35.416 5.116 260 HG3 PRO 37 HG3 PRO 37 -10.465 34.598 4.644 261 HD2 PRO 37 HD2 PRO 37 -11.236 36.933 3.503 262 HD3 PRO 37 HD3 PRO 37 -10.353 35.686 2.592 263 HA PRO 38 HA PRO 38 -17.274 34.975 3.476 264 HB2 PRO 38 HB2 PRO 38 -18.473 32.577 3.920 265 HB3 PRO 38 HB3 PRO 38 -18.158 33.198 2.288 266 HG2 PRO 38 HG2 PRO 38 -16.606 31.211 3.886 267 HG3 PRO 38 HG3 PRO 38 -17.070 31.164 2.174 268 HD2 PRO 38 HD2 PRO 38 -14.581 31.913 2.981 269 HD3 PRO 38 HD3 PRO 38 -15.354 32.585 1.527 270 HA PRO 39 HA PRO 39 -17.037 34.893 7.944 271 HB2 PRO 39 HB2 PRO 39 -19.608 35.368 8.687 272 HB3 PRO 39 HB3 PRO 39 -18.583 36.617 7.950 273 HG2 PRO 39 HG2 PRO 39 -20.670 34.895 6.685 274 HG3 PRO 39 HG3 PRO 39 -20.374 36.633 6.491 275 HD2 PRO 39 HD2 PRO 39 -19.512 34.811 4.665 276 HD3 PRO 39 HD3 PRO 39 -18.620 36.311 5.003 277 HA PRO 40 HA PRO 40 -18.118 30.794 9.348 278 HB2 PRO 40 HB2 PRO 40 -18.531 31.106 12.029 279 HB3 PRO 40 HB3 PRO 40 -16.919 31.168 11.285 280 HG2 PRO 40 HG2 PRO 40 -18.710 33.411 12.107 281 HG3 PRO 40 HG3 PRO 40 -16.963 33.222 12.340 282 HD2 PRO 40 HD2 PRO 40 -17.979 34.771 10.359 283 HD3 PRO 40 HD3 PRO 40 -16.462 33.866 10.161 284 H GLU 41 H GLU 41 -19.855 29.433 10.004 285 HA GLU 41 HA GLU 41 -22.446 30.441 9.390 286 HB2 GLU 41 HB2 GLU 41 -23.218 28.159 9.862 287 HB3 GLU 41 HB3 GLU 41 -21.777 28.138 8.853 288 HG2 GLU 41 HG2 GLU 41 -20.384 27.694 10.846 289 HG3 GLU 41 HG3 GLU 41 -21.824 27.718 11.860 290 HA PRO 42 HA PRO 42 -24.116 31.738 13.285 291 HB2 PRO 42 HB2 PRO 42 -26.402 29.849 12.932 292 HB3 PRO 42 HB3 PRO 42 -26.417 31.604 13.193 293 HG2 PRO 42 HG2 PRO 42 -26.960 30.612 10.815 294 HG3 PRO 42 HG3 PRO 42 -25.963 32.070 10.974 295 HD2 PRO 42 HD2 PRO 42 -25.089 29.247 10.410 296 HD3 PRO 42 HD3 PRO 42 -24.506 30.770 9.695 297 H GLU 43 H GLU 43 -24.083 31.179 15.441 298 HA GLU 43 HA GLU 43 -23.756 28.316 16.114 299 HB2 GLU 43 HB2 GLU 43 -22.192 30.664 17.216 300 HB3 GLU 43 HB3 GLU 43 -22.099 29.014 17.830 301 HG2 GLU 43 HG2 GLU 43 -21.330 28.223 15.630 302 HG3 GLU 43 HG3 GLU 43 -21.448 29.861 14.993 303 HA PRO 44 HA PRO 44 -26.909 29.110 19.144 304 HB2 PRO 44 HB2 PRO 44 -26.306 27.354 21.137 305 HB3 PRO 44 HB3 PRO 44 -26.967 26.841 19.571 306 HG2 PRO 44 HG2 PRO 44 -24.139 26.820 20.526 307 HG3 PRO 44 HG3 PRO 44 -25.036 25.579 19.630 308 HD2 PRO 44 HD2 PRO 44 -23.307 27.282 18.401 309 HD3 PRO 44 HD3 PRO 44 -24.762 26.656 17.592 310 H GLU 45 H GLU 45 -27.332 30.302 20.988 311 HA GLU 45 HA GLU 45 -25.030 31.174 22.621 312 HB2 GLU 45 HB2 GLU 45 -27.210 32.961 21.493 313 HB3 GLU 45 HB3 GLU 45 -25.965 33.472 22.633 314 HG2 GLU 45 HG2 GLU 45 -25.434 32.350 19.862 315 HG3 GLU 45 HG3 GLU 45 -25.382 34.057 20.286 316 HA PRO 46 HA PRO 46 -28.675 29.703 25.199 317 HB2 PRO 46 HB2 PRO 46 -27.281 28.087 26.890 318 HB3 PRO 46 HB3 PRO 46 -27.893 27.534 25.320 319 HG2 PRO 46 HG2 PRO 46 -25.147 28.428 26.068 320 HG3 PRO 46 HG3 PRO 46 -25.650 27.049 25.075 321 HD2 PRO 46 HD2 PRO 46 -24.770 29.374 23.973 322 HD3 PRO 46 HD3 PRO 46 -25.997 28.355 23.187 323 H VAL 47 H VAL 47 -29.273 30.449 27.224 324 HA VAL 47 HA VAL 47 -27.254 31.897 28.815 325 HB VAL 47 HB VAL 47 -28.883 33.728 29.193 326 HG11 VAL 47 HG11 VAL 47 -27.167 33.919 27.427 327 HG12 VAL 47 HG12 VAL 47 -28.643 34.770 26.978 328 HG13 VAL 47 HG13 VAL 47 -28.281 33.196 26.270 329 HG21 VAL 47 HG21 VAL 47 -30.963 32.485 28.735 330 HG22 VAL 47 HG22 VAL 47 -30.492 32.303 27.044 331 HG23 VAL 47 HG23 VAL 47 -30.854 33.903 27.691 332 H SER 48 H SER 48 -27.888 32.250 31.050 333 HA SER 48 HA SER 48 -29.923 30.321 32.009 334 HB2 SER 48 HB2 SER 48 -27.214 30.912 33.224 335 HB3 SER 48 HB3 SER 48 -28.450 29.893 33.954 336 HG SER 48 HG SER 48 -26.785 28.813 32.646 337 H PHE 49 H PHE 49 -31.197 30.960 33.696 338 HA PHE 49 HA PHE 49 -31.600 33.741 34.111 339 HB2 PHE 49 HB2 PHE 49 -32.647 31.290 35.533 340 HB3 PHE 49 HB3 PHE 49 -33.148 32.929 35.952 341 HD1 PHE 49 HD1 PHE 49 -33.273 30.285 33.395 342 HD2 PHE 49 HD2 PHE 49 -34.474 34.284 34.405 343 HE1 PHE 49 HE1 PHE 49 -34.903 30.267 31.525 344 HE2 PHE 49 HE2 PHE 49 -36.103 34.268 32.535 345 HZ PHE 49 HZ PHE 49 -36.318 32.258 31.096 346 H ASP 50 H ASP 50 -29.987 31.215 35.983 347 HA ASP 50 HA ASP 50 -29.366 33.036 38.170 348 HB2 ASP 50 HB2 ASP 50 -28.224 31.039 39.128 349 HB3 ASP 50 HB3 ASP 50 -29.916 30.750 38.738 350 H ASP 51 H ASP 51 -27.039 33.016 38.968 351 HA ASP 51 HA ASP 51 -25.401 34.302 37.102 352 HB2 ASP 51 HB2 ASP 51 -25.180 34.553 39.549 353 HB3 ASP 51 HB3 ASP 51 -24.544 32.913 39.650 354 H GLU 52 H GLU 52 -24.999 30.962 38.431 355 HA GLU 52 HA GLU 52 -24.254 29.821 35.969 356 HB2 GLU 52 HB2 GLU 52 -22.203 31.239 36.342 357 HB3 GLU 52 HB3 GLU 52 -21.922 30.354 37.839 358 HG2 GLU 52 HG2 GLU 52 -20.576 29.364 36.063 359 HG3 GLU 52 HG3 GLU 52 -21.837 28.231 36.533 360 H VAL 53 H VAL 53 -24.787 27.738 36.256 361 HA VAL 53 HA VAL 53 -24.391 26.576 38.934 362 HB VAL 53 HB VAL 53 -26.516 25.319 38.663 363 HG11 VAL 53 HG11 VAL 53 -26.744 28.337 38.496 364 HG12 VAL 53 HG12 VAL 53 -26.447 27.403 39.961 365 HG13 VAL 53 HG13 VAL 53 -27.988 27.253 39.119 366 HG21 VAL 53 HG21 VAL 53 -26.576 25.516 36.140 367 HG22 VAL 53 HG22 VAL 53 -27.036 27.206 36.343 368 HG23 VAL 53 HG23 VAL 53 -28.097 25.927 36.932 369 H LEU 54 H LEU 54 -24.266 24.224 38.966 370 HA LEU 54 HA LEU 54 -23.054 23.156 36.490 371 HB2 LEU 54 HB2 LEU 54 -22.505 22.782 39.404 372 HB3 LEU 54 HB3 LEU 54 -22.289 21.374 38.377 373 HG LEU 54 HG LEU 54 -20.176 22.617 38.667 374 HD11 LEU 54 HD11 LEU 54 -19.475 22.574 36.414 375 HD12 LEU 54 HD12 LEU 54 -21.064 23.055 35.817 376 HD13 LEU 54 HD13 LEU 54 -20.822 21.437 36.471 377 HD21 LEU 54 HD21 LEU 54 -21.330 24.884 38.892 378 HD22 LEU 54 HD22 LEU 54 -21.434 24.903 37.132 379 HD23 LEU 54 HD23 LEU 54 -19.856 24.864 37.921 380 H GLU 55 H GLU 55 -24.236 21.749 35.381 381 HA GLU 55 HA GLU 55 -25.638 19.583 36.621 382 HB2 GLU 55 HB2 GLU 55 -27.224 21.507 36.988 383 HB3 GLU 55 HB3 GLU 55 -27.369 21.641 35.235 384 HG2 GLU 55 HG2 GLU 55 -28.183 19.329 35.101 385 HG3 GLU 55 HG3 GLU 55 -27.993 19.148 36.844 386 H LEU 56 H LEU 56 -25.543 17.929 35.244 387 HA LEU 56 HA LEU 56 -25.619 18.455 32.341 388 HB2 LEU 56 HB2 LEU 56 -23.602 16.769 33.837 389 HB3 LEU 56 HB3 LEU 56 -23.870 16.627 32.101 390 HG LEU 56 HG LEU 56 -23.197 19.259 33.444 391 HD11 LEU 56 HD11 LEU 56 -21.356 17.674 33.820 392 HD12 LEU 56 HD12 LEU 56 -20.887 18.879 32.622 393 HD13 LEU 56 HD13 LEU 56 -21.349 17.256 32.107 394 HD21 LEU 56 HD21 LEU 56 -24.189 19.553 31.263 395 HD22 LEU 56 HD22 LEU 56 -23.205 18.258 30.580 396 HD23 LEU 56 HD23 LEU 56 -22.452 19.776 31.065 397 H THR 57 H THR 57 -27.729 17.719 32.207 398 HA THR 57 HA THR 57 -28.725 15.351 33.381 399 HB THR 57 HB THR 57 -29.657 16.795 30.877 400 HG1 THR 57 HG1 THR 57 -30.464 16.987 33.590 401 HG21 THR 57 HG21 THR 57 -30.591 14.502 31.106 402 HG22 THR 57 HG22 THR 57 -31.828 15.736 31.343 403 HG23 THR 57 HG23 THR 57 -31.137 14.901 32.734 404 H ASP 58 H ASP 58 -27.393 16.014 30.149 405 HA ASP 58 HA ASP 58 -27.505 13.183 29.446 406 HB2 ASP 58 HB2 ASP 58 -28.155 14.892 27.787 407 HB3 ASP 58 HB3 ASP 58 -26.529 15.566 27.859 408 HA PRO 59 HA PRO 59 -23.171 13.012 30.936 409 HB2 PRO 59 HB2 PRO 59 -22.792 10.330 30.755 410 HB3 PRO 59 HB3 PRO 59 -23.728 11.069 32.074 411 HG2 PRO 59 HG2 PRO 59 -24.699 9.758 29.573 412 HG3 PRO 59 HG3 PRO 59 -25.288 9.585 31.236 413 HD2 PRO 59 HD2 PRO 59 -26.525 11.190 29.416 414 HD3 PRO 59 HD3 PRO 59 -26.512 11.554 31.155 415 H ILE 60 H ILE 60 -21.108 12.600 29.949 416 HA ILE 60 HA ILE 60 -21.210 11.933 27.064 417 HB ILE 60 HB ILE 60 -19.459 13.625 26.657 418 HG12 ILE 60 HG12 ILE 60 -19.994 14.617 29.474 419 HG13 ILE 60 HG13 ILE 60 -18.628 13.571 29.086 420 HG21 ILE 60 HG21 ILE 60 -21.849 14.191 26.358 421 HG22 ILE 60 HG22 ILE 60 -20.918 15.597 26.878 422 HG23 ILE 60 HG23 ILE 60 -21.927 14.729 28.036 423 HD11 ILE 60 HD11 ILE 60 -17.683 15.704 28.905 424 HD12 ILE 60 HD12 ILE 60 -19.145 16.405 28.212 425 HD13 ILE 60 HD13 ILE 60 -18.116 15.357 27.233 426 H ALA 61 H ALA 61 -19.323 11.006 26.180 427 HA ALA 61 HA ALA 61 -17.881 9.322 28.070 428 HB1 ALA 61 HB1 ALA 61 -18.208 9.370 25.085 429 HB2 ALA 61 HB2 ALA 61 -18.588 8.079 26.225 430 HB3 ALA 61 HB3 ALA 61 -16.910 8.431 25.820 431 HA PRO 62 HA PRO 62 -14.148 11.755 27.983 432 HB2 PRO 62 HB2 PRO 62 -12.208 9.895 28.369 433 HB3 PRO 62 HB3 PRO 62 -13.341 10.364 29.650 434 HG2 PRO 62 HG2 PRO 62 -13.402 7.982 27.854 435 HG3 PRO 62 HG3 PRO 62 -13.701 8.085 29.599 436 HD2 PRO 62 HD2 PRO 62 -15.727 7.967 27.778 437 HD3 PRO 62 HD3 PRO 62 -15.878 8.837 29.321 438 H GLU 63 H GLU 63 -12.243 12.244 26.723 439 HA GLU 63 HA GLU 63 -12.025 10.774 24.168 440 HB2 GLU 63 HB2 GLU 63 -12.014 13.785 24.528 441 HB3 GLU 63 HB3 GLU 63 -11.680 12.943 23.014 442 HG2 GLU 63 HG2 GLU 63 -13.933 11.925 23.085 443 HG3 GLU 63 HG3 GLU 63 -14.267 12.777 24.593 444 HA PRO 64 HA PRO 64 -7.856 11.295 26.264 445 HB2 PRO 64 HB2 PRO 64 -7.046 8.706 26.130 446 HB3 PRO 64 HB3 PRO 64 -8.063 9.317 27.449 447 HG2 PRO 64 HG2 PRO 64 -8.850 7.801 25.000 448 HG3 PRO 64 HG3 PRO 64 -9.381 7.584 26.679 449 HD2 PRO 64 HD2 PRO 64 -10.884 8.915 24.840 450 HD3 PRO 64 HD3 PRO 64 -10.906 9.328 26.569 451 H GLU 65 H GLU 65 -5.745 11.129 25.310 452 HA GLU 65 HA GLU 65 -5.728 11.384 22.448 453 HB2 GLU 65 HB2 GLU 65 -3.448 11.258 24.442 454 HB3 GLU 65 HB3 GLU 65 -3.276 11.672 22.736 455 HG2 GLU 65 HG2 GLU 65 -4.808 13.588 23.052 456 HG3 GLU 65 HG3 GLU 65 -4.956 13.180 24.762 457 H LEU 66 H LEU 66 -4.833 9.999 20.914 458 HA LEU 66 HA LEU 66 -4.868 7.193 21.613 459 HB2 LEU 66 HB2 LEU 66 -4.323 8.605 18.988 460 HB3 LEU 66 HB3 LEU 66 -4.456 6.859 19.176 461 HG LEU 66 HG LEU 66 -6.656 8.780 19.995 462 HD11 LEU 66 HD11 LEU 66 -6.378 7.183 17.430 463 HD12 LEU 66 HD12 LEU 66 -6.207 8.932 17.558 464 HD13 LEU 66 HD13 LEU 66 -7.764 8.172 17.887 465 HD21 LEU 66 HD21 LEU 66 -8.023 6.656 19.771 466 HD22 LEU 66 HD22 LEU 66 -6.839 6.618 21.076 467 HD23 LEU 66 HD23 LEU 66 -6.509 5.777 19.563 468 HA PRO 67 HA PRO 67 -0.443 6.836 22.161 469 HB2 PRO 67 HB2 PRO 67 -0.020 4.205 21.679 470 HB3 PRO 67 HB3 PRO 67 -0.880 4.773 23.124 471 HG2 PRO 67 HG2 PRO 67 -1.984 3.689 20.572 472 HG3 PRO 67 HG3 PRO 67 -2.458 3.337 22.244 473 HD2 PRO 67 HD2 PRO 67 -3.840 5.084 20.660 474 HD3 PRO 67 HD3 PRO 67 -3.748 5.254 22.427 475 HA PRO 68 HA PRO 68 1.432 7.255 18.116 476 HB2 PRO 68 HB2 PRO 68 4.028 6.501 18.593 477 HB3 PRO 68 HB3 PRO 68 3.352 8.068 19.082 478 HG2 PRO 68 HG2 PRO 68 3.767 5.598 20.702 479 HG3 PRO 68 HG3 PRO 68 4.075 7.292 21.127 480 HD2 PRO 68 HD2 PRO 68 1.865 5.989 21.993 481 HD3 PRO 68 HD3 PRO 68 1.837 7.724 21.603 482 H LEU 69 H LEU 69 1.542 4.226 19.798 483 HA LEU 69 HA LEU 69 1.949 2.778 17.241 484 HB2 LEU 69 HB2 LEU 69 2.713 1.913 20.047 485 HB3 LEU 69 HB3 LEU 69 2.844 0.904 18.607 486 HG LEU 69 HG LEU 69 4.224 3.593 18.879 487 HD11 LEU 69 HD11 LEU 69 6.282 2.237 19.289 488 HD12 LEU 69 HD12 LEU 69 5.276 0.793 19.396 489 HD13 LEU 69 HD13 LEU 69 5.100 2.081 20.588 490 HD21 LEU 69 HD21 LEU 69 4.530 1.249 16.968 491 HD22 LEU 69 HD22 LEU 69 5.628 2.627 17.024 492 HD23 LEU 69 HD23 LEU 69 3.941 2.862 16.567 493 H GLU 70 H GLU 70 0.184 1.734 16.569 494 HA GLU 70 HA GLU 70 -1.782 0.829 18.593 495 HB2 GLU 70 HB2 GLU 70 -2.258 2.078 15.884 496 HB3 GLU 70 HB3 GLU 70 -3.510 1.211 16.777 497 HG2 GLU 70 HG2 GLU 70 -3.347 2.751 18.634 498 HG3 GLU 70 HG3 GLU 70 -1.937 3.530 17.926 499 H THR 71 H THR 71 -1.094 0.337 15.106 500 HA THR 71 HA THR 71 -0.639 -2.482 15.482 501 HB THR 71 HB THR 71 -3.090 -2.428 15.620 502 HG1 THR 71 HG1 THR 71 -1.937 -4.131 14.516 503 HG21 THR 71 HG21 THR 71 -3.327 -0.337 14.195 504 HG22 THR 71 HG22 THR 71 -4.471 -1.628 13.830 505 HG23 THR 71 HG23 THR 71 -3.076 -1.366 12.786 506 H VAL 72 H VAL 72 -0.656 -3.593 13.210 507 HA VAL 72 HA VAL 72 1.390 -2.468 11.669 508 HB VAL 72 HB VAL 72 -0.672 -4.546 10.854 509 HG11 VAL 72 HG11 VAL 72 0.443 -3.741 8.867 510 HG12 VAL 72 HG12 VAL 72 1.175 -5.289 9.290 511 HG13 VAL 72 HG13 VAL 72 2.014 -3.784 9.669 512 HG21 VAL 72 HG21 VAL 72 0.516 -5.271 12.832 513 HG22 VAL 72 HG22 VAL 72 2.059 -4.755 12.153 514 HG23 VAL 72 HG23 VAL 72 1.203 -6.130 11.453 515 H GLY 73 H GLY 73 1.433 -1.312 9.780 516 HA2 GLY 73 HA2 GLY 73 -0.689 0.516 9.284 517 HA3 GLY 73 HA3 GLY 73 0.779 0.344 8.328 518 H ASP 74 H ASP 74 -1.516 0.878 7.013 519 HA ASP 74 HA ASP 74 -1.760 -1.343 5.229 520 HB2 ASP 74 HB2 ASP 74 -3.293 -1.787 7.325 521 HB3 ASP 74 HB3 ASP 74 -4.366 -0.640 6.520 522 H ILE 75 H ILE 75 -3.587 -0.858 3.586 523 HA ILE 75 HA ILE 75 -3.401 1.999 2.913 524 HB ILE 75 HB ILE 75 -2.571 0.334 1.258 525 HG12 ILE 75 HG12 ILE 75 -5.052 1.667 0.145 526 HG13 ILE 75 HG13 ILE 75 -3.656 2.609 0.661 527 HG21 ILE 75 HG21 ILE 75 -4.016 -1.202 0.159 528 HG22 ILE 75 HG22 ILE 75 -5.459 -0.465 0.858 529 HG23 ILE 75 HG23 ILE 75 -4.357 -1.390 1.879 530 HD11 ILE 75 HD11 ILE 75 -3.780 1.909 -1.827 531 HD12 ILE 75 HD12 ILE 75 -3.360 0.292 -1.255 532 HD13 ILE 75 HD13 ILE 75 -2.255 1.639 -0.979 533 H ASP 76 H ASP 76 -5.146 1.382 4.967 534 HA ASP 76 HA ASP 76 -7.834 1.327 3.794 535 HB2 ASP 76 HB2 ASP 76 -6.969 1.282 6.696 536 HB3 ASP 76 HB3 ASP 76 -8.621 1.090 6.111 537 H VAL 77 H VAL 77 -6.417 3.234 6.489 538 HA VAL 77 HA VAL 77 -7.246 5.713 5.187 539 HB VAL 77 HB VAL 77 -8.549 6.476 7.153 540 HG11 VAL 77 HG11 VAL 77 -9.603 3.887 5.978 541 HG12 VAL 77 HG12 VAL 77 -9.613 5.436 5.133 542 HG13 VAL 77 HG13 VAL 77 -10.557 5.230 6.611 543 HG21 VAL 77 HG21 VAL 77 -7.719 5.111 8.935 544 HG22 VAL 77 HG22 VAL 77 -8.063 3.623 8.053 545 HG23 VAL 77 HG23 VAL 77 -9.390 4.600 8.686 546 H TYR 78 H TYR 78 -4.791 4.221 6.548 547 HA TYR 78 HA TYR 78 -3.845 6.625 7.999 548 HB2 TYR 78 HB2 TYR 78 -3.284 3.710 8.575 549 HB3 TYR 78 HB3 TYR 78 -2.360 5.037 9.278 550 HD1 TYR 78 HD1 TYR 78 -5.509 3.191 9.338 551 HD2 TYR 78 HD2 TYR 78 -3.479 6.700 10.758 552 HE1 TYR 78 HE1 TYR 78 -7.245 3.490 11.085 553 HE2 TYR 78 HE2 TYR 78 -5.214 6.999 12.503 554 HH TYR 78 HH TYR 78 -6.878 5.781 13.664 555 H SER 79 H SER 79 -2.658 3.680 6.362 556 HA SER 79 HA SER 79 -0.871 3.304 4.989 557 HB2 SER 79 HB2 SER 79 -2.296 4.880 3.600 558 HB3 SER 79 HB3 SER 79 -1.235 6.181 4.128 559 HG SER 79 HG SER 79 -0.592 3.859 2.636 560 HA PRO 80 HA PRO 80 1.999 5.892 7.779 561 HB2 PRO 80 HB2 PRO 80 2.733 4.037 9.614 562 HB3 PRO 80 HB3 PRO 80 1.268 5.023 9.805 563 HG2 PRO 80 HG2 PRO 80 1.545 2.221 8.823 564 HG3 PRO 80 HG3 PRO 80 0.363 2.905 9.954 565 HD2 PRO 80 HD2 PRO 80 -0.214 2.463 7.320 566 HD3 PRO 80 HD3 PRO 80 -0.963 3.770 8.264 567 HA PRO 81 HA PRO 81 5.442 4.111 5.535 568 HB2 PRO 81 HB2 PRO 81 7.600 5.132 6.844 569 HB3 PRO 81 HB3 PRO 81 6.553 6.118 5.802 570 HG2 PRO 81 HG2 PRO 81 6.575 5.875 8.774 571 HG3 PRO 81 HG3 PRO 81 6.405 7.320 7.764 572 HD2 PRO 81 HD2 PRO 81 4.268 6.092 8.933 573 HD3 PRO 81 HD3 PRO 81 4.146 6.959 7.389 574 H GLU 82 H GLU 82 6.565 2.257 5.536 575 HA GLU 82 HA GLU 82 7.873 1.142 7.818 576 HB2 GLU 82 HB2 GLU 82 5.466 0.718 8.387 577 HB3 GLU 82 HB3 GLU 82 5.372 -0.315 6.962 578 HG2 GLU 82 HG2 GLU 82 5.820 -1.718 8.889 579 HG3 GLU 82 HG3 GLU 82 7.262 -1.674 7.884 580 HA PRO 83 HA PRO 83 9.889 -0.798 4.235 581 HB2 PRO 83 HB2 PRO 83 11.061 -2.658 6.250 582 HB3 PRO 83 HB3 PRO 83 11.875 -1.643 5.044 583 HG2 PRO 83 HG2 PRO 83 11.945 -1.007 7.609 584 HG3 PRO 83 HG3 PRO 83 11.763 0.246 6.366 585 HD2 PRO 83 HD2 PRO 83 9.658 -0.948 8.155 586 HD3 PRO 83 HD3 PRO 83 9.901 0.748 7.676 587 H GLU 84 H GLU 84 9.503 -2.643 2.963 588 HA GLU 84 HA GLU 84 7.196 -4.185 3.529 589 HB2 GLU 84 HB2 GLU 84 9.413 -4.534 1.502 590 HB3 GLU 84 HB3 GLU 84 7.988 -5.572 1.563 591 HG2 GLU 84 HG2 GLU 84 6.516 -3.688 1.192 592 HG3 GLU 84 HG3 GLU 84 7.853 -2.553 1.349 593 H SER 85 H SER 85 10.663 -4.900 3.744 594 HA SER 85 HA SER 85 11.842 -6.572 4.766 595 HB2 SER 85 HB2 SER 85 9.399 -6.605 6.551 596 HB3 SER 85 HB3 SER 85 10.948 -7.349 6.935 597 HG SER 85 HG SER 85 10.222 -4.649 6.778 598 H GLU 86 H GLU 86 10.119 -7.344 2.517 599 HA GLU 86 HA GLU 86 9.252 -9.215 1.483 600 HB2 GLU 86 HB2 GLU 86 11.299 -10.506 3.307 601 HB3 GLU 86 HB3 GLU 86 10.540 -11.296 1.926 602 HG2 GLU 86 HG2 GLU 86 11.459 -9.576 0.422 603 HG3 GLU 86 HG3 GLU 86 12.198 -8.759 1.797 604 HA PRO 87 HA PRO 87 6.486 -10.290 5.118 605 HB2 PRO 87 HB2 PRO 87 4.106 -9.555 4.046 606 HB3 PRO 87 HB3 PRO 87 5.194 -8.393 4.835 607 HG2 PRO 87 HG2 PRO 87 4.796 -8.934 1.930 608 HG3 PRO 87 HG3 PRO 87 4.964 -7.386 2.775 609 HD2 PRO 87 HD2 PRO 87 7.028 -8.578 1.430 610 HD3 PRO 87 HD3 PRO 87 7.273 -7.518 2.829 611 H ALA 88 H ALA 88 5.361 -12.180 5.395 612 HA ALA 88 HA ALA 88 4.224 -13.617 3.136 613 HB1 ALA 88 HB1 ALA 88 6.263 -15.089 4.779 614 HB2 ALA 88 HB2 ALA 88 6.768 -14.156 3.372 615 HB3 ALA 88 HB3 ALA 88 5.624 -15.485 3.184 616 H TYR 89 H TYR 89 2.788 -15.268 3.780 617 HA TYR 89 HA TYR 89 1.154 -16.166 5.129 618 HB2 TYR 89 HB2 TYR 89 3.474 -16.191 7.077 619 HB3 TYR 89 HB3 TYR 89 1.953 -17.051 7.321 620 HD1 TYR 89 HD1 TYR 89 5.091 -16.925 5.413 621 HD2 TYR 89 HD2 TYR 89 1.338 -18.959 5.894 622 HE1 TYR 89 HE1 TYR 89 5.935 -18.807 4.036 623 HE2 TYR 89 HE2 TYR 89 2.183 -20.843 4.517 624 HH TYR 89 HH TYR 89 4.080 -21.013 2.605 625 H THR 90 H THR 90 1.263 -13.314 4.969 626 HA THR 90 HA THR 90 0.877 -12.158 7.577 627 HB THR 90 HB THR 90 0.194 -10.145 6.328 628 HG1 THR 90 HG1 THR 90 0.489 -11.798 4.050 629 HG21 THR 90 HG21 THR 90 2.289 -9.783 5.108 630 HG22 THR 90 HG22 THR 90 2.589 -11.520 5.078 631 HG23 THR 90 HG23 THR 90 2.607 -10.649 6.611 632 HA PRO 91 HA PRO 91 -3.456 -13.026 8.102 633 HB2 PRO 91 HB2 PRO 91 -4.383 -10.863 9.454 634 HB3 PRO 91 HB3 PRO 91 -3.286 -12.048 10.192 635 HG2 PRO 91 HG2 PRO 91 -2.665 -9.375 9.020 636 HG3 PRO 91 HG3 PRO 91 -2.078 -10.110 10.522 637 HD2 PRO 91 HD2 PRO 91 -0.597 -10.083 8.237 638 HD3 PRO 91 HD3 PRO 91 -0.480 -11.390 9.435 639 HA PRO 92 HA PRO 92 -5.998 -11.306 4.877 640 HB2 PRO 92 HB2 PRO 92 -8.156 -10.735 6.870 641 HB3 PRO 92 HB3 PRO 92 -8.239 -11.647 5.347 642 HG2 PRO 92 HG2 PRO 92 -8.239 -12.921 7.650 643 HG3 PRO 92 HG3 PRO 92 -7.293 -13.542 6.284 644 HD2 PRO 92 HD2 PRO 92 -6.335 -12.056 8.716 645 HD3 PRO 92 HD3 PRO 92 -5.589 -13.434 7.872 646 HA PRO 93 HA PRO 93 -5.426 -6.872 5.352 647 HB2 PRO 93 HB2 PRO 93 -6.404 -5.946 3.007 648 HB3 PRO 93 HB3 PRO 93 -4.902 -6.889 3.095 649 HG2 PRO 93 HG2 PRO 93 -7.642 -7.765 2.317 650 HG3 PRO 93 HG3 PRO 93 -6.078 -8.176 1.592 651 HD2 PRO 93 HD2 PRO 93 -7.426 -9.823 3.344 652 HD3 PRO 93 HD3 PRO 93 -5.665 -9.852 3.114 653 H ALA 94 H ALA 94 -7.189 -7.165 7.104 654 HA ALA 94 HA ALA 94 -9.418 -5.355 6.454 655 HB1 ALA 94 HB1 ALA 94 -10.084 -7.860 6.544 656 HB2 ALA 94 HB2 ALA 94 -11.040 -6.712 7.482 657 HB3 ALA 94 HB3 ALA 94 -9.828 -7.712 8.283 658 H ALA 95 H ALA 95 -9.446 -3.700 7.756 659 HA ALA 95 HA ALA 95 -8.242 -3.951 10.449 660 HB1 ALA 95 HB1 ALA 95 -8.204 -1.304 9.132 661 HB2 ALA 95 HB2 ALA 95 -7.189 -2.543 8.390 662 HB3 ALA 95 HB3 ALA 95 -6.959 -2.115 10.089 663 HA PRO 96 HA PRO 96 -11.978 -2.248 12.133 664 HB2 PRO 96 HB2 PRO 96 -11.117 -0.664 14.173 665 HB3 PRO 96 HB3 PRO 96 -11.030 -2.437 14.232 666 HG2 PRO 96 HG2 PRO 96 -8.891 -0.461 13.573 667 HG3 PRO 96 HG3 PRO 96 -8.815 -1.902 14.606 668 HD2 PRO 96 HD2 PRO 96 -7.884 -1.909 12.054 669 HD3 PRO 96 HD3 PRO 96 -8.605 -3.351 12.804 670 H VAL 97 H VAL 97 -13.222 -0.264 12.533 671 HA VAL 97 HA VAL 97 -13.912 1.889 12.165 672 HB VAL 97 HB VAL 97 -11.213 2.540 10.941 673 HG11 VAL 97 HG11 VAL 97 -12.867 4.183 10.386 674 HG12 VAL 97 HG12 VAL 97 -11.924 4.853 11.719 675 HG13 VAL 97 HG13 VAL 97 -13.522 4.171 12.022 676 HG21 VAL 97 HG21 VAL 97 -12.140 2.954 13.805 677 HG22 VAL 97 HG22 VAL 97 -10.568 3.387 13.139 678 HG23 VAL 97 HG23 VAL 97 -11.016 1.690 13.303 679 H PHE 98 H PHE 98 -15.355 0.897 10.766 680 HA PHE 98 HA PHE 98 -14.949 1.591 7.934 681 HB2 PHE 98 HB2 PHE 98 -14.444 -0.827 8.194 682 HB3 PHE 98 HB3 PHE 98 -16.024 -1.068 8.938 683 HD1 PHE 98 HD1 PHE 98 -14.298 -0.068 5.797 684 HD2 PHE 98 HD2 PHE 98 -18.008 -1.250 7.610 685 HE1 PHE 98 HE1 PHE 98 -15.312 -0.333 3.551 686 HE2 PHE 98 HE2 PHE 98 -19.022 -1.515 5.363 687 HZ PHE 98 HZ PHE 98 -17.673 -1.059 3.334 688 H ASP 99 H ASP 99 -16.626 2.858 7.303 689 HA ASP 99 HA ASP 99 -19.275 2.390 8.521 690 HB2 ASP 99 HB2 ASP 99 -18.000 5.104 8.102 691 HB3 ASP 99 HB3 ASP 99 -19.625 4.805 8.713 692 H ARG 100 H ARG 100 -17.785 4.556 6.078 693 HA ARG 100 HA ARG 100 -20.000 3.857 4.252 694 HB2 ARG 100 HB2 ARG 100 -18.381 6.329 4.710 695 HB3 ARG 100 HB3 ARG 100 -18.877 6.000 3.054 696 HG2 ARG 100 HG2 ARG 100 -20.611 7.349 4.011 697 HG3 ARG 100 HG3 ARG 100 -21.251 5.707 3.952 698 HD2 ARG 100 HD2 ARG 100 -20.822 5.368 6.295 699 HD3 ARG 100 HD3 ARG 100 -19.887 6.856 6.399 700 HE ARG 100 HE ARG 100 -22.450 7.558 5.521 701 HH11 ARG 100 HH11 ARG 100 -20.985 6.148 8.377 702 HH12 ARG 100 HH12 ARG 100 -22.201 6.764 9.446 703 HH21 ARG 100 HH21 ARG 100 -24.008 8.337 6.946 704 HH22 ARG 100 HH22 ARG 100 -23.897 7.995 8.640 705 H ASP 101 H ASP 101 -16.713 5.091 3.516 706 HA ASP 101 HA ASP 101 -15.199 4.402 1.915 707 HB2 ASP 101 HB2 ASP 101 -15.973 1.724 3.103 708 HB3 ASP 101 HB3 ASP 101 -14.527 2.032 2.141 709 H GLU 102 H GLU 102 -17.420 5.046 0.662 710 HA GLU 102 HA GLU 102 -18.602 2.943 -0.919 711 HB2 GLU 102 HB2 GLU 102 -18.640 5.956 -1.175 712 HB3 GLU 102 HB3 GLU 102 -19.527 4.871 -2.247 713 HG2 GLU 102 HG2 GLU 102 -20.727 3.926 -0.314 714 HG3 GLU 102 HG3 GLU 102 -19.836 4.996 0.766 715 H VAL 103 H VAL 103 -16.146 5.418 -1.424 716 HA VAL 103 HA VAL 103 -15.653 5.104 -4.129 717 HB VAL 103 HB VAL 103 -14.721 6.905 -2.711 718 HG11 VAL 103 HG11 VAL 103 -12.804 6.548 -1.305 719 HG12 VAL 103 HG12 VAL 103 -12.651 4.873 -1.838 720 HG13 VAL 103 HG13 VAL 103 -14.019 5.358 -0.835 721 HG21 VAL 103 HG21 VAL 103 -13.768 6.265 -4.980 722 HG22 VAL 103 HG22 VAL 103 -12.501 5.395 -4.113 723 HG23 VAL 103 HG23 VAL 103 -12.660 7.141 -3.922 724 H ALA 104 H ALA 104 -14.330 3.178 -1.442 725 HA ALA 104 HA ALA 104 -13.125 1.223 -1.416 726 HB1 ALA 104 HB1 ALA 104 -13.843 -0.484 -2.915 727 HB2 ALA 104 HB2 ALA 104 -14.328 0.691 -4.137 728 HB3 ALA 104 HB3 ALA 104 -15.253 0.541 -2.642 729 H GLU 105 H GLU 105 -11.230 2.648 -1.641 730 HA GLU 105 HA GLU 105 -9.945 3.282 -4.028 731 HB2 GLU 105 HB2 GLU 105 -9.331 4.178 -1.794 732 HB3 GLU 105 HB3 GLU 105 -8.642 2.612 -1.373 733 HG2 GLU 105 HG2 GLU 105 -7.004 2.807 -3.185 734 HG3 GLU 105 HG3 GLU 105 -7.731 4.327 -3.708 735 H GLN 106 H GLN 106 -9.576 0.341 -2.025 736 HA GLN 106 HA GLN 106 -7.580 -1.079 -2.891 737 HB2 GLN 106 HB2 GLN 106 -8.945 -3.132 -2.780 738 HB3 GLN 106 HB3 GLN 106 -9.300 -2.025 -1.457 739 HG2 GLN 106 HG2 GLN 106 -11.243 -1.152 -2.826 740 HG3 GLN 106 HG3 GLN 106 -10.942 -2.463 -3.967 741 HE21 GLN 106 HE21 GLN 106 -13.093 -1.792 -1.684 742 HE22 GLN 106 HE22 GLN 106 -13.290 -3.311 -0.951 743 H LEU 107 H LEU 107 -6.687 -1.932 -4.596 744 HA LEU 107 HA LEU 107 -7.538 -1.198 -7.197 745 HB2 LEU 107 HB2 LEU 107 -5.163 -1.571 -6.651 746 HB3 LEU 107 HB3 LEU 107 -5.489 -3.273 -6.352 747 HG LEU 107 HG LEU 107 -6.217 -3.506 -8.741 748 HD11 LEU 107 HD11 LEU 107 -5.258 -0.633 -8.878 749 HD12 LEU 107 HD12 LEU 107 -6.860 -1.245 -9.288 750 HD13 LEU 107 HD13 LEU 107 -5.476 -1.652 -10.301 751 HD21 LEU 107 HD21 LEU 107 -3.973 -4.163 -8.209 752 HD22 LEU 107 HD22 LEU 107 -3.432 -2.485 -8.143 753 HD23 LEU 107 HD23 LEU 107 -3.875 -3.207 -9.690 754 H VAL 108 H VAL 108 -7.380 -4.397 -5.621 755 HA VAL 108 HA VAL 108 -9.846 -5.250 -6.862 756 HB VAL 108 HB VAL 108 -8.249 -5.525 -8.724 757 HG11 VAL 108 HG11 VAL 108 -6.246 -5.923 -7.229 758 HG12 VAL 108 HG12 VAL 108 -6.379 -7.031 -8.596 759 HG13 VAL 108 HG13 VAL 108 -6.844 -7.562 -6.978 760 HG21 VAL 108 HG21 VAL 108 -8.786 -7.843 -9.250 761 HG22 VAL 108 HG22 VAL 108 -10.161 -7.110 -8.427 762 HG23 VAL 108 HG23 VAL 108 -9.083 -8.194 -7.547 763 H GLY 109 H GLY 109 -10.637 -7.231 -6.055 764 HA2 GLY 109 HA2 GLY 109 -10.651 -9.135 -4.671 765 HA3 GLY 109 HA3 GLY 109 -9.117 -8.619 -3.977 766 H VAL 110 H VAL 110 -11.510 -9.481 -2.576 767 HA VAL 110 HA VAL 110 -11.859 -7.103 -0.876 768 HB VAL 110 HB VAL 110 -14.279 -7.580 -0.624 769 HG11 VAL 110 HG11 VAL 110 -13.504 -5.870 -2.216 770 HG12 VAL 110 HG12 VAL 110 -14.953 -6.676 -2.817 771 HG13 VAL 110 HG13 VAL 110 -13.372 -7.098 -3.476 772 HG21 VAL 110 HG21 VAL 110 -13.748 -9.563 -2.862 773 HG22 VAL 110 HG22 VAL 110 -15.356 -9.033 -2.370 774 HG23 VAL 110 HG23 VAL 110 -14.341 -9.937 -1.246 775 H SER 111 H SER 111 -12.081 -7.502 1.280 776 HA SER 111 HA SER 111 -12.610 -10.099 2.371 777 HB2 SER 111 HB2 SER 111 -10.308 -10.501 1.647 778 HB3 SER 111 HB3 SER 111 -9.770 -9.060 2.503 779 HG SER 111 HG SER 111 -10.076 -11.515 3.445 780 H ALA 112 H ALA 112 -13.874 -9.462 4.000 781 HA ALA 112 HA ALA 112 -12.795 -7.873 6.143 782 HB1 ALA 112 HB1 ALA 112 -13.445 -5.948 4.994 783 HB2 ALA 112 HB2 ALA 112 -14.843 -6.286 6.022 784 HB3 ALA 112 HB3 ALA 112 -14.877 -6.724 4.312 785 H ALA 113 H ALA 113 -14.152 -7.810 7.990 786 HA ALA 113 HA ALA 113 -15.535 -8.761 9.531 787 HB1 ALA 113 HB1 ALA 113 -17.802 -9.615 8.427 788 HB2 ALA 113 HB2 ALA 113 -17.195 -8.690 7.052 789 HB3 ALA 113 HB3 ALA 113 -17.457 -7.894 8.601 790 H SER 114 H SER 114 -13.489 -10.362 8.585 791 HA SER 114 HA SER 114 -14.563 -13.016 8.024 792 HB2 SER 114 HB2 SER 114 -11.728 -12.015 8.309 793 HB3 SER 114 HB3 SER 114 -12.172 -13.665 7.885 794 HG SER 114 HG SER 114 -13.091 -12.919 6.015 795 H ALA 115 H ALA 115 -14.481 -11.364 10.802 796 HA ALA 115 HA ALA 115 -14.211 -13.768 12.409 797 HB1 ALA 115 HB1 ALA 115 -12.381 -13.178 13.636 798 HB2 ALA 115 HB2 ALA 115 -12.746 -11.454 13.547 799 HB3 ALA 115 HB3 ALA 115 -11.959 -12.261 12.190 800 H ALA 116 H ALA 116 -15.342 -13.608 14.370 801 HA ALA 116 HA ALA 116 -16.567 -11.079 15.085 802 HB1 ALA 116 HB1 ALA 116 -18.433 -13.384 14.574 803 HB2 ALA 116 HB2 ALA 116 -17.993 -12.277 13.273 804 HB3 ALA 116 HB3 ALA 116 -18.808 -11.665 14.713 805 H ALA 117 H ALA 117 -14.785 -12.181 16.643 806 HA ALA 117 HA ALA 117 -15.500 -14.250 18.383 807 HB1 ALA 117 HB1 ALA 117 -13.951 -12.792 19.994 808 HB2 ALA 117 HB2 ALA 117 -13.604 -11.950 18.485 809 HB3 ALA 117 HB3 ALA 117 -13.287 -13.679 18.622 810 H SER 118 H SER 118 -16.629 -14.367 20.249 811 HA SER 118 HA SER 118 -18.119 -11.956 21.109 812 HB2 SER 118 HB2 SER 118 -19.943 -13.492 21.760 813 HB3 SER 118 HB3 SER 118 -19.592 -13.586 20.035 814 HG SER 118 HG SER 118 -19.527 -15.521 21.862 815 H ALA 119 H ALA 119 -15.508 -12.909 22.087 816 HA ALA 119 HA ALA 119 -15.556 -14.349 24.445 817 HB1 ALA 119 HB1 ALA 119 -13.571 -12.866 25.089 818 HB2 ALA 119 HB2 ALA 119 -13.842 -12.034 23.557 819 HB3 ALA 119 HB3 ALA 119 -13.441 -13.752 23.571 820 H PHE 120 H PHE 120 -15.838 -13.896 26.579 821 HA PHE 120 HA PHE 120 -17.861 -12.124 27.336 822 HB2 PHE 120 HB2 PHE 120 -17.206 -12.651 29.666 823 HB3 PHE 120 HB3 PHE 120 -17.299 -14.098 28.665 824 HD1 PHE 120 HD1 PHE 120 -15.053 -11.781 30.443 825 HD2 PHE 120 HD2 PHE 120 -15.275 -15.312 28.005 826 HE1 PHE 120 HE1 PHE 120 -12.701 -12.319 31.009 827 HE2 PHE 120 HE2 PHE 120 -12.921 -15.850 28.573 828 HZ PHE 120 HZ PHE 120 -11.634 -14.356 30.075 829 H GLY 121 H GLY 121 -17.352 -10.611 29.387 830 HA2 GLY 121 HA2 GLY 121 -15.641 -8.990 30.204 831 HA3 GLY 121 HA3 GLY 121 -15.292 -8.671 28.507 832 H SER 122 H SER 122 -16.362 -7.008 30.819 833 HA SER 122 HA SER 122 -18.275 -5.499 29.261 834 HB2 SER 122 HB2 SER 122 -19.768 -7.154 30.285 835 HB3 SER 122 HB3 SER 122 -19.132 -6.757 31.880 836 HG SER 122 HG SER 122 -20.957 -5.549 31.614 837 H LEU 123 H LEU 123 -18.346 -3.369 29.865 838 HA LEU 123 HA LEU 123 -16.731 -2.599 32.228 839 HB2 LEU 123 HB2 LEU 123 -17.007 -1.195 29.558 840 HB3 LEU 123 HB3 LEU 123 -16.174 -0.525 30.958 841 HG LEU 123 HG LEU 123 -15.438 -3.194 29.721 842 HD11 LEU 123 HD11 LEU 123 -15.067 -1.473 28.044 843 HD12 LEU 123 HD12 LEU 123 -13.507 -1.921 28.736 844 HD13 LEU 123 HD13 LEU 123 -14.297 -0.424 29.237 845 HD21 LEU 123 HD21 LEU 123 -14.101 -1.324 31.705 846 HD22 LEU 123 HD22 LEU 123 -13.270 -2.679 30.941 847 HD23 LEU 123 HD23 LEU 123 -14.651 -2.974 32.000 848 H SER 124 H SER 124 -17.849 -1.576 33.770 849 HA SER 124 HA SER 124 -19.913 0.344 33.106 850 HB2 SER 124 HB2 SER 124 -20.551 -2.111 34.770 851 HB3 SER 124 HB3 SER 124 -21.629 -0.747 34.489 852 HG SER 124 HG SER 124 -21.897 -1.364 32.442 853 H SER 125 H SER 125 -17.485 0.847 34.089 854 HA SER 125 HA SER 125 -18.046 1.685 36.829 855 HB2 SER 125 HB2 SER 125 -15.502 0.287 35.974 856 HB3 SER 125 HB3 SER 125 -15.750 1.068 37.532 857 HG SER 125 HG SER 125 -16.363 -1.384 36.875 858 H ALA 126 H ALA 126 -17.346 3.741 37.236 859 HA ALA 126 HA ALA 126 -15.342 4.935 35.485 860 HB1 ALA 126 HB1 ALA 126 -16.925 5.865 34.173 861 HB2 ALA 126 HB2 ALA 126 -17.209 6.958 35.532 862 HB3 ALA 126 HB3 ALA 126 -18.213 5.518 35.327 863 H LEU 127 H LEU 127 -14.340 6.756 36.349 864 HA LEU 127 HA LEU 127 -15.210 7.656 39.001 865 HB2 LEU 127 HB2 LEU 127 -13.334 5.824 38.995 866 HB3 LEU 127 HB3 LEU 127 -12.288 7.144 38.482 867 HG LEU 127 HG LEU 127 -14.078 7.566 40.876 868 HD11 LEU 127 HD11 LEU 127 -11.506 5.968 40.839 869 HD12 LEU 127 HD12 LEU 127 -13.078 5.469 41.466 870 HD13 LEU 127 HD13 LEU 127 -12.151 6.716 42.301 871 HD21 LEU 127 HD21 LEU 127 -11.411 8.603 39.890 872 HD22 LEU 127 HD22 LEU 127 -11.915 8.835 41.565 873 HD23 LEU 127 HD23 LEU 127 -12.874 9.512 40.257 874 H LEU 128 H LEU 128 -14.999 9.804 39.306 875 HA LEU 128 HA LEU 128 -14.566 11.535 37.128 876 HB2 LEU 128 HB2 LEU 128 -14.764 11.918 40.105 877 HB3 LEU 128 HB3 LEU 128 -14.300 13.274 39.079 878 HG LEU 128 HG LEU 128 -16.384 12.719 37.677 879 HD11 LEU 128 HD11 LEU 128 -16.936 11.083 40.168 880 HD12 LEU 128 HD12 LEU 128 -16.854 10.493 38.508 881 HD13 LEU 128 HD13 LEU 128 -18.178 11.547 39.006 882 HD21 LEU 128 HD21 LEU 128 -16.852 13.575 40.552 883 HD22 LEU 128 HD22 LEU 128 -17.830 14.010 39.148 884 HD23 LEU 128 HD23 LEU 128 -16.185 14.627 39.303 885 H MET 129 H MET 129 -12.794 12.402 36.267 886 HA MET 129 HA MET 129 -10.197 11.558 37.112 887 HB2 MET 129 HB2 MET 129 -11.096 13.569 35.038 888 HB3 MET 129 HB3 MET 129 -9.416 13.085 35.280 889 HG2 MET 129 HG2 MET 129 -10.079 10.713 34.881 890 HG3 MET 129 HG3 MET 129 -11.721 11.258 34.538 891 HE1 MET 129 HE1 MET 129 -11.783 12.944 31.336 892 HE2 MET 129 HE2 MET 129 -11.345 13.992 32.683 893 HE3 MET 129 HE3 MET 129 -12.465 12.660 32.943 894 HA PRO 130 HA PRO 130 -9.210 14.876 39.930 895 HB2 PRO 130 HB2 PRO 130 -6.508 15.134 39.597 896 HB3 PRO 130 HB3 PRO 130 -7.257 13.784 40.476 897 HG2 PRO 130 HG2 PRO 130 -6.248 13.888 37.670 898 HG3 PRO 130 HG3 PRO 130 -6.059 12.616 38.890 899 HD2 PRO 130 HD2 PRO 130 -7.897 12.430 36.904 900 HD3 PRO 130 HD3 PRO 130 -8.184 11.752 38.522 901 H LYS 131 H LYS 131 -8.458 15.144 36.557 902 HA LYS 131 HA LYS 131 -7.436 17.764 36.425 903 HB2 LYS 131 HB2 LYS 131 -9.013 16.122 34.438 904 HB3 LYS 131 HB3 LYS 131 -8.323 17.701 34.056 905 HG2 LYS 131 HG2 LYS 131 -6.079 16.864 34.660 906 HG3 LYS 131 HG3 LYS 131 -6.768 15.287 35.039 907 HD2 LYS 131 HD2 LYS 131 -7.546 15.059 32.711 908 HD3 LYS 131 HD3 LYS 131 -6.861 16.639 32.327 909 HE2 LYS 131 HE2 LYS 131 -4.615 15.820 32.927 910 HE3 LYS 131 HE3 LYS 131 -5.292 14.241 33.319 911 HZ1 LYS 131 HZ1 LYS 131 -5.852 15.370 30.678 912 HZ2 LYS 131 HZ2 LYS 131 -5.668 13.748 31.146 913 HZ3 LYS 131 HZ3 LYS 131 -4.302 14.742 30.963 914 H ASP 132 H ASP 132 -10.759 16.537 36.468 915 HA ASP 132 HA ASP 132 -12.790 17.587 36.682 916 HB2 ASP 132 HB2 ASP 132 -11.093 19.654 38.109 917 HB3 ASP 132 HB3 ASP 132 -12.841 19.471 38.255 918 H GLY 133 H GLY 133 -13.618 20.215 36.615 919 HA2 GLY 133 HA2 GLY 133 -13.384 20.842 33.816 920 HA3 GLY 133 HA3 GLY 133 -14.333 21.721 35.009 921 H LEU 134 H LEU 134 -10.912 21.074 34.234 922 HA LEU 134 HA LEU 134 -10.312 23.919 34.782 923 HB2 LEU 134 HB2 LEU 134 -8.559 21.487 35.224 924 HB3 LEU 134 HB3 LEU 134 -8.019 23.155 35.397 925 HG LEU 134 HG LEU 134 -10.340 21.973 36.956 926 HD11 LEU 134 HD11 LEU 134 -8.842 21.664 38.803 927 HD12 LEU 134 HD12 LEU 134 -7.535 22.502 37.967 928 HD13 LEU 134 HD13 LEU 134 -8.063 20.916 37.411 929 HD21 LEU 134 HD21 LEU 134 -9.849 23.974 38.432 930 HD22 LEU 134 HD22 LEU 134 -10.450 24.395 36.830 931 HD23 LEU 134 HD23 LEU 134 -8.730 24.539 37.193 932 H GLU 135 H GLU 135 -8.634 24.867 33.468 933 HA GLU 135 HA GLU 135 -7.749 25.401 31.415 934 HB2 GLU 135 HB2 GLU 135 -7.181 22.454 31.698 935 HB3 GLU 135 HB3 GLU 135 -6.710 23.312 30.232 936 HG2 GLU 135 HG2 GLU 135 -5.940 24.215 33.022 937 HG3 GLU 135 HG3 GLU 135 -4.910 23.210 32.003 938 H HIS 136 H HIS 136 -10.461 25.312 31.365 939 HA HIS 136 HA HIS 136 -11.575 23.623 29.369 940 HB2 HIS 136 HB2 HIS 136 -13.520 25.119 29.468 941 HB3 HIS 136 HB3 HIS 136 -12.961 24.694 31.083 942 HD2 HIS 136 HD2 HIS 136 -12.045 26.870 32.624 943 HE1 HIS 136 HE1 HIS 136 -12.591 29.836 29.669 944 HE2 HIS 136 HE2 HIS 136 -12.029 29.431 32.112 945 H HIS 137 H HIS 137 -9.554 26.372 29.104 946 HA HIS 137 HA HIS 137 -10.507 27.463 26.653 947 HB2 HIS 137 HB2 HIS 137 -7.770 27.536 27.944 948 HB3 HIS 137 HB3 HIS 137 -8.215 28.465 26.515 949 HD2 HIS 137 HD2 HIS 137 -8.425 28.795 30.323 950 HE1 HIS 137 HE1 HIS 137 -11.111 31.648 28.752 951 HE2 HIS 137 HE2 HIS 137 -9.921 30.867 30.855 952 H HIS 138 H HIS 138 -9.883 27.091 24.551 953 HA HIS 138 HA HIS 138 -8.086 24.812 24.030 954 HB2 HIS 138 HB2 HIS 138 -9.649 23.956 22.314 955 HB3 HIS 138 HB3 HIS 138 -10.359 23.921 23.925 956 HD2 HIS 138 HD2 HIS 138 -11.091 25.459 20.458 957 HE1 HIS 138 HE1 HIS 138 -13.783 27.251 23.171 958 HE2 HIS 138 HE2 HIS 138 -13.213 26.960 20.714 959 H HIS 139 H HIS 139 -7.696 27.709 23.827 960 HA HIS 139 HA HIS 139 -7.820 28.518 21.087 961 HB2 HIS 139 HB2 HIS 139 -6.260 29.559 23.459 962 HB3 HIS 139 HB3 HIS 139 -6.226 30.318 21.868 963 HD2 HIS 139 HD2 HIS 139 -8.468 31.887 21.276 964 HE1 HIS 139 HE1 HIS 139 -10.698 30.940 24.733 965 HE2 HIS 139 HE2 HIS 139 -10.611 32.421 22.671 966 H HIS 140 H HIS 140 -6.191 28.620 19.552 967 HA HIS 140 HA HIS 140 -4.402 27.835 18.347 968 HB2 HIS 140 HB2 HIS 140 -3.070 27.895 21.071 969 HB3 HIS 140 HB3 HIS 140 -2.228 27.759 19.529 970 HD2 HIS 140 HD2 HIS 140 -3.473 30.515 21.856 971 HE1 HIS 140 HE1 HIS 140 -2.904 32.356 18.100 972 HE2 HIS 140 HE2 HIS 140 -3.324 32.781 20.569 973 H HIS 141 H HIS 141 -6.303 25.915 19.206 974 HA HIS 141 HA HIS 141 -4.655 23.497 19.072 975 HB2 HIS 141 HB2 HIS 141 -5.175 23.957 21.501 976 HB3 HIS 141 HB3 HIS 141 -6.881 23.766 21.103 977 HD2 HIS 141 HD2 HIS 141 -7.703 21.151 21.380 978 HE1 HIS 141 HE1 HIS 141 -3.957 19.273 20.865 979 HE2 HIS 141 HE2 HIS 141 -6.419 18.878 21.352 Start of MODEL 13 1 H1 MET 1 HT1 MET 1 -4.343 9.218 -6.339 2 H2 MET 1 HT2 MET 1 -3.982 10.803 -6.828 3 H3 MET 1 HT3 MET 1 -5.577 10.377 -6.431 4 HA MET 1 HA MET 1 -5.191 10.356 -4.188 5 HB2 MET 1 HB2 MET 1 -2.436 9.598 -5.083 6 HB3 MET 1 HB3 MET 1 -2.563 10.454 -3.545 7 HG2 MET 1 HG2 MET 1 -4.183 7.982 -4.223 8 HG3 MET 1 HG3 MET 1 -2.657 7.942 -3.336 9 HE1 MET 1 HE1 MET 1 -5.000 6.657 -2.476 10 HE2 MET 1 HE2 MET 1 -5.779 7.256 -1.015 11 HE3 MET 1 HE3 MET 1 -4.076 6.814 -0.976 12 H SER 2 H SER 2 -2.708 11.990 -6.170 13 HA SER 2 HA SER 2 -2.059 14.180 -6.323 14 HB2 SER 2 HB2 SER 2 -4.837 14.697 -5.232 15 HB3 SER 2 HB3 SER 2 -3.786 15.910 -5.959 16 HG SER 2 HG SER 2 -5.137 13.748 -7.125 17 H ASP 3 H ASP 3 -1.425 12.669 -3.952 18 HA ASP 3 HA ASP 3 -1.645 14.446 -1.673 19 HB2 ASP 3 HB2 ASP 3 -1.541 11.849 -1.670 20 HB3 ASP 3 HB3 ASP 3 0.197 12.076 -1.844 21 H GLN 4 H GLN 4 0.507 14.855 -0.437 22 HA GLN 4 HA GLN 4 2.196 16.420 -2.190 23 HB2 GLN 4 HB2 GLN 4 2.019 16.001 0.792 24 HB3 GLN 4 HB3 GLN 4 3.399 16.837 0.084 25 HG2 GLN 4 HG2 GLN 4 1.789 18.525 0.664 26 HG3 GLN 4 HG3 GLN 4 1.746 18.359 -1.090 27 HE21 GLN 4 HE21 GLN 4 -0.416 18.600 -1.697 28 HE22 GLN 4 HE22 GLN 4 -1.721 17.817 -0.947 29 H SER 5 H SER 5 2.645 14.187 -3.276 30 HA SER 5 HA SER 5 5.265 13.268 -2.308 31 HB2 SER 5 HB2 SER 5 3.022 11.473 -3.269 32 HB3 SER 5 HB3 SER 5 4.666 10.949 -2.923 33 HG SER 5 HG SER 5 2.694 11.948 -1.162 34 H GLN 6 H GLN 6 6.567 12.279 -4.081 35 HA GLN 6 HA GLN 6 5.894 13.527 -6.662 36 HB2 GLN 6 HB2 GLN 6 8.548 12.496 -5.619 37 HB3 GLN 6 HB3 GLN 6 8.291 13.259 -7.187 38 HG2 GLN 6 HG2 GLN 6 9.065 15.028 -5.838 39 HG3 GLN 6 HG3 GLN 6 7.317 15.247 -5.836 40 HE21 GLN 6 HE21 GLN 6 6.880 16.022 -3.745 41 HE22 GLN 6 HE22 GLN 6 7.392 15.256 -2.319 42 H GLU 7 H GLU 7 6.432 12.311 -8.620 43 HA GLU 7 HA GLU 7 6.194 10.494 -9.995 44 HB2 GLU 7 HB2 GLU 7 7.542 9.262 -7.600 45 HB3 GLU 7 HB3 GLU 7 6.989 8.240 -8.924 46 HG2 GLU 7 HG2 GLU 7 9.291 8.816 -9.364 47 HG3 GLU 7 HG3 GLU 7 8.290 9.710 -10.504 48 HA PRO 8 HA PRO 8 2.259 8.722 -8.978 49 HB2 PRO 8 HB2 PRO 8 2.042 6.617 -10.663 50 HB3 PRO 8 HB3 PRO 8 2.056 8.295 -11.247 51 HG2 PRO 8 HG2 PRO 8 4.244 6.276 -11.234 52 HG3 PRO 8 HG3 PRO 8 3.811 7.463 -12.476 53 HD2 PRO 8 HD2 PRO 8 5.872 7.809 -10.666 54 HD3 PRO 8 HD3 PRO 8 5.024 9.142 -11.480 55 H THR 9 H THR 9 2.607 8.048 -6.818 56 HA THR 9 HA THR 9 3.874 5.608 -6.095 57 HB THR 9 HB THR 9 2.870 5.988 -3.877 58 HG1 THR 9 HG1 THR 9 1.476 8.015 -5.275 59 HG21 THR 9 HG21 THR 9 3.919 8.138 -3.417 60 HG22 THR 9 HG22 THR 9 3.849 8.571 -5.125 61 HG23 THR 9 HG23 THR 9 4.900 7.259 -4.591 62 H MET 10 H MET 10 2.712 3.887 -4.853 63 HA MET 10 HA MET 10 0.923 2.500 -6.513 64 HB2 MET 10 HB2 MET 10 1.635 2.162 -3.595 65 HB3 MET 10 HB3 MET 10 0.630 1.021 -4.489 66 HG2 MET 10 HG2 MET 10 2.490 0.800 -6.167 67 HG3 MET 10 HG3 MET 10 3.494 1.790 -5.108 68 HE1 MET 10 HE1 MET 10 2.839 1.017 -2.222 69 HE2 MET 10 HE2 MET 10 4.420 1.220 -2.972 70 HE3 MET 10 HE3 MET 10 4.093 -0.208 -1.994 71 H GLU 11 H GLU 11 0.380 4.498 -3.682 72 HA GLU 11 HA GLU 11 -2.391 3.921 -3.311 73 HB2 GLU 11 HB2 GLU 11 -0.769 6.390 -2.639 74 HB3 GLU 11 HB3 GLU 11 -2.464 6.193 -2.186 75 HG2 GLU 11 HG2 GLU 11 -1.955 4.226 -0.874 76 HG3 GLU 11 HG3 GLU 11 -0.294 4.206 -1.457 77 H GLU 12 H GLU 12 -0.776 6.605 -4.946 78 HA GLU 12 HA GLU 12 -2.987 7.866 -6.041 79 HB2 GLU 12 HB2 GLU 12 -0.636 8.737 -6.007 80 HB3 GLU 12 HB3 GLU 12 -0.268 7.656 -7.348 81 HG2 GLU 12 HG2 GLU 12 -2.014 8.746 -8.712 82 HG3 GLU 12 HG3 GLU 12 -2.383 9.832 -7.375 83 H ILE 13 H ILE 13 -1.028 5.250 -7.487 84 HA ILE 13 HA ILE 13 -2.303 5.161 -9.976 85 HB ILE 13 HB ILE 13 -0.905 3.020 -8.341 86 HG12 ILE 13 HG12 ILE 13 0.038 4.513 -10.806 87 HG13 ILE 13 HG13 ILE 13 0.317 5.123 -9.177 88 HG21 ILE 13 HG21 ILE 13 -1.921 2.956 -11.199 89 HG22 ILE 13 HG22 ILE 13 -2.265 1.807 -9.908 90 HG23 ILE 13 HG23 ILE 13 -0.650 1.881 -10.616 91 HD11 ILE 13 HD11 ILE 13 2.229 3.768 -10.116 92 HD12 ILE 13 HD12 ILE 13 1.167 2.361 -10.094 93 HD13 ILE 13 HD13 ILE 13 1.602 3.161 -8.584 94 H LEU 14 H LEU 14 -3.054 3.396 -6.964 95 HA LEU 14 HA LEU 14 -5.218 1.876 -7.918 96 HB2 LEU 14 HB2 LEU 14 -4.057 1.575 -5.716 97 HB3 LEU 14 HB3 LEU 14 -4.880 3.017 -5.129 98 HG LEU 14 HG LEU 14 -6.552 0.822 -6.349 99 HD11 LEU 14 HD11 LEU 14 -6.614 -0.463 -4.342 100 HD12 LEU 14 HD12 LEU 14 -5.704 0.754 -3.444 101 HD13 LEU 14 HD13 LEU 14 -4.903 -0.207 -4.687 102 HD21 LEU 14 HD21 LEU 14 -8.037 1.623 -4.366 103 HD22 LEU 14 HD22 LEU 14 -7.812 2.733 -5.712 104 HD23 LEU 14 HD23 LEU 14 -6.890 2.955 -4.228 105 H ALA 15 H ALA 15 -5.037 5.146 -6.603 106 HA ALA 15 HA ALA 15 -7.838 5.676 -6.528 107 HB1 ALA 15 HB1 ALA 15 -5.479 7.559 -6.753 108 HB2 ALA 15 HB2 ALA 15 -6.291 7.062 -5.268 109 HB3 ALA 15 HB3 ALA 15 -7.140 8.065 -6.445 110 H SER 16 H SER 16 -5.333 6.152 -8.943 111 HA SER 16 HA SER 16 -6.765 7.666 -10.819 112 HB2 SER 16 HB2 SER 16 -4.482 5.730 -11.203 113 HB3 SER 16 HB3 SER 16 -5.086 6.802 -12.463 114 HG SER 16 HG SER 16 -4.006 7.517 -9.933 115 H ILE 17 H ILE 17 -6.473 4.110 -10.549 116 HA ILE 17 HA ILE 17 -8.002 3.649 -12.937 117 HB ILE 17 HB ILE 17 -6.254 2.109 -11.850 118 HG12 ILE 17 HG12 ILE 17 -7.543 1.486 -13.843 119 HG13 ILE 17 HG13 ILE 17 -7.281 0.095 -12.804 120 HG21 ILE 17 HG21 ILE 17 -6.742 0.723 -10.092 121 HG22 ILE 17 HG22 ILE 17 -8.477 0.738 -10.402 122 HG23 ILE 17 HG23 ILE 17 -7.711 2.116 -9.632 123 HD11 ILE 17 HD11 ILE 17 -9.523 -0.216 -13.214 124 HD12 ILE 17 HD12 ILE 17 -9.818 1.499 -13.498 125 HD13 ILE 17 HD13 ILE 17 -9.687 0.890 -11.848 126 H ARG 18 H ARG 18 -8.729 3.807 -9.500 127 HA ARG 18 HA ARG 18 -11.306 2.762 -9.434 128 HB2 ARG 18 HB2 ARG 18 -9.965 3.558 -7.457 129 HB3 ARG 18 HB3 ARG 18 -10.389 5.208 -7.902 130 HG2 ARG 18 HG2 ARG 18 -12.003 4.586 -6.273 131 HG3 ARG 18 HG3 ARG 18 -12.837 4.424 -7.815 132 HD2 ARG 18 HD2 ARG 18 -12.417 2.014 -7.828 133 HD3 ARG 18 HD3 ARG 18 -11.503 2.147 -6.327 134 HE ARG 18 HE ARG 18 -14.396 2.218 -6.616 135 HH11 ARG 18 HH11 ARG 18 -11.664 2.949 -4.545 136 HH12 ARG 18 HH12 ARG 18 -12.618 2.954 -3.098 137 HH21 ARG 18 HH21 ARG 18 -15.594 2.241 -4.712 138 HH22 ARG 18 HH22 ARG 18 -14.824 2.556 -3.196 139 H ARG 19 H ARG 19 -10.661 6.300 -9.575 140 HA ARG 19 HA ARG 19 -12.833 6.559 -11.554 141 HB2 ARG 19 HB2 ARG 19 -12.535 8.174 -9.011 142 HB3 ARG 19 HB3 ARG 19 -13.614 8.607 -10.339 143 HG2 ARG 19 HG2 ARG 19 -14.803 6.474 -10.097 144 HG3 ARG 19 HG3 ARG 19 -13.704 5.996 -8.804 145 HD2 ARG 19 HD2 ARG 19 -15.753 6.861 -7.817 146 HD3 ARG 19 HD3 ARG 19 -14.435 7.985 -7.493 147 HE ARG 19 HE ARG 19 -15.482 9.550 -8.866 148 HH11 ARG 19 HH11 ARG 19 -17.009 6.424 -9.285 149 HH12 ARG 19 HH12 ARG 19 -18.326 7.063 -10.210 150 HH21 ARG 19 HH21 ARG 19 -17.215 10.339 -10.069 151 HH22 ARG 19 HH22 ARG 19 -18.440 9.261 -10.650 152 H ILE 20 H ILE 20 -12.620 8.269 -12.991 153 HA ILE 20 HA ILE 20 -10.337 10.075 -12.728 154 HB ILE 20 HB ILE 20 -9.432 8.085 -13.884 155 HG12 ILE 20 HG12 ILE 20 -8.714 9.300 -16.029 156 HG13 ILE 20 HG13 ILE 20 -9.754 10.623 -15.501 157 HG21 ILE 20 HG21 ILE 20 -11.355 8.691 -16.137 158 HG22 ILE 20 HG22 ILE 20 -11.681 7.463 -14.917 159 HG23 ILE 20 HG23 ILE 20 -10.278 7.306 -15.972 160 HD11 ILE 20 HD11 ILE 20 -7.284 10.778 -14.824 161 HD12 ILE 20 HD12 ILE 20 -7.618 9.449 -13.712 162 HD13 ILE 20 HD13 ILE 20 -8.465 10.987 -13.530 163 H ILE 21 H ILE 21 -10.997 12.058 -13.216 164 HA ILE 21 HA ILE 21 -13.559 12.645 -14.276 165 HB ILE 21 HB ILE 21 -11.084 14.380 -13.924 166 HG12 ILE 21 HG12 ILE 21 -13.640 14.291 -12.291 167 HG13 ILE 21 HG13 ILE 21 -12.237 13.296 -11.903 168 HG21 ILE 21 HG21 ILE 21 -13.961 15.173 -14.534 169 HG22 ILE 21 HG22 ILE 21 -12.574 15.404 -15.599 170 HG23 ILE 21 HG23 ILE 21 -12.681 16.298 -14.083 171 HD11 ILE 21 HD11 ILE 21 -12.166 16.319 -12.146 172 HD12 ILE 21 HD12 ILE 21 -10.849 15.276 -11.609 173 HD13 ILE 21 HD13 ILE 21 -12.300 15.447 -10.619 174 H SER 22 H SER 22 -10.301 12.721 -15.684 175 HA SER 22 HA SER 22 -11.336 12.183 -18.336 176 HB2 SER 22 HB2 SER 22 -10.409 14.164 -19.388 177 HB3 SER 22 HB3 SER 22 -11.537 14.668 -18.133 178 HG SER 22 HG SER 22 -9.156 15.506 -18.342 179 H GLU 23 H GLU 23 -9.513 11.854 -19.900 180 HA GLU 23 HA GLU 23 -7.325 10.511 -18.539 181 HB2 GLU 23 HB2 GLU 23 -8.629 9.638 -20.594 182 HB3 GLU 23 HB3 GLU 23 -7.649 10.768 -21.529 183 HG2 GLU 23 HG2 GLU 23 -6.328 8.849 -19.615 184 HG3 GLU 23 HG3 GLU 23 -6.807 8.309 -21.220 185 H ASP 24 H ASP 24 -6.253 12.315 -17.646 186 HA ASP 24 HA ASP 24 -4.161 13.374 -19.288 187 HB2 ASP 24 HB2 ASP 24 -6.226 14.822 -19.817 188 HB3 ASP 24 HB3 ASP 24 -6.008 15.484 -18.197 189 H ASP 25 H ASP 25 -4.940 12.123 -16.526 190 HA ASP 25 HA ASP 25 -3.511 14.002 -14.769 191 HB2 ASP 25 HB2 ASP 25 -5.136 11.538 -14.103 192 HB3 ASP 25 HB3 ASP 25 -4.383 12.617 -12.928 193 H ALA 26 H ALA 26 -2.327 12.084 -16.842 194 HA ALA 26 HA ALA 26 -0.868 10.137 -15.275 195 HB1 ALA 26 HB1 ALA 26 0.411 9.947 -17.539 196 HB2 ALA 26 HB2 ALA 26 -0.895 10.956 -18.159 197 HB3 ALA 26 HB3 ALA 26 -1.256 9.385 -17.446 198 HA PRO 27 HA PRO 27 2.183 13.385 -14.166 199 HB2 PRO 27 HB2 PRO 27 3.650 11.061 -13.011 200 HB3 PRO 27 HB3 PRO 27 3.187 12.596 -12.252 201 HG2 PRO 27 HG2 PRO 27 1.925 10.365 -11.635 202 HG3 PRO 27 HG3 PRO 27 1.033 11.886 -11.822 203 HD2 PRO 27 HD2 PRO 27 1.268 9.595 -13.761 204 HD3 PRO 27 HD3 PRO 27 -0.169 10.548 -13.317 205 H ALA 28 H ALA 28 4.130 14.044 -15.058 206 HA ALA 28 HA ALA 28 5.026 12.812 -17.448 207 HB1 ALA 28 HB1 ALA 28 6.504 14.820 -15.731 208 HB2 ALA 28 HB2 ALA 28 5.277 15.242 -16.923 209 HB3 ALA 28 HB3 ALA 28 6.785 14.487 -17.439 210 H GLU 29 H GLU 29 6.775 11.501 -17.876 211 HA GLU 29 HA GLU 29 8.734 10.850 -15.882 212 HB2 GLU 29 HB2 GLU 29 6.707 9.509 -15.167 213 HB3 GLU 29 HB3 GLU 29 6.846 8.625 -16.686 214 HG2 GLU 29 HG2 GLU 29 8.012 7.364 -14.976 215 HG3 GLU 29 HG3 GLU 29 9.209 8.050 -16.070 216 HA PRO 30 HA PRO 30 9.692 10.148 -20.441 217 HB2 PRO 30 HB2 PRO 30 11.719 11.947 -20.695 218 HB3 PRO 30 HB3 PRO 30 10.019 12.381 -20.937 219 HG2 PRO 30 HG2 PRO 30 11.760 12.798 -18.551 220 HG3 PRO 30 HG3 PRO 30 10.593 13.901 -19.303 221 HD2 PRO 30 HD2 PRO 30 10.002 12.460 -17.068 222 HD3 PRO 30 HD3 PRO 30 8.774 12.899 -18.277 223 H ALA 31 H ALA 31 11.292 8.751 -21.125 224 HA ALA 31 HA ALA 31 13.813 8.485 -19.760 225 HB1 ALA 31 HB1 ALA 31 13.487 6.583 -18.538 226 HB2 ALA 31 HB2 ALA 31 12.255 5.957 -19.636 227 HB3 ALA 31 HB3 ALA 31 11.838 7.204 -18.459 228 H ALA 32 H ALA 32 15.204 6.933 -20.764 229 HA ALA 32 HA ALA 32 14.280 5.884 -23.353 230 HB1 ALA 32 HB1 ALA 32 16.958 7.232 -23.075 231 HB2 ALA 32 HB2 ALA 32 15.509 8.141 -23.513 232 HB3 ALA 32 HB3 ALA 32 16.076 6.829 -24.549 233 H GLU 33 H GLU 33 16.748 5.903 -20.822 234 HA GLU 33 HA GLU 33 18.243 4.304 -20.099 235 HB2 GLU 33 HB2 GLU 33 15.947 2.497 -20.911 236 HB3 GLU 33 HB3 GLU 33 17.276 2.040 -19.851 237 HG2 GLU 33 HG2 GLU 33 15.310 4.290 -19.313 238 HG3 GLU 33 HG3 GLU 33 15.250 2.697 -18.570 239 H ALA 34 H ALA 34 19.259 5.096 -22.302 240 HA ALA 34 HA ALA 34 20.360 2.724 -23.547 241 HB1 ALA 34 HB1 ALA 34 18.891 4.755 -25.242 242 HB2 ALA 34 HB2 ALA 34 18.348 3.107 -24.921 243 HB3 ALA 34 HB3 ALA 34 19.824 3.384 -25.845 244 H ALA 35 H ALA 35 22.324 3.049 -24.495 245 HA ALA 35 HA ALA 35 23.428 5.789 -24.400 246 HB1 ALA 35 HB1 ALA 35 25.311 3.577 -23.868 247 HB2 ALA 35 HB2 ALA 35 24.087 3.823 -22.624 248 HB3 ALA 35 HB3 ALA 35 25.157 5.149 -23.082 249 HA PRO 36 HA PRO 36 23.873 4.126 -28.729 250 HB2 PRO 36 HB2 PRO 36 24.376 7.036 -29.182 251 HB3 PRO 36 HB3 PRO 36 23.355 5.912 -30.103 252 HG2 PRO 36 HG2 PRO 36 22.255 7.688 -28.500 253 HG3 PRO 36 HG3 PRO 36 21.621 6.031 -28.571 254 HD2 PRO 36 HD2 PRO 36 23.371 7.293 -26.471 255 HD3 PRO 36 HD3 PRO 36 21.996 6.180 -26.272 256 HA PRO 37 HA PRO 37 28.370 3.890 -28.514 257 HB2 PRO 37 HB2 PRO 37 28.313 3.729 -31.495 258 HB3 PRO 37 HB3 PRO 37 29.049 2.624 -30.319 259 HG2 PRO 37 HG2 PRO 37 26.831 1.953 -31.575 260 HG3 PRO 37 HG3 PRO 37 27.046 1.570 -29.857 261 HD2 PRO 37 HD2 PRO 37 25.423 3.773 -31.106 262 HD3 PRO 37 HD3 PRO 37 25.030 2.727 -29.721 263 HA PRO 38 HA PRO 38 29.797 8.072 -29.238 264 HB2 PRO 38 HB2 PRO 38 32.418 6.869 -30.036 265 HB3 PRO 38 HB3 PRO 38 32.077 8.129 -28.834 266 HG2 PRO 38 HG2 PRO 38 32.667 5.686 -28.052 267 HG3 PRO 38 HG3 PRO 38 31.383 6.600 -27.238 268 HD2 PRO 38 HD2 PRO 38 31.127 4.378 -29.247 269 HD3 PRO 38 HD3 PRO 38 30.162 4.694 -27.787 270 HA PRO 39 HA PRO 39 29.208 8.728 -33.634 271 HB2 PRO 39 HB2 PRO 39 31.083 11.041 -33.338 272 HB3 PRO 39 HB3 PRO 39 29.460 10.990 -34.053 273 HG2 PRO 39 HG2 PRO 39 29.813 12.050 -31.674 274 HG3 PRO 39 HG3 PRO 39 28.410 11.011 -31.987 275 HD2 PRO 39 HD2 PRO 39 30.948 10.352 -30.516 276 HD3 PRO 39 HD3 PRO 39 29.273 9.884 -30.141 277 HA PRO 40 HA PRO 40 32.899 6.816 -35.378 278 HB2 PRO 40 HB2 PRO 40 32.353 6.950 -38.037 279 HB3 PRO 40 HB3 PRO 40 31.512 5.832 -36.944 280 HG2 PRO 40 HG2 PRO 40 30.619 8.483 -37.988 281 HG3 PRO 40 HG3 PRO 40 29.710 6.966 -37.839 282 HD2 PRO 40 HD2 PRO 40 29.468 8.977 -36.026 283 HD3 PRO 40 HD3 PRO 40 29.304 7.266 -35.575 284 H GLU 41 H GLU 41 34.785 7.287 -36.664 285 HA GLU 41 HA GLU 41 35.656 9.991 -36.480 286 HB2 GLU 41 HB2 GLU 41 36.862 7.583 -37.863 287 HB3 GLU 41 HB3 GLU 41 37.683 9.132 -37.675 288 HG2 GLU 41 HG2 GLU 41 37.467 8.951 -35.221 289 HG3 GLU 41 HG3 GLU 41 36.652 7.400 -35.409 290 HA PRO 42 HA PRO 42 34.336 11.666 -40.380 291 HB2 PRO 42 HB2 PRO 42 36.512 13.179 -41.149 292 HB3 PRO 42 HB3 PRO 42 35.327 13.684 -39.931 293 HG2 PRO 42 HG2 PRO 42 38.023 12.473 -39.556 294 HG3 PRO 42 HG3 PRO 42 37.246 13.796 -38.668 295 HD2 PRO 42 HD2 PRO 42 37.363 11.301 -37.646 296 HD3 PRO 42 HD3 PRO 42 35.954 12.352 -37.369 297 H GLU 43 H GLU 43 37.382 9.954 -40.224 298 HA GLU 43 HA GLU 43 37.034 9.103 -43.036 299 HB2 GLU 43 HB2 GLU 43 39.640 9.762 -41.635 300 HB3 GLU 43 HB3 GLU 43 39.516 9.015 -43.228 301 HG2 GLU 43 HG2 GLU 43 38.279 10.975 -44.064 302 HG3 GLU 43 HG3 GLU 43 38.374 11.721 -42.469 303 HA PRO 44 HA PRO 44 37.248 5.017 -41.270 304 HB2 PRO 44 HB2 PRO 44 38.201 3.522 -43.335 305 HB3 PRO 44 HB3 PRO 44 36.558 4.195 -43.318 306 HG2 PRO 44 HG2 PRO 44 39.005 5.216 -44.690 307 HG3 PRO 44 HG3 PRO 44 37.344 5.083 -45.299 308 HD2 PRO 44 HD2 PRO 44 38.375 7.436 -44.394 309 HD3 PRO 44 HD3 PRO 44 36.652 7.024 -44.230 310 H GLU 45 H GLU 45 38.677 3.562 -40.290 311 HA GLU 45 HA GLU 45 41.465 3.443 -40.916 312 HB2 GLU 45 HB2 GLU 45 40.566 5.431 -38.966 313 HB3 GLU 45 HB3 GLU 45 41.682 4.281 -38.237 314 HG2 GLU 45 HG2 GLU 45 43.321 4.730 -40.026 315 HG3 GLU 45 HG3 GLU 45 42.205 5.871 -40.771 316 HA PRO 46 HA PRO 46 40.680 0.550 -37.176 317 HB2 PRO 46 HB2 PRO 46 38.322 0.607 -35.825 318 HB3 PRO 46 HB3 PRO 46 39.687 1.663 -35.409 319 HG2 PRO 46 HG2 PRO 46 37.245 2.276 -37.008 320 HG3 PRO 46 HG3 PRO 46 38.040 3.242 -35.752 321 HD2 PRO 46 HD2 PRO 46 38.393 3.733 -38.405 322 HD3 PRO 46 HD3 PRO 46 39.663 4.043 -37.203 323 H VAL 47 H VAL 47 39.963 -1.580 -37.329 324 HA VAL 47 HA VAL 47 37.957 -2.105 -39.433 325 HB VAL 47 HB VAL 47 40.124 -3.933 -38.337 326 HG11 VAL 47 HG11 VAL 47 39.552 -5.272 -40.404 327 HG12 VAL 47 HG12 VAL 47 38.144 -4.231 -40.615 328 HG13 VAL 47 HG13 VAL 47 38.281 -5.249 -39.181 329 HG21 VAL 47 HG21 VAL 47 41.145 -3.573 -40.608 330 HG22 VAL 47 HG22 VAL 47 41.124 -2.117 -39.612 331 HG23 VAL 47 HG23 VAL 47 39.940 -2.319 -40.902 332 H SER 48 H SER 48 39.078 -3.312 -36.276 333 HA SER 48 HA SER 48 36.790 -4.970 -35.824 334 HB2 SER 48 HB2 SER 48 38.900 -3.928 -33.925 335 HB3 SER 48 HB3 SER 48 37.690 -5.139 -33.513 336 HG SER 48 HG SER 48 39.956 -5.323 -35.097 337 H PHE 49 H PHE 49 35.102 -4.672 -34.336 338 HA PHE 49 HA PHE 49 34.577 -1.871 -33.531 339 HB2 PHE 49 HB2 PHE 49 32.596 -3.904 -34.592 340 HB3 PHE 49 HB3 PHE 49 32.167 -2.327 -33.928 341 HD1 PHE 49 HD1 PHE 49 33.581 -4.119 -36.789 342 HD2 PHE 49 HD2 PHE 49 32.842 -0.242 -35.090 343 HE1 PHE 49 HE1 PHE 49 33.989 -3.073 -38.999 344 HE2 PHE 49 HE2 PHE 49 33.249 0.804 -37.301 345 HZ PHE 49 HZ PHE 49 33.825 -0.611 -39.255 346 H ASP 50 H ASP 50 33.702 -1.563 -31.517 347 HA ASP 50 HA ASP 50 33.433 -3.973 -29.814 348 HB2 ASP 50 HB2 ASP 50 34.205 -2.585 -27.942 349 HB3 ASP 50 HB3 ASP 50 35.403 -2.652 -29.227 350 H ASP 51 H ASP 51 31.343 -4.334 -29.472 351 HA ASP 51 HA ASP 51 29.715 -2.375 -28.138 352 HB2 ASP 51 HB2 ASP 51 29.576 -1.868 -30.680 353 HB3 ASP 51 HB3 ASP 51 28.606 -3.336 -30.763 354 H GLU 52 H GLU 52 27.715 -3.274 -27.360 355 HA GLU 52 HA GLU 52 27.358 -6.165 -27.708 356 HB2 GLU 52 HB2 GLU 52 27.147 -6.485 -25.255 357 HB3 GLU 52 HB3 GLU 52 28.767 -5.973 -25.717 358 HG2 GLU 52 HG2 GLU 52 28.158 -3.623 -25.138 359 HG3 GLU 52 HG3 GLU 52 26.582 -4.193 -24.596 360 H VAL 53 H VAL 53 25.907 -3.937 -28.739 361 HA VAL 53 HA VAL 53 23.447 -3.893 -27.148 362 HB VAL 53 HB VAL 53 24.240 -2.257 -29.580 363 HG11 VAL 53 HG11 VAL 53 21.781 -2.565 -29.353 364 HG12 VAL 53 HG12 VAL 53 22.266 -0.894 -29.061 365 HG13 VAL 53 HG13 VAL 53 21.874 -1.949 -27.702 366 HG21 VAL 53 HG21 VAL 53 25.580 -1.641 -27.648 367 HG22 VAL 53 HG22 VAL 53 24.147 -1.600 -26.620 368 HG23 VAL 53 HG23 VAL 53 24.353 -0.397 -27.894 369 H LEU 54 H LEU 54 21.876 -5.300 -27.651 370 HA LEU 54 HA LEU 54 21.780 -6.399 -30.398 371 HB2 LEU 54 HB2 LEU 54 22.362 -7.919 -28.360 372 HB3 LEU 54 HB3 LEU 54 20.641 -7.817 -28.005 373 HG LEU 54 HG LEU 54 20.227 -8.566 -30.413 374 HD11 LEU 54 HD11 LEU 54 22.344 -8.130 -31.445 375 HD12 LEU 54 HD12 LEU 54 22.197 -9.886 -31.363 376 HD13 LEU 54 HD13 LEU 54 23.210 -9.031 -30.200 377 HD21 LEU 54 HD21 LEU 54 21.653 -10.374 -28.444 378 HD22 LEU 54 HD22 LEU 54 20.799 -10.965 -29.869 379 HD23 LEU 54 HD23 LEU 54 19.913 -10.126 -28.594 380 H GLU 55 H GLU 55 20.225 -4.174 -28.591 381 HA GLU 55 HA GLU 55 18.118 -3.270 -28.558 382 HB2 GLU 55 HB2 GLU 55 18.064 -4.739 -31.204 383 HB3 GLU 55 HB3 GLU 55 16.776 -3.658 -30.675 384 HG2 GLU 55 HG2 GLU 55 18.304 -1.789 -30.545 385 HG3 GLU 55 HG3 GLU 55 19.687 -2.837 -30.841 386 H LEU 56 H LEU 56 18.332 -5.405 -26.910 387 HA LEU 56 HA LEU 56 16.418 -7.471 -27.328 388 HB2 LEU 56 HB2 LEU 56 17.699 -6.406 -24.798 389 HB3 LEU 56 HB3 LEU 56 16.675 -7.840 -24.859 390 HG LEU 56 HG LEU 56 19.160 -7.516 -26.563 391 HD11 LEU 56 HD11 LEU 56 19.624 -7.480 -24.075 392 HD12 LEU 56 HD12 LEU 56 20.350 -8.838 -24.933 393 HD13 LEU 56 HD13 LEU 56 18.886 -9.078 -23.981 394 HD21 LEU 56 HD21 LEU 56 17.361 -9.849 -25.835 395 HD22 LEU 56 HD22 LEU 56 18.937 -10.052 -26.600 396 HD23 LEU 56 HD23 LEU 56 17.653 -9.187 -27.443 397 H THR 57 H THR 57 14.342 -7.712 -26.540 398 HA THR 57 HA THR 57 13.006 -5.226 -25.641 399 HB THR 57 HB THR 57 11.843 -7.543 -27.223 400 HG1 THR 57 HG1 THR 57 12.411 -6.439 -28.901 401 HG21 THR 57 HG21 THR 57 10.150 -6.469 -25.824 402 HG22 THR 57 HG22 THR 57 9.908 -5.984 -27.502 403 HG23 THR 57 HG23 THR 57 10.677 -4.877 -26.365 404 H ASP 58 H ASP 58 12.051 -5.274 -23.711 405 HA ASP 58 HA ASP 58 12.030 -7.762 -22.186 406 HB2 ASP 58 HB2 ASP 58 11.458 -4.901 -21.372 407 HB3 ASP 58 HB3 ASP 58 11.473 -6.273 -20.272 408 HA PRO 59 HA PRO 59 7.693 -8.547 -22.651 409 HB2 PRO 59 HB2 PRO 59 7.454 -8.868 -19.696 410 HB3 PRO 59 HB3 PRO 59 7.040 -10.008 -20.992 411 HG2 PRO 59 HG2 PRO 59 9.191 -10.388 -19.504 412 HG3 PRO 59 HG3 PRO 59 9.224 -10.713 -21.247 413 HD2 PRO 59 HD2 PRO 59 10.329 -8.346 -19.754 414 HD3 PRO 59 HD3 PRO 59 11.036 -9.249 -21.115 415 H ILE 60 H ILE 60 5.702 -7.508 -22.532 416 HA ILE 60 HA ILE 60 5.680 -4.758 -21.920 417 HB ILE 60 HB ILE 60 3.407 -6.714 -22.409 418 HG12 ILE 60 HG12 ILE 60 4.578 -4.597 -24.240 419 HG13 ILE 60 HG13 ILE 60 5.172 -6.258 -24.215 420 HG21 ILE 60 HG21 ILE 60 3.399 -3.675 -22.279 421 HG22 ILE 60 HG22 ILE 60 2.496 -4.772 -21.235 422 HG23 ILE 60 HG23 ILE 60 2.078 -4.637 -22.943 423 HD11 ILE 60 HD11 ILE 60 2.275 -5.502 -24.709 424 HD12 ILE 60 HD12 ILE 60 2.986 -7.111 -24.848 425 HD13 ILE 60 HD13 ILE 60 3.440 -5.844 -25.989 426 H ALA 61 H ALA 61 4.370 -7.570 -20.163 427 HA ALA 61 HA ALA 61 4.274 -5.914 -17.722 428 HB1 ALA 61 HB1 ALA 61 2.140 -6.731 -17.110 429 HB2 ALA 61 HB2 ALA 61 2.182 -7.998 -18.338 430 HB3 ALA 61 HB3 ALA 61 1.986 -6.310 -18.815 431 HA PRO 62 HA PRO 62 6.794 -9.873 -17.154 432 HB2 PRO 62 HB2 PRO 62 8.287 -8.020 -15.355 433 HB3 PRO 62 HB3 PRO 62 8.907 -9.185 -16.542 434 HG2 PRO 62 HG2 PRO 62 8.984 -6.594 -17.042 435 HG3 PRO 62 HG3 PRO 62 8.563 -7.748 -18.321 436 HD2 PRO 62 HD2 PRO 62 6.741 -5.970 -16.719 437 HD3 PRO 62 HD3 PRO 62 6.696 -6.348 -18.457 438 H GLU 63 H GLU 63 6.434 -11.311 -15.510 439 HA GLU 63 HA GLU 63 5.736 -10.371 -12.841 440 HB2 GLU 63 HB2 GLU 63 3.590 -10.421 -14.173 441 HB3 GLU 63 HB3 GLU 63 3.815 -12.162 -14.345 442 HG2 GLU 63 HG2 GLU 63 2.363 -11.773 -12.443 443 HG3 GLU 63 HG3 GLU 63 3.921 -12.338 -11.843 444 HA PRO 64 HA PRO 64 8.076 -14.453 -13.059 445 HB2 PRO 64 HB2 PRO 64 10.236 -13.752 -11.570 446 HB3 PRO 64 HB3 PRO 64 10.144 -13.443 -13.315 447 HG2 PRO 64 HG2 PRO 64 9.658 -11.580 -11.035 448 HG3 PRO 64 HG3 PRO 64 10.545 -11.306 -12.545 449 HD2 PRO 64 HD2 PRO 64 7.980 -10.444 -12.173 450 HD3 PRO 64 HD3 PRO 64 8.617 -10.907 -13.767 451 H GLU 65 H GLU 65 8.009 -16.030 -11.465 452 HA GLU 65 HA GLU 65 7.532 -15.225 -8.680 453 HB2 GLU 65 HB2 GLU 65 5.696 -17.084 -10.217 454 HB3 GLU 65 HB3 GLU 65 5.600 -16.745 -8.491 455 HG2 GLU 65 HG2 GLU 65 5.307 -14.676 -10.694 456 HG3 GLU 65 HG3 GLU 65 3.972 -15.391 -9.796 457 H LEU 66 H LEU 66 9.262 -16.177 -7.757 458 HA LEU 66 HA LEU 66 10.417 -18.621 -8.634 459 HB2 LEU 66 HB2 LEU 66 10.749 -16.962 -6.139 460 HB3 LEU 66 HB3 LEU 66 11.602 -18.486 -6.367 461 HG LEU 66 HG LEU 66 12.483 -17.547 -8.554 462 HD11 LEU 66 HD11 LEU 66 11.135 -15.077 -7.450 463 HD12 LEU 66 HD12 LEU 66 11.006 -15.761 -9.071 464 HD13 LEU 66 HD13 LEU 66 12.495 -14.964 -8.568 465 HD21 LEU 66 HD21 LEU 66 13.849 -17.621 -6.516 466 HD22 LEU 66 HD22 LEU 66 13.172 -16.080 -5.989 467 HD23 LEU 66 HD23 LEU 66 14.193 -16.148 -7.426 468 HA PRO 67 HA PRO 67 8.262 -20.651 -4.828 469 HB2 PRO 67 HB2 PRO 67 6.122 -19.438 -3.668 470 HB3 PRO 67 HB3 PRO 67 7.794 -19.142 -3.152 471 HG2 PRO 67 HG2 PRO 67 6.045 -17.500 -4.914 472 HG3 PRO 67 HG3 PRO 67 7.144 -16.988 -3.623 473 HD2 PRO 67 HD2 PRO 67 7.803 -16.836 -6.256 474 HD3 PRO 67 HD3 PRO 67 9.012 -17.094 -4.982 475 HA PRO 68 HA PRO 68 5.007 -22.781 -6.958 476 HB2 PRO 68 HB2 PRO 68 3.225 -22.649 -4.565 477 HB3 PRO 68 HB3 PRO 68 3.716 -24.054 -5.533 478 HG2 PRO 68 HG2 PRO 68 4.766 -23.603 -3.139 479 HG3 PRO 68 HG3 PRO 68 5.747 -24.242 -4.472 480 HD2 PRO 68 HD2 PRO 68 5.714 -21.490 -3.307 481 HD3 PRO 68 HD3 PRO 68 7.067 -22.402 -4.014 482 H LEU 69 H LEU 69 2.434 -22.753 -7.228 483 HA LEU 69 HA LEU 69 1.774 -20.323 -8.491 484 HB2 LEU 69 HB2 LEU 69 0.052 -22.656 -7.631 485 HB3 LEU 69 HB3 LEU 69 -0.539 -21.314 -8.611 486 HG LEU 69 HG LEU 69 1.867 -22.984 -9.396 487 HD11 LEU 69 HD11 LEU 69 0.401 -24.250 -10.850 488 HD12 LEU 69 HD12 LEU 69 -0.986 -23.262 -10.387 489 HD13 LEU 69 HD13 LEU 69 -0.242 -24.346 -9.211 490 HD21 LEU 69 HD21 LEU 69 1.804 -20.853 -10.532 491 HD22 LEU 69 HD22 LEU 69 0.073 -21.004 -10.835 492 HD23 LEU 69 HD23 LEU 69 1.209 -22.059 -11.674 493 H GLU 70 H GLU 70 0.399 -18.670 -7.956 494 HA GLU 70 HA GLU 70 -0.116 -18.315 -5.075 495 HB2 GLU 70 HB2 GLU 70 -0.027 -16.272 -7.315 496 HB3 GLU 70 HB3 GLU 70 -0.312 -15.909 -5.612 497 HG2 GLU 70 HG2 GLU 70 2.191 -17.224 -6.723 498 HG3 GLU 70 HG3 GLU 70 2.057 -15.530 -6.268 499 H THR 71 H THR 71 -2.140 -17.380 -4.394 500 HA THR 71 HA THR 71 -4.354 -17.419 -6.291 501 HB THR 71 HB THR 71 -4.258 -19.743 -5.513 502 HG1 THR 71 HG1 THR 71 -6.386 -19.788 -4.660 503 HG21 THR 71 HG21 THR 71 -4.412 -20.361 -3.214 504 HG22 THR 71 HG22 THR 71 -4.764 -18.706 -2.717 505 HG23 THR 71 HG23 THR 71 -3.151 -19.131 -3.291 506 H VAL 72 H VAL 72 -6.276 -16.406 -5.472 507 HA VAL 72 HA VAL 72 -7.374 -14.692 -4.407 508 HB VAL 72 HB VAL 72 -5.812 -15.645 -1.979 509 HG11 VAL 72 HG11 VAL 72 -6.957 -13.413 -1.778 510 HG12 VAL 72 HG12 VAL 72 -7.605 -14.636 -0.685 511 HG13 VAL 72 HG13 VAL 72 -8.483 -14.214 -2.155 512 HG21 VAL 72 HG21 VAL 72 -7.766 -17.056 -1.513 513 HG22 VAL 72 HG22 VAL 72 -7.104 -17.464 -3.095 514 HG23 VAL 72 HG23 VAL 72 -8.558 -16.475 -2.977 515 H GLY 73 H GLY 73 -6.545 -12.924 -5.429 516 HA2 GLY 73 HA2 GLY 73 -5.117 -11.005 -3.967 517 HA3 GLY 73 HA3 GLY 73 -3.982 -11.803 -5.052 518 H ASP 74 H ASP 74 -6.757 -9.712 -4.818 519 HA ASP 74 HA ASP 74 -6.299 -8.794 -7.564 520 HB2 ASP 74 HB2 ASP 74 -9.030 -9.526 -6.474 521 HB3 ASP 74 HB3 ASP 74 -8.705 -8.795 -8.047 522 H ILE 75 H ILE 75 -6.746 -6.625 -7.871 523 HA ILE 75 HA ILE 75 -6.779 -4.993 -5.525 524 HB ILE 75 HB ILE 75 -5.534 -4.384 -7.589 525 HG12 ILE 75 HG12 ILE 75 -7.674 -2.316 -7.043 526 HG13 ILE 75 HG13 ILE 75 -6.417 -2.694 -5.867 527 HG21 ILE 75 HG21 ILE 75 -8.259 -3.794 -8.783 528 HG22 ILE 75 HG22 ILE 75 -7.290 -5.212 -9.188 529 HG23 ILE 75 HG23 ILE 75 -6.689 -3.598 -9.566 530 HD11 ILE 75 HD11 ILE 75 -5.534 -0.865 -7.083 531 HD12 ILE 75 HD12 ILE 75 -6.105 -1.504 -8.624 532 HD13 ILE 75 HD13 ILE 75 -4.747 -2.272 -7.800 533 H ASP 76 H ASP 76 -9.113 -6.004 -7.927 534 HA ASP 76 HA ASP 76 -11.191 -4.316 -6.772 535 HB2 ASP 76 HB2 ASP 76 -11.279 -6.188 -9.143 536 HB3 ASP 76 HB3 ASP 76 -12.586 -5.119 -8.638 537 H VAL 77 H VAL 77 -12.602 -5.024 -5.316 538 HA VAL 77 HA VAL 77 -12.757 -7.930 -4.798 539 HB VAL 77 HB VAL 77 -13.490 -7.305 -2.512 540 HG11 VAL 77 HG11 VAL 77 -11.133 -7.742 -2.880 541 HG12 VAL 77 HG12 VAL 77 -11.280 -6.368 -1.782 542 HG13 VAL 77 HG13 VAL 77 -10.880 -6.102 -3.479 543 HG21 VAL 77 HG21 VAL 77 -13.418 -5.013 -1.754 544 HG22 VAL 77 HG22 VAL 77 -14.420 -5.044 -3.204 545 HG23 VAL 77 HG23 VAL 77 -12.756 -4.466 -3.295 546 H TYR 78 H TYR 78 -14.903 -8.520 -3.670 547 HA TYR 78 HA TYR 78 -17.144 -7.320 -5.190 548 HB2 TYR 78 HB2 TYR 78 -16.720 -10.206 -4.375 549 HB3 TYR 78 HB3 TYR 78 -18.189 -9.578 -5.120 550 HD1 TYR 78 HD1 TYR 78 -14.662 -10.460 -5.649 551 HD2 TYR 78 HD2 TYR 78 -18.191 -8.807 -7.458 552 HE1 TYR 78 HE1 TYR 78 -13.638 -10.728 -7.891 553 HE2 TYR 78 HE2 TYR 78 -17.165 -9.075 -9.701 554 HH TYR 78 HH TYR 78 -14.436 -10.967 -10.260 555 H SER 79 H SER 79 -19.202 -7.312 -4.137 556 HA SER 79 HA SER 79 -19.108 -6.514 -1.427 557 HB2 SER 79 HB2 SER 79 -21.428 -7.270 -3.211 558 HB3 SER 79 HB3 SER 79 -21.622 -6.620 -1.586 559 HG SER 79 HG SER 79 -20.520 -4.770 -2.251 560 HA PRO 80 HA PRO 80 -19.367 -10.461 0.628 561 HB2 PRO 80 HB2 PRO 80 -20.557 -9.818 2.986 562 HB3 PRO 80 HB3 PRO 80 -18.891 -9.352 2.597 563 HG2 PRO 80 HG2 PRO 80 -21.390 -7.733 2.429 564 HG3 PRO 80 HG3 PRO 80 -19.796 -7.281 3.064 565 HD2 PRO 80 HD2 PRO 80 -20.623 -6.554 0.574 566 HD3 PRO 80 HD3 PRO 80 -18.916 -6.879 0.953 567 HA PRO 81 HA PRO 81 -23.446 -12.116 -0.192 568 HB2 PRO 81 HB2 PRO 81 -23.460 -14.400 1.280 569 HB3 PRO 81 HB3 PRO 81 -22.471 -14.216 -0.183 570 HG2 PRO 81 HG2 PRO 81 -21.670 -13.957 2.681 571 HG3 PRO 81 HG3 PRO 81 -20.839 -14.782 1.350 572 HD2 PRO 81 HD2 PRO 81 -20.108 -12.300 2.198 573 HD3 PRO 81 HD3 PRO 81 -19.948 -12.813 0.504 574 H GLU 82 H GLU 82 -25.536 -12.549 0.769 575 HA GLU 82 HA GLU 82 -25.833 -11.522 3.533 576 HB2 GLU 82 HB2 GLU 82 -26.611 -9.907 1.802 577 HB3 GLU 82 HB3 GLU 82 -27.749 -11.121 1.218 578 HG2 GLU 82 HG2 GLU 82 -28.823 -11.181 3.446 579 HG3 GLU 82 HG3 GLU 82 -27.689 -9.961 4.022 580 HA PRO 83 HA PRO 83 -27.668 -15.774 3.500 581 HB2 PRO 83 HB2 PRO 83 -27.394 -16.285 6.159 582 HB3 PRO 83 HB3 PRO 83 -26.058 -16.476 5.005 583 HG2 PRO 83 HG2 PRO 83 -26.639 -14.214 6.864 584 HG3 PRO 83 HG3 PRO 83 -25.097 -15.012 6.510 585 HD2 PRO 83 HD2 PRO 83 -25.785 -12.641 5.374 586 HD3 PRO 83 HD3 PRO 83 -24.784 -13.843 4.528 587 H GLU 84 H GLU 84 -29.679 -16.558 4.196 588 HA GLU 84 HA GLU 84 -31.891 -16.435 4.796 589 HB2 GLU 84 HB2 GLU 84 -30.773 -16.268 7.069 590 HB3 GLU 84 HB3 GLU 84 -31.002 -14.523 6.959 591 HG2 GLU 84 HG2 GLU 84 -33.433 -14.859 6.677 592 HG3 GLU 84 HG3 GLU 84 -33.205 -16.600 6.796 593 H SER 85 H SER 85 -33.220 -15.452 3.433 594 HA SER 85 HA SER 85 -33.838 -12.659 3.741 595 HB2 SER 85 HB2 SER 85 -33.261 -11.936 1.492 596 HB3 SER 85 HB3 SER 85 -31.817 -12.533 2.306 597 HG SER 85 HG SER 85 -31.805 -13.542 0.374 598 H GLU 86 H GLU 86 -35.786 -12.089 2.807 599 HA GLU 86 HA GLU 86 -37.230 -14.186 1.310 600 HB2 GLU 86 HB2 GLU 86 -38.325 -12.557 3.622 601 HB3 GLU 86 HB3 GLU 86 -39.274 -13.646 2.611 602 HG2 GLU 86 HG2 GLU 86 -37.835 -15.535 3.299 603 HG3 GLU 86 HG3 GLU 86 -36.892 -14.446 4.313 604 HA PRO 87 HA PRO 87 -37.534 -9.953 -0.726 605 HB2 PRO 87 HB2 PRO 87 -36.721 -10.667 -3.221 606 HB3 PRO 87 HB3 PRO 87 -35.580 -10.220 -1.935 607 HG2 PRO 87 HG2 PRO 87 -36.392 -12.931 -2.884 608 HG3 PRO 87 HG3 PRO 87 -34.779 -12.314 -2.480 609 HD2 PRO 87 HD2 PRO 87 -36.228 -13.847 -0.752 610 HD3 PRO 87 HD3 PRO 87 -35.090 -12.598 -0.199 611 H ALA 88 H ALA 88 -39.261 -9.243 -1.956 612 HA ALA 88 HA ALA 88 -41.093 -11.319 -3.012 613 HB1 ALA 88 HB1 ALA 88 -42.945 -10.037 -2.294 614 HB2 ALA 88 HB2 ALA 88 -41.952 -8.606 -2.017 615 HB3 ALA 88 HB3 ALA 88 -41.820 -9.993 -0.937 616 H TYR 89 H TYR 89 -41.991 -11.019 -4.992 617 HA TYR 89 HA TYR 89 -42.301 -10.250 -7.116 618 HB2 TYR 89 HB2 TYR 89 -41.651 -7.552 -5.901 619 HB3 TYR 89 HB3 TYR 89 -42.265 -7.802 -7.531 620 HD1 TYR 89 HD1 TYR 89 -43.071 -7.876 -3.951 621 HD2 TYR 89 HD2 TYR 89 -44.547 -8.641 -7.911 622 HE1 TYR 89 HE1 TYR 89 -45.387 -7.968 -3.069 623 HE2 TYR 89 HE2 TYR 89 -46.864 -8.735 -7.029 624 HH TYR 89 HH TYR 89 -47.866 -9.319 -4.552 625 H THR 90 H THR 90 -39.617 -8.132 -6.036 626 HA THR 90 HA THR 90 -37.741 -9.595 -7.724 627 HB THR 90 HB THR 90 -37.040 -7.562 -8.940 628 HG1 THR 90 HG1 THR 90 -37.680 -5.776 -8.075 629 HG21 THR 90 HG21 THR 90 -40.014 -7.989 -9.294 630 HG22 THR 90 HG22 THR 90 -38.808 -9.155 -9.836 631 HG23 THR 90 HG23 THR 90 -38.833 -7.534 -10.525 632 HA PRO 91 HA PRO 91 -34.825 -8.519 -4.558 633 HB2 PRO 91 HB2 PRO 91 -32.912 -7.592 -6.655 634 HB3 PRO 91 HB3 PRO 91 -32.686 -8.805 -5.378 635 HG2 PRO 91 HG2 PRO 91 -33.005 -9.561 -7.880 636 HG3 PRO 91 HG3 PRO 91 -33.797 -10.451 -6.566 637 HD2 PRO 91 HD2 PRO 91 -34.996 -8.458 -8.476 638 HD3 PRO 91 HD3 PRO 91 -35.672 -9.993 -7.883 639 HA PRO 92 HA PRO 92 -35.388 -4.056 -4.140 640 HB2 PRO 92 HB2 PRO 92 -33.974 -3.563 -1.871 641 HB3 PRO 92 HB3 PRO 92 -35.541 -4.399 -1.855 642 HG2 PRO 92 HG2 PRO 92 -32.787 -5.543 -1.729 643 HG3 PRO 92 HG3 PRO 92 -34.227 -5.964 -0.782 644 HD2 PRO 92 HD2 PRO 92 -33.412 -7.442 -2.918 645 HD3 PRO 92 HD3 PRO 92 -35.125 -7.276 -2.472 646 HA PRO 93 HA PRO 93 -31.697 -2.339 -6.037 647 HB2 PRO 93 HB2 PRO 93 -32.041 0.330 -5.635 648 HB3 PRO 93 HB3 PRO 93 -33.016 -0.596 -6.796 649 HG2 PRO 93 HG2 PRO 93 -33.695 0.263 -4.019 650 HG3 PRO 93 HG3 PRO 93 -34.688 0.307 -5.486 651 HD2 PRO 93 HD2 PRO 93 -34.950 -1.656 -3.622 652 HD3 PRO 93 HD3 PRO 93 -35.237 -1.943 -5.351 653 H ALA 94 H ALA 94 -29.624 -1.545 -5.515 654 HA ALA 94 HA ALA 94 -29.127 -0.712 -2.743 655 HB1 ALA 94 HB1 ALA 94 -27.019 -2.235 -2.928 656 HB2 ALA 94 HB2 ALA 94 -27.953 -3.090 -4.154 657 HB3 ALA 94 HB3 ALA 94 -28.565 -2.968 -2.504 658 H ALA 95 H ALA 95 -27.299 -1.484 -5.718 659 HA ALA 95 HA ALA 95 -26.598 1.222 -6.237 660 HB1 ALA 95 HB1 ALA 95 -24.164 -0.226 -5.354 661 HB2 ALA 95 HB2 ALA 95 -25.276 0.304 -4.083 662 HB3 ALA 95 HB3 ALA 95 -24.583 1.485 -5.204 663 HA PRO 96 HA PRO 96 -25.479 -0.511 -10.180 664 HB2 PRO 96 HB2 PRO 96 -23.000 1.152 -10.191 665 HB3 PRO 96 HB3 PRO 96 -24.321 1.086 -11.376 666 HG2 PRO 96 HG2 PRO 96 -24.084 3.153 -9.753 667 HG3 PRO 96 HG3 PRO 96 -25.682 2.479 -10.128 668 HD2 PRO 96 HD2 PRO 96 -24.024 2.114 -7.642 669 HD3 PRO 96 HD3 PRO 96 -25.778 2.374 -7.797 670 H VAL 97 H VAL 97 -24.187 -2.147 -11.076 671 HA VAL 97 HA VAL 97 -21.833 -3.004 -9.510 672 HB VAL 97 HB VAL 97 -22.518 -5.361 -9.853 673 HG11 VAL 97 HG11 VAL 97 -24.484 -3.543 -8.438 674 HG12 VAL 97 HG12 VAL 97 -23.083 -4.354 -7.738 675 HG13 VAL 97 HG13 VAL 97 -24.478 -5.298 -8.260 676 HG21 VAL 97 HG21 VAL 97 -25.124 -4.158 -10.851 677 HG22 VAL 97 HG22 VAL 97 -24.801 -5.872 -10.606 678 HG23 VAL 97 HG23 VAL 97 -23.943 -4.986 -11.865 679 H PHE 98 H PHE 98 -20.345 -4.386 -10.708 680 HA PHE 98 HA PHE 98 -20.259 -3.628 -13.560 681 HB2 PHE 98 HB2 PHE 98 -18.072 -4.515 -11.663 682 HB3 PHE 98 HB3 PHE 98 -17.834 -4.202 -13.384 683 HD1 PHE 98 HD1 PHE 98 -18.443 -2.706 -10.091 684 HD2 PHE 98 HD2 PHE 98 -18.082 -1.921 -14.299 685 HE1 PHE 98 HE1 PHE 98 -18.211 -0.283 -9.621 686 HE2 PHE 98 HE2 PHE 98 -17.849 0.501 -13.828 687 HZ PHE 98 HZ PHE 98 -17.914 1.322 -11.488 688 H ASP 99 H ASP 99 -20.283 -5.116 -15.131 689 HA ASP 99 HA ASP 99 -20.662 -7.925 -14.355 690 HB2 ASP 99 HB2 ASP 99 -22.388 -6.866 -15.769 691 HB3 ASP 99 HB3 ASP 99 -21.170 -6.544 -17.001 692 H ARG 100 H ARG 100 -18.800 -9.023 -14.258 693 HA ARG 100 HA ARG 100 -16.682 -9.790 -14.774 694 HB2 ARG 100 HB2 ARG 100 -18.015 -9.672 -17.489 695 HB3 ARG 100 HB3 ARG 100 -16.490 -10.502 -17.179 696 HG2 ARG 100 HG2 ARG 100 -17.595 -11.920 -15.493 697 HG3 ARG 100 HG3 ARG 100 -19.124 -11.089 -15.796 698 HD2 ARG 100 HD2 ARG 100 -19.056 -11.830 -18.151 699 HD3 ARG 100 HD3 ARG 100 -17.538 -12.667 -17.844 700 HE ARG 100 HE ARG 100 -19.453 -13.588 -15.992 701 HH11 ARG 100 HH11 ARG 100 -18.808 -13.728 -19.433 702 HH12 ARG 100 HH12 ARG 100 -19.610 -15.251 -19.637 703 HH21 ARG 100 HH21 ARG 100 -20.490 -15.562 -16.303 704 HH22 ARG 100 HH22 ARG 100 -20.554 -16.278 -17.878 705 H ASP 101 H ASP 101 -16.074 -7.407 -14.125 706 HA ASP 101 HA ASP 101 -15.104 -5.744 -16.282 707 HB2 ASP 101 HB2 ASP 101 -15.998 -4.779 -14.187 708 HB3 ASP 101 HB3 ASP 101 -14.675 -5.524 -13.294 709 H GLU 102 H GLU 102 -13.232 -6.036 -17.271 710 HA GLU 102 HA GLU 102 -11.301 -7.962 -16.412 711 HB2 GLU 102 HB2 GLU 102 -11.221 -5.841 -18.569 712 HB3 GLU 102 HB3 GLU 102 -9.928 -7.009 -18.302 713 HG2 GLU 102 HG2 GLU 102 -11.232 -8.043 -19.960 714 HG3 GLU 102 HG3 GLU 102 -11.806 -8.802 -18.483 715 H VAL 103 H VAL 103 -10.410 -7.484 -14.457 716 HA VAL 103 HA VAL 103 -9.709 -5.032 -13.407 717 HB VAL 103 HB VAL 103 -8.295 -7.684 -12.976 718 HG11 VAL 103 HG11 VAL 103 -8.356 -5.135 -11.332 719 HG12 VAL 103 HG12 VAL 103 -6.941 -5.886 -12.072 720 HG13 VAL 103 HG13 VAL 103 -7.760 -6.681 -10.730 721 HG21 VAL 103 HG21 VAL 103 -10.687 -6.383 -11.644 722 HG22 VAL 103 HG22 VAL 103 -9.815 -7.751 -10.950 723 HG23 VAL 103 HG23 VAL 103 -10.646 -7.927 -12.496 724 H ALA 104 H ALA 104 -8.000 -3.690 -13.496 725 HA ALA 104 HA ALA 104 -5.604 -4.368 -15.019 726 HB1 ALA 104 HB1 ALA 104 -7.459 -2.092 -15.765 727 HB2 ALA 104 HB2 ALA 104 -7.015 -3.474 -16.769 728 HB3 ALA 104 HB3 ALA 104 -5.805 -2.257 -16.359 729 H GLU 105 H GLU 105 -4.053 -2.394 -14.926 730 HA GLU 105 HA GLU 105 -2.905 -0.797 -13.760 731 HB2 GLU 105 HB2 GLU 105 -5.207 0.272 -13.378 732 HB3 GLU 105 HB3 GLU 105 -5.193 -0.526 -11.804 733 HG2 GLU 105 HG2 GLU 105 -4.270 1.648 -11.416 734 HG3 GLU 105 HG3 GLU 105 -2.900 0.542 -11.442 735 H GLN 106 H GLN 106 -1.479 -2.467 -13.211 736 HA GLN 106 HA GLN 106 -1.750 -4.129 -10.925 737 HB2 GLN 106 HB2 GLN 106 -0.184 -4.527 -12.856 738 HB3 GLN 106 HB3 GLN 106 0.827 -3.222 -12.238 739 HG2 GLN 106 HG2 GLN 106 1.694 -5.360 -11.440 740 HG3 GLN 106 HG3 GLN 106 1.038 -4.450 -10.081 741 HE21 GLN 106 HE21 GLN 106 -0.073 -5.839 -8.706 742 HE22 GLN 106 HE22 GLN 106 -1.052 -7.134 -9.208 743 H LEU 107 H LEU 107 -1.762 -3.526 -8.891 744 HA LEU 107 HA LEU 107 -0.818 -0.928 -8.035 745 HB2 LEU 107 HB2 LEU 107 -2.840 -1.874 -7.031 746 HB3 LEU 107 HB3 LEU 107 -1.917 -3.248 -6.417 747 HG LEU 107 HG LEU 107 -0.527 -1.625 -5.081 748 HD11 LEU 107 HD11 LEU 107 -2.500 0.317 -6.283 749 HD12 LEU 107 HD12 LEU 107 -0.745 0.446 -6.196 750 HD13 LEU 107 HD13 LEU 107 -1.714 0.662 -4.740 751 HD21 LEU 107 HD21 LEU 107 -2.442 -1.054 -3.474 752 HD22 LEU 107 HD22 LEU 107 -2.265 -2.754 -3.904 753 HD23 LEU 107 HD23 LEU 107 -3.519 -1.779 -4.667 754 H VAL 108 H VAL 108 0.170 -4.304 -7.520 755 HA VAL 108 HA VAL 108 2.850 -3.333 -6.737 756 HB VAL 108 HB VAL 108 3.004 -5.167 -5.078 757 HG11 VAL 108 HG11 VAL 108 0.637 -3.316 -4.680 758 HG12 VAL 108 HG12 VAL 108 2.324 -2.912 -4.367 759 HG13 VAL 108 HG13 VAL 108 1.520 -4.143 -3.397 760 HG21 VAL 108 HG21 VAL 108 0.047 -5.537 -5.680 761 HG22 VAL 108 HG22 VAL 108 0.936 -6.337 -4.383 762 HG23 VAL 108 HG23 VAL 108 1.324 -6.692 -6.066 763 H GLY 109 H GLY 109 4.581 -4.857 -7.093 764 HA2 GLY 109 HA2 GLY 109 4.799 -7.291 -8.072 765 HA3 GLY 109 HA3 GLY 109 4.114 -6.491 -9.483 766 H VAL 110 H VAL 110 6.739 -6.060 -7.107 767 HA VAL 110 HA VAL 110 8.483 -5.104 -9.304 768 HB VAL 110 HB VAL 110 8.578 -4.351 -6.361 769 HG11 VAL 110 HG11 VAL 110 10.316 -2.733 -7.085 770 HG12 VAL 110 HG12 VAL 110 10.252 -3.406 -8.713 771 HG13 VAL 110 HG13 VAL 110 10.821 -4.398 -7.370 772 HG21 VAL 110 HG21 VAL 110 7.738 -2.816 -8.840 773 HG22 VAL 110 HG22 VAL 110 8.022 -2.067 -7.270 774 HG23 VAL 110 HG23 VAL 110 6.722 -3.243 -7.464 775 H SER 111 H SER 111 10.123 -6.410 -9.767 776 HA SER 111 HA SER 111 11.550 -7.873 -7.711 777 HB2 SER 111 HB2 SER 111 11.162 -10.083 -8.635 778 HB3 SER 111 HB3 SER 111 9.612 -9.354 -8.225 779 HG SER 111 HG SER 111 9.161 -9.112 -10.312 780 H ALA 112 H ALA 112 13.429 -9.035 -8.611 781 HA ALA 112 HA ALA 112 15.315 -9.158 -9.902 782 HB1 ALA 112 HB1 ALA 112 15.093 -9.348 -12.196 783 HB2 ALA 112 HB2 ALA 112 13.905 -8.048 -12.295 784 HB3 ALA 112 HB3 ALA 112 13.428 -9.635 -11.690 785 H ALA 113 H ALA 113 16.808 -7.782 -11.268 786 HA ALA 113 HA ALA 113 16.367 -4.920 -11.188 787 HB1 ALA 113 HB1 ALA 113 18.787 -5.786 -9.675 788 HB2 ALA 113 HB2 ALA 113 17.225 -5.880 -8.855 789 HB3 ALA 113 HB3 ALA 113 17.798 -4.334 -9.491 790 H SER 114 H SER 114 17.991 -3.732 -12.305 791 HA SER 114 HA SER 114 20.122 -5.216 -13.648 792 HB2 SER 114 HB2 SER 114 18.211 -5.503 -15.158 793 HB3 SER 114 HB3 SER 114 17.941 -3.764 -15.167 794 HG SER 114 HG SER 114 19.807 -3.475 -16.266 795 H ALA 115 H ALA 115 21.840 -3.941 -14.238 796 HA ALA 115 HA ALA 115 21.640 -1.057 -14.299 797 HB1 ALA 115 HB1 ALA 115 21.914 -1.082 -11.980 798 HB2 ALA 115 HB2 ALA 115 23.583 -0.984 -12.544 799 HB3 ALA 115 HB3 ALA 115 22.921 -2.530 -12.015 800 H ALA 116 H ALA 116 23.606 -0.077 -15.081 801 HA ALA 116 HA ALA 116 25.819 -1.750 -15.839 802 HB1 ALA 116 HB1 ALA 116 24.440 -0.385 -18.129 803 HB2 ALA 116 HB2 ALA 116 23.902 -1.986 -17.624 804 HB3 ALA 116 HB3 ALA 116 25.565 -1.742 -18.156 805 H ALA 117 H ALA 117 27.645 -0.461 -16.428 806 HA ALA 117 HA ALA 117 27.218 2.451 -16.378 807 HB1 ALA 117 HB1 ALA 117 29.432 1.102 -14.827 808 HB2 ALA 117 HB2 ALA 117 27.888 1.551 -14.100 809 HB3 ALA 117 HB3 ALA 117 28.944 2.796 -14.767 810 H SER 118 H SER 118 28.736 3.664 -17.515 811 HA SER 118 HA SER 118 30.904 2.266 -18.903 812 HB2 SER 118 HB2 SER 118 29.002 2.172 -20.453 813 HB3 SER 118 HB3 SER 118 28.769 3.910 -20.289 814 HG SER 118 HG SER 118 30.189 2.836 -22.077 815 H ALA 119 H ALA 119 32.661 3.543 -19.234 816 HA ALA 119 HA ALA 119 32.854 5.921 -17.727 817 HB1 ALA 119 HB1 ALA 119 34.695 4.197 -18.412 818 HB2 ALA 119 HB2 ALA 119 35.130 5.901 -18.279 819 HB3 ALA 119 HB3 ALA 119 34.839 5.186 -19.864 820 H PHE 120 H PHE 120 34.245 7.768 -19.123 821 HA PHE 120 HA PHE 120 32.643 8.501 -21.477 822 HB2 PHE 120 HB2 PHE 120 33.130 10.326 -19.107 823 HB3 PHE 120 HB3 PHE 120 32.416 10.822 -20.641 824 HD1 PHE 120 HD1 PHE 120 31.874 9.036 -17.493 825 HD2 PHE 120 HD2 PHE 120 30.199 9.954 -21.340 826 HE1 PHE 120 HE1 PHE 120 29.644 8.286 -16.701 827 HE2 PHE 120 HE2 PHE 120 27.971 9.204 -20.549 828 HZ PHE 120 HZ PHE 120 27.693 8.372 -18.231 829 H GLY 121 H GLY 121 33.764 9.676 -23.015 830 HA2 GLY 121 HA2 GLY 121 36.297 10.922 -22.474 831 HA3 GLY 121 HA3 GLY 121 36.475 9.392 -23.329 832 H SER 122 H SER 122 37.177 11.994 -24.318 833 HA SER 122 HA SER 122 35.178 12.475 -26.431 834 HB2 SER 122 HB2 SER 122 37.511 14.148 -25.485 835 HB3 SER 122 HB3 SER 122 36.453 14.574 -26.828 836 HG SER 122 HG SER 122 36.068 15.077 -24.300 837 H LEU 123 H LEU 123 38.366 11.217 -25.886 838 HA LEU 123 HA LEU 123 39.958 10.314 -27.272 839 HB2 LEU 123 HB2 LEU 123 37.519 10.106 -29.048 840 HB3 LEU 123 HB3 LEU 123 39.094 9.462 -29.510 841 HG LEU 123 HG LEU 123 37.731 8.728 -26.903 842 HD11 LEU 123 HD11 LEU 123 37.174 6.576 -28.119 843 HD12 LEU 123 HD12 LEU 123 37.606 7.391 -29.622 844 HD13 LEU 123 HD13 LEU 123 36.251 7.980 -28.656 845 HD21 LEU 123 HD21 LEU 123 40.042 7.598 -28.513 846 HD22 LEU 123 HD22 LEU 123 39.280 6.720 -27.184 847 HD23 LEU 123 HD23 LEU 123 40.094 8.255 -26.875 848 H SER 124 H SER 124 41.138 10.640 -29.382 849 HA SER 124 HA SER 124 41.101 13.511 -30.066 850 HB2 SER 124 HB2 SER 124 43.400 13.156 -30.840 851 HB3 SER 124 HB3 SER 124 43.213 12.626 -29.170 852 HG SER 124 HG SER 124 43.627 11.161 -31.503 853 H SER 125 H SER 125 40.726 10.323 -31.393 854 HA SER 125 HA SER 125 40.030 9.550 -33.421 855 HB2 SER 125 HB2 SER 125 38.320 11.373 -33.271 856 HB3 SER 125 HB3 SER 125 39.443 12.448 -34.096 857 HG SER 125 HG SER 125 39.484 10.764 -35.772 858 H ALA 126 H ALA 126 42.158 8.919 -33.820 859 HA ALA 126 HA ALA 126 44.179 10.531 -34.858 860 HB1 ALA 126 HB1 ALA 126 45.134 8.556 -34.281 861 HB2 ALA 126 HB2 ALA 126 44.769 8.094 -35.947 862 HB3 ALA 126 HB3 ALA 126 43.673 7.635 -34.639 863 H LEU 127 H LEU 127 44.903 10.965 -36.933 864 HA LEU 127 HA LEU 127 43.397 9.984 -39.215 865 HB2 LEU 127 HB2 LEU 127 43.573 12.923 -38.506 866 HB3 LEU 127 HB3 LEU 127 43.171 12.346 -40.118 867 HG LEU 127 HG LEU 127 41.621 11.539 -37.640 868 HD11 LEU 127 HD11 LEU 127 40.977 13.696 -39.670 869 HD12 LEU 127 HD12 LEU 127 41.504 13.991 -38.013 870 HD13 LEU 127 HD13 LEU 127 39.956 13.204 -38.319 871 HD21 LEU 127 HD21 LEU 127 41.283 9.992 -39.457 872 HD22 LEU 127 HD22 LEU 127 41.147 11.305 -40.627 873 HD23 LEU 127 HD23 LEU 127 39.873 11.053 -39.432 874 H LEU 128 H LEU 128 44.635 9.937 -41.102 875 HA LEU 128 HA LEU 128 47.417 10.901 -40.810 876 HB2 LEU 128 HB2 LEU 128 46.737 8.307 -40.917 877 HB3 LEU 128 HB3 LEU 128 46.755 8.634 -42.646 878 HG LEU 128 HG LEU 128 49.075 9.649 -42.300 879 HD11 LEU 128 HD11 LEU 128 48.567 8.438 -39.577 880 HD12 LEU 128 HD12 LEU 128 49.197 10.037 -39.971 881 HD13 LEU 128 HD13 LEU 128 50.210 8.614 -40.200 882 HD21 LEU 128 HD21 LEU 128 50.157 7.379 -42.163 883 HD22 LEU 128 HD22 LEU 128 48.822 7.453 -43.312 884 HD23 LEU 128 HD23 LEU 128 48.584 6.708 -41.729 885 H MET 129 H MET 129 45.683 12.710 -41.761 886 HA MET 129 HA MET 129 45.270 14.155 -43.495 887 HB2 MET 129 HB2 MET 129 47.769 12.749 -44.423 888 HB3 MET 129 HB3 MET 129 46.978 13.932 -45.457 889 HG2 MET 129 HG2 MET 129 47.148 15.624 -43.675 890 HG3 MET 129 HG3 MET 129 47.906 14.438 -42.614 891 HE1 MET 129 HE1 MET 129 50.204 16.043 -42.294 892 HE2 MET 129 HE2 MET 129 48.965 17.073 -43.007 893 HE3 MET 129 HE3 MET 129 50.601 17.088 -43.664 894 HA PRO 130 HA PRO 130 42.639 12.072 -46.400 895 HB2 PRO 130 HB2 PRO 130 42.582 13.722 -48.571 896 HB3 PRO 130 HB3 PRO 130 41.782 14.118 -47.036 897 HG2 PRO 130 HG2 PRO 130 44.421 15.038 -48.086 898 HG3 PRO 130 HG3 PRO 130 43.144 15.968 -47.280 899 HD2 PRO 130 HD2 PRO 130 45.354 15.124 -45.955 900 HD3 PRO 130 HD3 PRO 130 43.772 15.256 -45.159 901 H LYS 131 H LYS 131 42.562 10.822 -48.343 902 HA LYS 131 HA LYS 131 45.189 9.943 -49.251 903 HB2 LYS 131 HB2 LYS 131 42.411 8.873 -49.768 904 HB3 LYS 131 HB3 LYS 131 43.891 8.137 -50.381 905 HG2 LYS 131 HG2 LYS 131 44.720 7.943 -48.030 906 HG3 LYS 131 HG3 LYS 131 43.169 8.557 -47.464 907 HD2 LYS 131 HD2 LYS 131 43.430 6.097 -49.214 908 HD3 LYS 131 HD3 LYS 131 43.398 6.023 -47.453 909 HE2 LYS 131 HE2 LYS 131 41.218 7.246 -49.177 910 HE3 LYS 131 HE3 LYS 131 41.148 5.643 -48.446 911 HZ1 LYS 131 HZ1 LYS 131 41.707 7.019 -46.302 912 HZ2 LYS 131 HZ2 LYS 131 40.108 6.856 -46.850 913 HZ3 LYS 131 HZ3 LYS 131 40.981 8.275 -47.178 914 H ASP 132 H ASP 132 43.230 12.387 -50.264 915 HA ASP 132 HA ASP 132 42.833 13.463 -52.271 916 HB2 ASP 132 HB2 ASP 132 45.630 12.398 -52.743 917 HB3 ASP 132 HB3 ASP 132 44.883 13.734 -53.616 918 H GLY 133 H GLY 133 41.417 11.185 -52.426 919 HA2 GLY 133 HA2 GLY 133 42.163 9.662 -54.795 920 HA3 GLY 133 HA3 GLY 133 40.772 9.373 -53.754 921 H LEU 134 H LEU 134 41.669 12.454 -55.247 922 HA LEU 134 HA LEU 134 39.069 12.494 -56.633 923 HB2 LEU 134 HB2 LEU 134 40.967 14.627 -55.682 924 HB3 LEU 134 HB3 LEU 134 39.789 14.986 -56.942 925 HG LEU 134 HG LEU 134 38.022 13.999 -55.355 926 HD11 LEU 134 HD11 LEU 134 39.411 12.841 -53.776 927 HD12 LEU 134 HD12 LEU 134 38.717 14.214 -52.915 928 HD13 LEU 134 HD13 LEU 134 40.385 14.282 -53.483 929 HD21 LEU 134 HD21 LEU 134 39.529 16.531 -54.630 930 HD22 LEU 134 HD22 LEU 134 37.927 16.125 -54.014 931 HD23 LEU 134 HD23 LEU 134 38.167 16.396 -55.742 932 H GLU 135 H GLU 135 41.930 11.346 -57.460 933 HA GLU 135 HA GLU 135 42.772 12.754 -59.749 934 HB2 GLU 135 HB2 GLU 135 43.031 9.847 -58.964 935 HB3 GLU 135 HB3 GLU 135 43.793 10.530 -60.402 936 HG2 GLU 135 HG2 GLU 135 45.066 12.093 -59.067 937 HG3 GLU 135 HG3 GLU 135 44.191 11.636 -57.610 938 H HIS 136 H HIS 136 40.392 10.164 -59.326 939 HA HIS 136 HA HIS 136 39.633 10.444 -62.174 940 HB2 HIS 136 HB2 HIS 136 39.153 8.144 -60.263 941 HB3 HIS 136 HB3 HIS 136 38.577 8.215 -61.925 942 HD2 HIS 136 HD2 HIS 136 41.694 7.070 -60.039 943 HE1 HIS 136 HE1 HIS 136 42.893 7.546 -64.058 944 HE2 HIS 136 HE2 HIS 136 43.571 6.615 -61.796 945 H HIS 137 H HIS 137 37.790 11.434 -62.605 946 HA HIS 137 HA HIS 137 35.558 11.299 -60.694 947 HB2 HIS 137 HB2 HIS 137 36.896 13.408 -60.311 948 HB3 HIS 137 HB3 HIS 137 36.480 13.893 -61.953 949 HD2 HIS 137 HD2 HIS 137 34.826 13.714 -58.428 950 HE1 HIS 137 HE1 HIS 137 31.911 15.132 -61.133 951 HE2 HIS 137 HE2 HIS 137 32.443 14.752 -58.679 952 H HIS 138 H HIS 138 34.380 10.000 -62.078 953 HA HIS 138 HA HIS 138 33.316 11.331 -64.471 954 HB2 HIS 138 HB2 HIS 138 34.479 8.537 -64.453 955 HB3 HIS 138 HB3 HIS 138 33.522 9.214 -65.770 956 HD2 HIS 138 HD2 HIS 138 34.919 10.976 -67.454 957 HE1 HIS 138 HE1 HIS 138 38.566 10.921 -65.332 958 HE2 HIS 138 HE2 HIS 138 37.423 11.711 -67.458 959 H HIS 139 H HIS 139 31.267 10.593 -65.131 960 HA HIS 139 HA HIS 139 29.103 9.924 -64.762 961 HB2 HIS 139 HB2 HIS 139 30.520 7.548 -63.527 962 HB3 HIS 139 HB3 HIS 139 28.817 7.592 -63.972 963 HD2 HIS 139 HD2 HIS 139 32.158 6.726 -65.600 964 HE1 HIS 139 HE1 HIS 139 29.473 7.418 -68.784 965 HE2 HIS 139 HE2 HIS 139 31.763 6.507 -68.173 966 H HIS 140 H HIS 140 30.124 11.728 -62.863 967 HA HIS 140 HA HIS 140 28.946 10.815 -60.312 968 HB2 HIS 140 HB2 HIS 140 31.314 11.695 -60.328 969 HB3 HIS 140 HB3 HIS 140 30.655 13.262 -60.790 970 HD2 HIS 140 HD2 HIS 140 31.031 11.064 -57.605 971 HE1 HIS 140 HE1 HIS 140 28.781 14.467 -56.520 972 HE2 HIS 140 HE2 HIS 140 30.001 12.424 -55.630 973 H HIS 141 H HIS 141 26.925 11.433 -59.951 974 HA HIS 141 HA HIS 141 26.064 14.133 -60.757 975 HB2 HIS 141 HB2 HIS 141 25.322 12.431 -62.472 976 HB3 HIS 141 HB3 HIS 141 24.366 11.669 -61.203 977 HD2 HIS 141 HD2 HIS 141 21.824 12.727 -61.063 978 HE1 HIS 141 HE1 HIS 141 22.627 16.486 -62.807 979 HE2 HIS 141 HE2 HIS 141 20.806 15.000 -61.845 Start of MODEL 14 1 H1 MET 1 HT1 MET 1 4.220 1.927 -6.321 2 H2 MET 1 HT2 MET 1 5.449 0.784 -6.051 3 H3 MET 1 HT3 MET 1 3.864 0.271 -6.383 4 HA MET 1 HA MET 1 5.207 -0.016 -8.335 5 HB2 MET 1 HB2 MET 1 3.292 2.329 -8.547 6 HB3 MET 1 HB3 MET 1 3.860 1.354 -9.901 7 HG2 MET 1 HG2 MET 1 2.284 0.310 -7.526 8 HG3 MET 1 HG3 MET 1 1.623 0.621 -9.129 9 HE1 MET 1 HE1 MET 1 2.121 -0.529 -11.183 10 HE2 MET 1 HE2 MET 1 3.160 -1.930 -11.424 11 HE3 MET 1 HE3 MET 1 3.880 -0.353 -11.125 12 H SER 2 H SER 2 6.599 2.061 -6.463 13 HA SER 2 HA SER 2 7.548 4.125 -8.222 14 HB2 SER 2 HB2 SER 2 7.513 4.508 -5.821 15 HB3 SER 2 HB3 SER 2 8.578 3.131 -5.554 16 HG SER 2 HG SER 2 9.832 4.970 -5.591 17 H ASP 3 H ASP 3 9.160 4.040 -9.642 18 HA ASP 3 HA ASP 3 10.447 1.634 -10.347 19 HB2 ASP 3 HB2 ASP 3 10.086 3.580 -11.877 20 HB3 ASP 3 HB3 ASP 3 11.357 4.441 -11.010 21 H GLN 4 H GLN 4 11.561 4.438 -8.463 22 HA GLN 4 HA GLN 4 13.351 2.862 -6.915 23 HB2 GLN 4 HB2 GLN 4 15.485 3.863 -7.671 24 HB3 GLN 4 HB3 GLN 4 14.727 2.879 -8.920 25 HG2 GLN 4 HG2 GLN 4 13.720 5.036 -9.834 26 HG3 GLN 4 HG3 GLN 4 14.790 5.901 -8.732 27 HE21 GLN 4 HE21 GLN 4 16.779 6.445 -9.618 28 HE22 GLN 4 HE22 GLN 4 17.525 5.631 -10.908 29 H SER 5 H SER 5 12.803 6.182 -8.133 30 HA SER 5 HA SER 5 12.317 7.154 -5.466 31 HB2 SER 5 HB2 SER 5 14.771 7.162 -5.454 32 HB3 SER 5 HB3 SER 5 14.787 8.096 -6.948 33 HG SER 5 HG SER 5 13.647 8.878 -4.461 34 H GLN 6 H GLN 6 11.167 9.063 -5.495 35 HA GLN 6 HA GLN 6 9.784 10.684 -6.372 36 HB2 GLN 6 HB2 GLN 6 12.160 10.914 -8.239 37 HB3 GLN 6 HB3 GLN 6 10.805 12.044 -8.248 38 HG2 GLN 6 HG2 GLN 6 11.231 12.678 -5.955 39 HG3 GLN 6 HG3 GLN 6 12.445 11.413 -5.780 40 HE21 GLN 6 HE21 GLN 6 12.760 14.407 -5.519 41 HE22 GLN 6 HE22 GLN 6 13.977 14.821 -6.628 42 H GLU 7 H GLU 7 8.709 8.454 -6.915 43 HA GLU 7 HA GLU 7 7.903 8.547 -9.757 44 HB2 GLU 7 HB2 GLU 7 8.431 6.057 -8.120 45 HB3 GLU 7 HB3 GLU 7 7.760 6.079 -9.750 46 HG2 GLU 7 HG2 GLU 7 10.479 7.196 -8.995 47 HG3 GLU 7 HG3 GLU 7 10.219 5.625 -9.737 48 HA PRO 8 HA PRO 8 3.731 8.601 -8.223 49 HB2 PRO 8 HB2 PRO 8 3.086 6.366 -10.102 50 HB3 PRO 8 HB3 PRO 8 2.306 7.951 -9.925 51 HG2 PRO 8 HG2 PRO 8 3.881 7.467 -11.985 52 HG3 PRO 8 HG3 PRO 8 3.935 9.037 -11.159 53 HD2 PRO 8 HD2 PRO 8 5.857 6.734 -10.954 54 HD3 PRO 8 HD3 PRO 8 6.193 8.481 -11.003 55 H THR 9 H THR 9 3.097 7.766 -6.356 56 HA THR 9 HA THR 9 3.992 5.242 -5.355 57 HB THR 9 HB THR 9 1.827 7.052 -4.241 58 HG1 THR 9 HG1 THR 9 4.636 7.013 -3.846 59 HG21 THR 9 HG21 THR 9 2.163 5.949 -2.183 60 HG22 THR 9 HG22 THR 9 3.703 5.260 -2.703 61 HG23 THR 9 HG23 THR 9 2.192 4.631 -3.356 62 H MET 10 H MET 10 2.867 3.325 -5.109 63 HA MET 10 HA MET 10 1.031 2.498 -6.990 64 HB2 MET 10 HB2 MET 10 0.553 0.595 -5.510 65 HB3 MET 10 HB3 MET 10 2.275 0.953 -5.537 66 HG2 MET 10 HG2 MET 10 2.046 2.206 -3.412 67 HG3 MET 10 HG3 MET 10 0.325 1.820 -3.379 68 HE1 MET 10 HE1 MET 10 0.540 0.902 -1.059 69 HE2 MET 10 HE2 MET 10 2.281 1.160 -0.973 70 HE3 MET 10 HE3 MET 10 1.608 -0.410 -0.538 71 H GLU 11 H GLU 11 0.439 4.221 -4.051 72 HA GLU 11 HA GLU 11 -2.324 3.757 -3.699 73 HB2 GLU 11 HB2 GLU 11 -0.855 4.919 -2.039 74 HB3 GLU 11 HB3 GLU 11 -0.825 6.325 -3.102 75 HG2 GLU 11 HG2 GLU 11 -3.283 6.507 -2.940 76 HG3 GLU 11 HG3 GLU 11 -3.318 5.098 -1.883 77 H GLU 12 H GLU 12 -0.613 6.311 -5.495 78 HA GLU 12 HA GLU 12 -2.861 7.662 -6.458 79 HB2 GLU 12 HB2 GLU 12 -0.084 7.368 -7.602 80 HB3 GLU 12 HB3 GLU 12 -1.302 8.437 -8.297 81 HG2 GLU 12 HG2 GLU 12 -1.471 9.695 -6.235 82 HG3 GLU 12 HG3 GLU 12 -0.439 8.545 -5.395 83 H ILE 13 H ILE 13 -1.018 4.991 -8.040 84 HA ILE 13 HA ILE 13 -2.463 4.972 -10.430 85 HB ILE 13 HB ILE 13 -1.019 2.728 -8.979 86 HG12 ILE 13 HG12 ILE 13 -0.163 4.364 -11.386 87 HG13 ILE 13 HG13 ILE 13 0.222 4.845 -9.734 88 HG21 ILE 13 HG21 ILE 13 -2.532 1.691 -10.579 89 HG22 ILE 13 HG22 ILE 13 -0.919 1.683 -11.289 90 HG23 ILE 13 HG23 ILE 13 -2.108 2.873 -11.816 91 HD11 ILE 13 HD11 ILE 13 1.002 2.212 -11.031 92 HD12 ILE 13 HD12 ILE 13 1.380 2.689 -9.375 93 HD13 ILE 13 HD13 ILE 13 2.087 3.571 -10.730 94 H LEU 14 H LEU 14 -3.047 2.995 -7.481 95 HA LEU 14 HA LEU 14 -5.358 1.720 -8.546 96 HB2 LEU 14 HB2 LEU 14 -5.814 1.061 -6.165 97 HB3 LEU 14 HB3 LEU 14 -4.240 0.603 -6.776 98 HG LEU 14 HG LEU 14 -3.605 3.018 -5.682 99 HD11 LEU 14 HD11 LEU 14 -6.024 3.203 -4.863 100 HD12 LEU 14 HD12 LEU 14 -4.766 3.447 -3.658 101 HD13 LEU 14 HD13 LEU 14 -5.622 1.910 -3.735 102 HD21 LEU 14 HD21 LEU 14 -2.400 0.981 -5.176 103 HD22 LEU 14 HD22 LEU 14 -3.773 0.345 -4.271 104 HD23 LEU 14 HD23 LEU 14 -2.872 1.728 -3.651 105 H ALA 15 H ALA 15 -4.836 4.624 -6.645 106 HA ALA 15 HA ALA 15 -7.528 5.224 -6.009 107 HB1 ALA 15 HB1 ALA 15 -5.680 6.395 -4.928 108 HB2 ALA 15 HB2 ALA 15 -6.711 7.559 -5.759 109 HB3 ALA 15 HB3 ALA 15 -5.173 7.074 -6.476 110 H SER 16 H SER 16 -5.505 5.917 -8.805 111 HA SER 16 HA SER 16 -7.249 7.638 -10.199 112 HB2 SER 16 HB2 SER 16 -5.098 5.763 -11.198 113 HB3 SER 16 HB3 SER 16 -5.921 6.950 -12.207 114 HG SER 16 HG SER 16 -5.156 8.567 -10.804 115 H ILE 17 H ILE 17 -6.944 4.096 -10.174 116 HA ILE 17 HA ILE 17 -8.672 3.548 -12.334 117 HB ILE 17 HB ILE 17 -8.054 1.912 -9.856 118 HG12 ILE 17 HG12 ILE 17 -6.076 2.417 -11.237 119 HG13 ILE 17 HG13 ILE 17 -6.480 0.712 -11.340 120 HG21 ILE 17 HG21 ILE 17 -10.124 1.075 -10.836 121 HG22 ILE 17 HG22 ILE 17 -8.817 -0.050 -11.205 122 HG23 ILE 17 HG23 ILE 17 -9.396 1.063 -12.444 123 HD11 ILE 17 HD11 ILE 17 -5.938 1.472 -13.573 124 HD12 ILE 17 HD12 ILE 17 -7.022 2.853 -13.424 125 HD13 ILE 17 HD13 ILE 17 -7.683 1.222 -13.516 126 H ARG 18 H ARG 18 -9.358 3.848 -8.827 127 HA ARG 18 HA ARG 18 -11.319 4.257 -7.698 128 HB2 ARG 18 HB2 ARG 18 -12.192 5.378 -10.384 129 HB3 ARG 18 HB3 ARG 18 -13.013 5.658 -8.852 130 HG2 ARG 18 HG2 ARG 18 -10.903 6.670 -7.961 131 HG3 ARG 18 HG3 ARG 18 -10.195 6.499 -9.566 132 HD2 ARG 18 HD2 ARG 18 -12.037 7.883 -10.501 133 HD3 ARG 18 HD3 ARG 18 -12.664 8.111 -8.870 134 HE ARG 18 HE ARG 18 -10.326 9.391 -10.027 135 HH11 ARG 18 HH11 ARG 18 -11.982 8.527 -7.060 136 HH12 ARG 18 HH12 ARG 18 -11.182 9.748 -6.125 137 HH21 ARG 18 HH21 ARG 18 -9.312 10.959 -8.774 138 HH22 ARG 18 HH22 ARG 18 -9.682 11.110 -7.089 139 H ARG 19 H ARG 19 -14.004 4.109 -8.463 140 HA ARG 19 HA ARG 19 -15.710 2.580 -8.575 141 HB2 ARG 19 HB2 ARG 19 -14.771 2.844 -11.023 142 HB3 ARG 19 HB3 ARG 19 -14.227 1.187 -10.783 143 HG2 ARG 19 HG2 ARG 19 -16.376 0.946 -11.749 144 HG3 ARG 19 HG3 ARG 19 -16.653 0.696 -10.026 145 HD2 ARG 19 HD2 ARG 19 -18.362 2.198 -10.823 146 HD3 ARG 19 HD3 ARG 19 -17.245 3.143 -9.848 147 HE ARG 19 HE ARG 19 -16.451 3.196 -12.580 148 HH11 ARG 19 HH11 ARG 19 -18.868 4.512 -10.412 149 HH12 ARG 19 HH12 ARG 19 -19.113 5.936 -11.365 150 HH21 ARG 19 HH21 ARG 19 -16.803 5.059 -13.789 151 HH22 ARG 19 HH22 ARG 19 -17.954 6.244 -13.262 152 H ILE 20 H ILE 20 -15.395 1.540 -6.595 153 HA ILE 20 HA ILE 20 -15.008 -1.259 -6.716 154 HB ILE 20 HB ILE 20 -12.626 -0.607 -6.899 155 HG12 ILE 20 HG12 ILE 20 -13.110 -1.794 -4.157 156 HG13 ILE 20 HG13 ILE 20 -13.475 -2.688 -5.632 157 HG21 ILE 20 HG21 ILE 20 -13.138 0.695 -4.210 158 HG22 ILE 20 HG22 ILE 20 -12.631 1.497 -5.697 159 HG23 ILE 20 HG23 ILE 20 -11.532 0.391 -4.873 160 HD11 ILE 20 HD11 ILE 20 -11.257 -3.331 -5.042 161 HD12 ILE 20 HD12 ILE 20 -10.789 -1.667 -4.690 162 HD13 ILE 20 HD13 ILE 20 -11.068 -2.172 -6.358 163 H ILE 21 H ILE 21 -15.217 1.676 -4.800 164 HA ILE 21 HA ILE 21 -15.808 0.444 -2.311 165 HB ILE 21 HB ILE 21 -16.731 2.726 -1.693 166 HG12 ILE 21 HG12 ILE 21 -15.594 3.597 -4.368 167 HG13 ILE 21 HG13 ILE 21 -17.313 3.304 -4.149 168 HG21 ILE 21 HG21 ILE 21 -14.423 3.803 -1.944 169 HG22 ILE 21 HG22 ILE 21 -13.954 2.357 -2.836 170 HG23 ILE 21 HG23 ILE 21 -14.462 2.228 -1.154 171 HD11 ILE 21 HD11 ILE 21 -17.221 4.931 -2.190 172 HD12 ILE 21 HD12 ILE 21 -16.985 5.646 -3.785 173 HD13 ILE 21 HD13 ILE 21 -15.598 5.355 -2.736 174 H SER 22 H SER 22 -17.403 -0.961 -2.159 175 HA SER 22 HA SER 22 -20.135 -0.024 -2.476 176 HB2 SER 22 HB2 SER 22 -19.669 -0.907 -4.716 177 HB3 SER 22 HB3 SER 22 -19.117 -2.425 -4.016 178 HG SER 22 HG SER 22 -21.586 -1.701 -4.637 179 H GLU 23 H GLU 23 -21.325 -0.792 -0.831 180 HA GLU 23 HA GLU 23 -20.882 -3.439 0.252 181 HB2 GLU 23 HB2 GLU 23 -20.405 -2.680 2.554 182 HB3 GLU 23 HB3 GLU 23 -19.129 -2.222 1.430 183 HG2 GLU 23 HG2 GLU 23 -20.105 0.049 1.258 184 HG3 GLU 23 HG3 GLU 23 -21.366 -0.410 2.397 185 H ASP 24 H ASP 24 -22.489 -4.179 1.564 186 HA ASP 24 HA ASP 24 -24.540 -4.395 2.556 187 HB2 ASP 24 HB2 ASP 24 -24.847 -1.395 2.261 188 HB3 ASP 24 HB3 ASP 24 -25.838 -2.465 3.248 189 H ASP 25 H ASP 25 -24.586 -2.040 -0.125 190 HA ASP 25 HA ASP 25 -27.171 -2.824 -1.021 191 HB2 ASP 25 HB2 ASP 25 -24.944 -1.275 -2.345 192 HB3 ASP 25 HB3 ASP 25 -26.493 -1.576 -3.125 193 H ALA 26 H ALA 26 -23.874 -3.651 -1.933 194 HA ALA 26 HA ALA 26 -24.530 -5.288 -4.157 195 HB1 ALA 26 HB1 ALA 26 -22.087 -5.094 -2.399 196 HB2 ALA 26 HB2 ALA 26 -22.302 -4.484 -4.040 197 HB3 ALA 26 HB3 ALA 26 -22.188 -6.221 -3.754 198 HA PRO 27 HA PRO 27 -25.924 -8.953 -1.994 199 HB2 PRO 27 HB2 PRO 27 -25.497 -10.886 -3.858 200 HB3 PRO 27 HB3 PRO 27 -26.795 -9.684 -4.002 201 HG2 PRO 27 HG2 PRO 27 -24.109 -9.732 -5.300 202 HG3 PRO 27 HG3 PRO 27 -25.690 -9.327 -5.992 203 HD2 PRO 27 HD2 PRO 27 -23.903 -7.418 -5.220 204 HD3 PRO 27 HD3 PRO 27 -25.662 -7.170 -5.148 205 H ALA 28 H ALA 28 -22.671 -8.596 -3.071 206 HA ALA 28 HA ALA 28 -20.665 -9.453 -2.361 207 HB1 ALA 28 HB1 ALA 28 -22.143 -10.730 -0.058 208 HB2 ALA 28 HB2 ALA 28 -21.774 -9.007 -0.097 209 HB3 ALA 28 HB3 ALA 28 -20.466 -10.189 -0.113 210 H GLU 29 H GLU 29 -22.422 -10.960 -4.153 211 HA GLU 29 HA GLU 29 -21.004 -13.480 -4.095 212 HB2 GLU 29 HB2 GLU 29 -23.059 -13.835 -2.640 213 HB3 GLU 29 HB3 GLU 29 -24.035 -13.535 -4.080 214 HG2 GLU 29 HG2 GLU 29 -23.735 -15.929 -3.862 215 HG3 GLU 29 HG3 GLU 29 -22.788 -15.378 -5.239 216 HA PRO 30 HA PRO 30 -21.956 -11.270 -8.191 217 HB2 PRO 30 HB2 PRO 30 -19.171 -12.268 -8.626 218 HB3 PRO 30 HB3 PRO 30 -19.896 -10.722 -9.106 219 HG2 PRO 30 HG2 PRO 30 -18.251 -10.812 -7.064 220 HG3 PRO 30 HG3 PRO 30 -19.740 -9.850 -6.956 221 HD2 PRO 30 HD2 PRO 30 -19.154 -12.549 -5.767 222 HD3 PRO 30 HD3 PRO 30 -20.024 -11.171 -5.054 223 H ALA 31 H ALA 31 -22.744 -12.287 -9.951 224 HA ALA 31 HA ALA 31 -23.156 -15.074 -10.009 225 HB1 ALA 31 HB1 ALA 31 -24.334 -14.700 -11.981 226 HB2 ALA 31 HB2 ALA 31 -23.244 -13.411 -12.501 227 HB3 ALA 31 HB3 ALA 31 -24.412 -13.112 -11.214 228 H ALA 32 H ALA 32 -20.841 -12.985 -11.661 229 HA ALA 32 HA ALA 32 -18.912 -13.410 -12.792 230 HB1 ALA 32 HB1 ALA 32 -18.536 -16.201 -12.000 231 HB2 ALA 32 HB2 ALA 32 -18.900 -15.152 -10.628 232 HB3 ALA 32 HB3 ALA 32 -17.525 -14.793 -11.672 233 H GLU 33 H GLU 33 -20.059 -13.273 -14.734 234 HA GLU 33 HA GLU 33 -20.215 -15.818 -16.213 235 HB2 GLU 33 HB2 GLU 33 -22.252 -13.581 -16.268 236 HB3 GLU 33 HB3 GLU 33 -22.242 -14.958 -17.371 237 HG2 GLU 33 HG2 GLU 33 -22.455 -16.492 -15.439 238 HG3 GLU 33 HG3 GLU 33 -22.490 -15.106 -14.350 239 H ALA 34 H ALA 34 -20.138 -15.465 -18.597 240 HA ALA 34 HA ALA 34 -18.718 -12.973 -19.321 241 HB1 ALA 34 HB1 ALA 34 -17.248 -15.090 -19.052 242 HB2 ALA 34 HB2 ALA 34 -17.077 -14.141 -20.529 243 HB3 ALA 34 HB3 ALA 34 -18.015 -15.633 -20.543 244 H ALA 35 H ALA 35 -19.562 -11.940 -20.967 245 HA ALA 35 HA ALA 35 -21.051 -13.394 -23.033 246 HB1 ALA 35 HB1 ALA 35 -22.511 -11.016 -22.551 247 HB2 ALA 35 HB2 ALA 35 -22.228 -11.747 -20.969 248 HB3 ALA 35 HB3 ALA 35 -23.029 -12.675 -22.239 249 HA PRO 36 HA PRO 36 -18.141 -10.201 -24.752 250 HB2 PRO 36 HB2 PRO 36 -17.468 -11.562 -27.022 251 HB3 PRO 36 HB3 PRO 36 -16.670 -11.829 -25.459 252 HG2 PRO 36 HG2 PRO 36 -18.838 -13.407 -26.771 253 HG3 PRO 36 HG3 PRO 36 -17.388 -13.973 -25.920 254 HD2 PRO 36 HD2 PRO 36 -19.830 -13.941 -24.730 255 HD3 PRO 36 HD3 PRO 36 -18.331 -13.662 -23.818 256 HA PRO 37 HA PRO 37 -21.266 -8.547 -27.546 257 HB2 PRO 37 HB2 PRO 37 -19.966 -6.438 -28.614 258 HB3 PRO 37 HB3 PRO 37 -20.448 -6.466 -26.905 259 HG2 PRO 37 HG2 PRO 37 -17.783 -7.031 -28.127 260 HG3 PRO 37 HG3 PRO 37 -18.183 -6.071 -26.690 261 HD2 PRO 37 HD2 PRO 37 -17.287 -8.656 -26.547 262 HD3 PRO 37 HD3 PRO 37 -18.356 -7.929 -25.326 263 HA PRO 38 HA PRO 38 -20.470 -10.194 -31.626 264 HB2 PRO 38 HB2 PRO 38 -21.838 -8.527 -33.304 265 HB3 PRO 38 HB3 PRO 38 -22.644 -9.693 -32.235 266 HG2 PRO 38 HG2 PRO 38 -22.212 -6.763 -31.856 267 HG3 PRO 38 HG3 PRO 38 -23.660 -7.739 -31.546 268 HD2 PRO 38 HD2 PRO 38 -21.984 -6.990 -29.546 269 HD3 PRO 38 HD3 PRO 38 -22.858 -8.539 -29.514 270 HA PRO 39 HA PRO 39 -16.976 -8.006 -33.320 271 HB2 PRO 39 HB2 PRO 39 -16.905 -8.833 -35.926 272 HB3 PRO 39 HB3 PRO 39 -16.429 -9.865 -34.564 273 HG2 PRO 39 HG2 PRO 39 -19.007 -9.787 -36.067 274 HG3 PRO 39 HG3 PRO 39 -18.063 -11.185 -35.520 275 HD2 PRO 39 HD2 PRO 39 -20.251 -10.324 -34.168 276 HD3 PRO 39 HD3 PRO 39 -18.851 -11.038 -33.335 277 HA PRO 40 HA PRO 40 -18.666 -4.316 -35.250 278 HB2 PRO 40 HB2 PRO 40 -16.418 -2.990 -35.973 279 HB3 PRO 40 HB3 PRO 40 -16.895 -3.186 -34.274 280 HG2 PRO 40 HG2 PRO 40 -14.894 -4.729 -35.861 281 HG3 PRO 40 HG3 PRO 40 -14.770 -4.087 -34.213 282 HD2 PRO 40 HD2 PRO 40 -15.365 -6.701 -34.727 283 HD3 PRO 40 HD3 PRO 40 -15.965 -5.844 -33.291 284 H GLU 41 H GLU 41 -18.917 -3.232 -37.292 285 HA GLU 41 HA GLU 41 -17.860 -4.690 -39.636 286 HB2 GLU 41 HB2 GLU 41 -20.705 -3.705 -39.256 287 HB3 GLU 41 HB3 GLU 41 -20.060 -4.401 -40.740 288 HG2 GLU 41 HG2 GLU 41 -20.184 -5.823 -38.060 289 HG3 GLU 41 HG3 GLU 41 -21.309 -6.076 -39.391 290 HA PRO 42 HA PRO 42 -17.114 -0.061 -39.911 291 HB2 PRO 42 HB2 PRO 42 -14.499 -0.167 -40.648 292 HB3 PRO 42 HB3 PRO 42 -15.019 -0.225 -38.952 293 HG2 PRO 42 HG2 PRO 42 -14.232 -2.462 -40.764 294 HG3 PRO 42 HG3 PRO 42 -13.788 -2.174 -39.071 295 HD2 PRO 42 HD2 PRO 42 -15.744 -3.930 -39.774 296 HD3 PRO 42 HD3 PRO 42 -15.799 -3.003 -38.259 297 H GLU 43 H GLU 43 -16.780 1.236 -41.774 298 HA GLU 43 HA GLU 43 -17.617 0.056 -44.237 299 HB2 GLU 43 HB2 GLU 43 -16.623 2.831 -43.557 300 HB3 GLU 43 HB3 GLU 43 -17.246 2.369 -45.140 301 HG2 GLU 43 HG2 GLU 43 -19.386 1.699 -44.103 302 HG3 GLU 43 HG3 GLU 43 -18.764 2.173 -42.522 303 HA PRO 44 HA PRO 44 -13.848 -1.082 -46.290 304 HB2 PRO 44 HB2 PRO 44 -14.591 0.828 -48.480 305 HB3 PRO 44 HB3 PRO 44 -14.101 -0.876 -48.590 306 HG2 PRO 44 HG2 PRO 44 -16.628 -0.238 -48.871 307 HG3 PRO 44 HG3 PRO 44 -16.179 -1.650 -47.893 308 HD2 PRO 44 HD2 PRO 44 -17.055 1.076 -46.974 309 HD3 PRO 44 HD3 PRO 44 -17.456 -0.524 -46.304 310 H GLU 45 H GLU 45 -14.599 2.391 -46.386 311 HA GLU 45 HA GLU 45 -13.280 4.268 -46.250 312 HB2 GLU 45 HB2 GLU 45 -11.749 2.418 -44.402 313 HB3 GLU 45 HB3 GLU 45 -11.536 4.165 -44.475 314 HG2 GLU 45 HG2 GLU 45 -14.143 2.756 -43.819 315 HG3 GLU 45 HG3 GLU 45 -13.063 3.480 -42.632 316 HA PRO 46 HA PRO 46 -10.158 2.413 -49.327 317 HB2 PRO 46 HB2 PRO 46 -10.863 4.059 -51.428 318 HB3 PRO 46 HB3 PRO 46 -11.548 2.447 -51.150 319 HG2 PRO 46 HG2 PRO 46 -12.665 5.123 -50.458 320 HG3 PRO 46 HG3 PRO 46 -13.481 3.699 -51.130 321 HD2 PRO 46 HD2 PRO 46 -13.689 4.322 -48.513 322 HD3 PRO 46 HD3 PRO 46 -13.622 2.631 -49.060 323 H VAL 47 H VAL 47 -11.065 5.625 -48.302 324 HA VAL 47 HA VAL 47 -8.717 6.961 -49.309 325 HB VAL 47 HB VAL 47 -10.742 7.826 -47.212 326 HG11 VAL 47 HG11 VAL 47 -8.598 9.377 -48.697 327 HG12 VAL 47 HG12 VAL 47 -8.692 9.111 -46.956 328 HG13 VAL 47 HG13 VAL 47 -9.891 10.126 -47.760 329 HG21 VAL 47 HG21 VAL 47 -10.500 8.531 -50.156 330 HG22 VAL 47 HG22 VAL 47 -11.721 9.142 -49.041 331 HG23 VAL 47 HG23 VAL 47 -11.701 7.432 -49.472 332 H SER 48 H SER 48 -6.766 7.088 -48.383 333 HA SER 48 HA SER 48 -6.025 5.479 -46.192 334 HB2 SER 48 HB2 SER 48 -4.595 7.827 -47.453 335 HB3 SER 48 HB3 SER 48 -3.864 6.702 -46.310 336 HG SER 48 HG SER 48 -4.839 6.225 -48.921 337 H PHE 49 H PHE 49 -5.602 5.921 -44.070 338 HA PHE 49 HA PHE 49 -6.906 8.295 -42.968 339 HB2 PHE 49 HB2 PHE 49 -6.642 7.170 -40.783 340 HB3 PHE 49 HB3 PHE 49 -7.472 6.147 -41.954 341 HD1 PHE 49 HD1 PHE 49 -4.346 6.676 -40.072 342 HD2 PHE 49 HD2 PHE 49 -6.396 4.157 -42.885 343 HE1 PHE 49 HE1 PHE 49 -2.637 4.910 -39.736 344 HE2 PHE 49 HE2 PHE 49 -4.686 2.393 -42.551 345 HZ PHE 49 HZ PHE 49 -2.808 2.770 -40.977 346 H ASP 50 H ASP 50 -3.709 6.957 -43.382 347 HA ASP 50 HA ASP 50 -2.418 8.750 -41.528 348 HB2 ASP 50 HB2 ASP 50 -0.348 7.789 -42.341 349 HB3 ASP 50 HB3 ASP 50 -1.515 6.500 -42.078 350 H ASP 51 H ASP 51 -0.393 9.955 -42.515 351 HA ASP 51 HA ASP 51 -0.755 11.189 -45.081 352 HB2 ASP 51 HB2 ASP 51 -2.448 12.283 -43.392 353 HB3 ASP 51 HB3 ASP 51 -1.018 13.110 -42.793 354 H GLU 52 H GLU 52 0.788 13.280 -45.091 355 HA GLU 52 HA GLU 52 3.284 12.494 -43.705 356 HB2 GLU 52 HB2 GLU 52 2.952 13.789 -46.422 357 HB3 GLU 52 HB3 GLU 52 4.495 13.476 -45.627 358 HG2 GLU 52 HG2 GLU 52 3.975 11.056 -45.586 359 HG3 GLU 52 HG3 GLU 52 2.448 11.377 -46.407 360 H VAL 53 H VAL 53 0.898 14.675 -43.459 361 HA VAL 53 HA VAL 53 2.327 17.124 -43.460 362 HB VAL 53 HB VAL 53 0.307 18.055 -42.347 363 HG11 VAL 53 HG11 VAL 53 -1.289 17.373 -44.237 364 HG12 VAL 53 HG12 VAL 53 0.002 16.307 -44.794 365 HG13 VAL 53 HG13 VAL 53 0.265 18.048 -44.723 366 HG21 VAL 53 HG21 VAL 53 -1.635 16.593 -41.979 367 HG22 VAL 53 HG22 VAL 53 -0.272 16.032 -41.012 368 HG23 VAL 53 HG23 VAL 53 -0.701 15.190 -42.497 369 H LEU 54 H LEU 54 1.545 14.704 -41.050 370 HA LEU 54 HA LEU 54 3.168 16.184 -39.070 371 HB2 LEU 54 HB2 LEU 54 0.722 14.462 -38.618 372 HB3 LEU 54 HB3 LEU 54 1.785 15.011 -37.324 373 HG LEU 54 HG LEU 54 0.456 16.917 -39.269 374 HD11 LEU 54 HD11 LEU 54 -1.285 15.703 -38.036 375 HD12 LEU 54 HD12 LEU 54 -1.161 17.355 -37.431 376 HD13 LEU 54 HD13 LEU 54 -0.454 16.026 -36.513 377 HD21 LEU 54 HD21 LEU 54 1.868 17.218 -36.601 378 HD22 LEU 54 HD22 LEU 54 0.910 18.507 -37.332 379 HD23 LEU 54 HD23 LEU 54 2.352 17.905 -38.152 380 H GLU 55 H GLU 55 4.644 15.044 -37.872 381 HA GLU 55 HA GLU 55 5.215 12.296 -38.807 382 HB2 GLU 55 HB2 GLU 55 7.545 12.722 -38.100 383 HB3 GLU 55 HB3 GLU 55 7.003 13.883 -39.308 384 HG2 GLU 55 HG2 GLU 55 6.522 15.519 -37.506 385 HG3 GLU 55 HG3 GLU 55 7.097 14.360 -36.312 386 H LEU 56 H LEU 56 3.351 13.167 -36.596 387 HA LEU 56 HA LEU 56 4.462 12.619 -34.066 388 HB2 LEU 56 HB2 LEU 56 1.643 12.356 -35.124 389 HB3 LEU 56 HB3 LEU 56 2.066 12.112 -33.431 390 HG LEU 56 HG LEU 56 2.762 14.645 -34.941 391 HD11 LEU 56 HD11 LEU 56 0.315 14.361 -34.911 392 HD12 LEU 56 HD12 LEU 56 0.799 15.649 -33.804 393 HD13 LEU 56 HD13 LEU 56 0.364 14.061 -33.172 394 HD21 LEU 56 HD21 LEU 56 2.823 15.521 -32.547 395 HD22 LEU 56 HD22 LEU 56 4.090 14.364 -32.947 396 HD23 LEU 56 HD23 LEU 56 2.686 13.844 -32.015 397 H THR 57 H THR 57 2.987 10.497 -36.489 398 HA THR 57 HA THR 57 4.324 8.205 -35.298 399 HB THR 57 HB THR 57 2.230 8.256 -34.034 400 HG1 THR 57 HG1 THR 57 1.647 6.164 -34.495 401 HG21 THR 57 HG21 THR 57 0.064 8.009 -35.155 402 HG22 THR 57 HG22 THR 57 0.856 8.047 -36.731 403 HG23 THR 57 HG23 THR 57 0.861 9.483 -35.706 404 H ASP 58 H ASP 58 4.544 6.446 -36.688 405 HA ASP 58 HA ASP 58 4.287 7.087 -39.512 406 HB2 ASP 58 HB2 ASP 58 5.616 5.064 -39.863 407 HB3 ASP 58 HB3 ASP 58 6.370 6.074 -38.636 408 HA PRO 59 HA PRO 59 0.607 4.689 -40.140 409 HB2 PRO 59 HB2 PRO 59 0.946 3.603 -42.620 410 HB3 PRO 59 HB3 PRO 59 0.614 5.328 -42.355 411 HG2 PRO 59 HG2 PRO 59 3.212 3.963 -42.888 412 HG3 PRO 59 HG3 PRO 59 2.579 5.479 -43.549 413 HD2 PRO 59 HD2 PRO 59 4.396 5.423 -41.522 414 HD3 PRO 59 HD3 PRO 59 3.178 6.707 -41.675 415 H ILE 60 H ILE 60 3.684 3.078 -40.366 416 HA ILE 60 HA ILE 60 2.852 0.398 -40.653 417 HB ILE 60 HB ILE 60 5.307 1.591 -39.314 418 HG12 ILE 60 HG12 ILE 60 5.038 0.229 -42.011 419 HG13 ILE 60 HG13 ILE 60 4.849 1.971 -41.811 420 HG21 ILE 60 HG21 ILE 60 4.841 -0.751 -38.531 421 HG22 ILE 60 HG22 ILE 60 6.311 -0.643 -39.498 422 HG23 ILE 60 HG23 ILE 60 4.829 -1.278 -40.214 423 HD11 ILE 60 HD11 ILE 60 7.103 2.221 -41.040 424 HD12 ILE 60 HD12 ILE 60 7.186 1.188 -42.468 425 HD13 ILE 60 HD13 ILE 60 7.304 0.477 -40.857 426 H ALA 61 H ALA 61 3.438 2.394 -37.764 427 HA ALA 61 HA ALA 61 2.889 2.109 -35.553 428 HB1 ALA 61 HB1 ALA 61 0.537 0.598 -36.726 429 HB2 ALA 61 HB2 ALA 61 0.632 2.355 -36.580 430 HB3 ALA 61 HB3 ALA 61 0.613 1.349 -35.131 431 HA PRO 62 HA PRO 62 4.421 -2.404 -35.698 432 HB2 PRO 62 HB2 PRO 62 6.947 -1.977 -34.747 433 HB3 PRO 62 HB3 PRO 62 6.537 -1.936 -36.472 434 HG2 PRO 62 HG2 PRO 62 6.890 0.324 -34.558 435 HG3 PRO 62 HG3 PRO 62 7.464 0.161 -36.229 436 HD2 PRO 62 HD2 PRO 62 5.257 1.614 -35.607 437 HD3 PRO 62 HD3 PRO 62 5.401 0.724 -37.139 438 H GLU 63 H GLU 63 4.370 0.171 -33.377 439 HA GLU 63 HA GLU 63 5.023 -1.344 -31.049 440 HB2 GLU 63 HB2 GLU 63 4.164 0.591 -29.806 441 HB3 GLU 63 HB3 GLU 63 5.227 1.107 -31.114 442 HG2 GLU 63 HG2 GLU 63 3.249 1.583 -32.524 443 HG3 GLU 63 HG3 GLU 63 2.192 1.081 -31.209 444 HA PRO 64 HA PRO 64 1.329 -3.563 -30.020 445 HB2 PRO 64 HB2 PRO 64 1.195 -2.107 -27.410 446 HB3 PRO 64 HB3 PRO 64 1.194 -3.853 -27.730 447 HG2 PRO 64 HG2 PRO 64 3.355 -2.689 -26.788 448 HG3 PRO 64 HG3 PRO 64 3.487 -3.922 -28.058 449 HD2 PRO 64 HD2 PRO 64 3.692 -0.933 -28.311 450 HD3 PRO 64 HD3 PRO 64 4.650 -2.198 -29.114 451 H GLU 65 H GLU 65 -0.819 -3.343 -30.387 452 HA GLU 65 HA GLU 65 -1.903 -0.631 -30.657 453 HB2 GLU 65 HB2 GLU 65 -2.064 -2.278 -32.541 454 HB3 GLU 65 HB3 GLU 65 -3.108 -3.269 -31.526 455 HG2 GLU 65 HG2 GLU 65 -4.722 -1.424 -31.349 456 HG3 GLU 65 HG3 GLU 65 -3.668 -0.396 -32.319 457 H LEU 66 H LEU 66 -3.482 0.176 -29.406 458 HA LEU 66 HA LEU 66 -4.837 -1.613 -27.480 459 HB2 LEU 66 HB2 LEU 66 -3.732 1.162 -26.949 460 HB3 LEU 66 HB3 LEU 66 -4.726 0.240 -25.824 461 HG LEU 66 HG LEU 66 -2.107 -0.808 -26.937 462 HD11 LEU 66 HD11 LEU 66 -1.816 1.312 -25.613 463 HD12 LEU 66 HD12 LEU 66 -1.053 -0.095 -24.872 464 HD13 LEU 66 HD13 LEU 66 -2.587 0.507 -24.249 465 HD21 LEU 66 HD21 LEU 66 -3.877 -1.595 -24.596 466 HD22 LEU 66 HD22 LEU 66 -2.278 -2.277 -24.900 467 HD23 LEU 66 HD23 LEU 66 -3.584 -2.539 -26.056 468 HA PRO 67 HA PRO 67 -8.684 0.023 -28.969 469 HB2 PRO 67 HB2 PRO 67 -9.402 0.655 -26.132 470 HB3 PRO 67 HB3 PRO 67 -10.318 -0.252 -27.353 471 HG2 PRO 67 HG2 PRO 67 -9.086 -1.536 -25.418 472 HG3 PRO 67 HG3 PRO 67 -9.041 -2.167 -27.077 473 HD2 PRO 67 HD2 PRO 67 -6.894 -0.716 -25.555 474 HD3 PRO 67 HD3 PRO 67 -6.748 -2.087 -26.679 475 HA PRO 68 HA PRO 68 -7.667 4.470 -29.165 476 HB2 PRO 68 HB2 PRO 68 -10.380 4.678 -30.402 477 HB3 PRO 68 HB3 PRO 68 -8.819 5.281 -30.995 478 HG2 PRO 68 HG2 PRO 68 -9.908 3.168 -32.109 479 HG3 PRO 68 HG3 PRO 68 -8.164 3.197 -31.775 480 HD2 PRO 68 HD2 PRO 68 -10.349 1.816 -30.228 481 HD3 PRO 68 HD3 PRO 68 -8.738 1.213 -30.679 482 H LEU 69 H LEU 69 -10.896 3.383 -28.181 483 HA LEU 69 HA LEU 69 -11.105 5.689 -26.333 484 HB2 LEU 69 HB2 LEU 69 -13.124 4.125 -27.906 485 HB3 LEU 69 HB3 LEU 69 -13.619 4.830 -26.369 486 HG LEU 69 HG LEU 69 -12.620 7.036 -27.244 487 HD11 LEU 69 HD11 LEU 69 -11.305 6.241 -29.090 488 HD12 LEU 69 HD12 LEU 69 -12.650 7.146 -29.785 489 HD13 LEU 69 HD13 LEU 69 -12.683 5.383 -29.782 490 HD21 LEU 69 HD21 LEU 69 -15.037 6.663 -27.094 491 HD22 LEU 69 HD22 LEU 69 -15.018 5.798 -28.632 492 HD23 LEU 69 HD23 LEU 69 -14.662 7.524 -28.588 493 H GLU 70 H GLU 70 -12.626 5.129 -24.434 494 HA GLU 70 HA GLU 70 -12.996 4.014 -22.474 495 HB2 GLU 70 HB2 GLU 70 -13.672 2.168 -24.183 496 HB3 GLU 70 HB3 GLU 70 -12.130 1.425 -23.755 497 HG2 GLU 70 HG2 GLU 70 -13.871 0.492 -22.334 498 HG3 GLU 70 HG3 GLU 70 -12.814 1.496 -21.349 499 H THR 71 H THR 71 -10.378 5.110 -23.176 500 HA THR 71 HA THR 71 -8.265 5.282 -22.360 501 HB THR 71 HB THR 71 -7.854 4.675 -20.066 502 HG1 THR 71 HG1 THR 71 -8.606 2.793 -19.563 503 HG21 THR 71 HG21 THR 71 -9.475 6.552 -20.593 504 HG22 THR 71 HG22 THR 71 -9.636 5.852 -18.982 505 HG23 THR 71 HG23 THR 71 -10.782 5.417 -20.251 506 H VAL 72 H VAL 72 -6.284 4.332 -22.404 507 HA VAL 72 HA VAL 72 -6.045 1.881 -23.809 508 HB VAL 72 HB VAL 72 -3.607 2.146 -23.439 509 HG11 VAL 72 HG11 VAL 72 -3.425 4.387 -24.542 510 HG12 VAL 72 HG12 VAL 72 -5.139 4.643 -24.215 511 HG13 VAL 72 HG13 VAL 72 -4.631 3.339 -25.288 512 HG21 VAL 72 HG21 VAL 72 -2.719 3.949 -22.125 513 HG22 VAL 72 HG22 VAL 72 -3.888 3.120 -21.096 514 HG23 VAL 72 HG23 VAL 72 -4.323 4.641 -21.874 515 H GLY 73 H GLY 73 -6.143 2.619 -20.412 516 HA2 GLY 73 HA2 GLY 73 -6.223 1.262 -18.558 517 HA3 GLY 73 HA3 GLY 73 -6.382 -0.109 -19.651 518 H ASP 74 H ASP 74 -4.881 -1.565 -19.083 519 HA ASP 74 HA ASP 74 -2.855 -2.549 -18.694 520 HB2 ASP 74 HB2 ASP 74 -1.622 0.052 -19.650 521 HB3 ASP 74 HB3 ASP 74 -0.819 -1.514 -19.522 522 H ILE 75 H ILE 75 -3.745 -2.274 -16.502 523 HA ILE 75 HA ILE 75 -3.024 -0.230 -14.758 524 HB ILE 75 HB ILE 75 -4.770 -1.924 -14.284 525 HG12 ILE 75 HG12 ILE 75 -4.027 -2.391 -11.864 526 HG13 ILE 75 HG13 ILE 75 -2.523 -1.572 -12.287 527 HG21 ILE 75 HG21 ILE 75 -3.484 -3.888 -15.146 528 HG22 ILE 75 HG22 ILE 75 -4.184 -4.163 -13.550 529 HG23 ILE 75 HG23 ILE 75 -2.463 -3.804 -13.709 530 HD11 ILE 75 HD11 ILE 75 -4.336 -0.105 -11.232 531 HD12 ILE 75 HD12 ILE 75 -5.236 -0.313 -12.735 532 HD13 ILE 75 HD13 ILE 75 -3.661 0.477 -12.756 533 H ASP 76 H ASP 76 -1.340 -3.148 -15.758 534 HA ASP 76 HA ASP 76 1.181 -2.050 -15.021 535 HB2 ASP 76 HB2 ASP 76 0.237 -2.966 -12.832 536 HB3 ASP 76 HB3 ASP 76 0.423 -4.566 -13.547 537 H VAL 77 H VAL 77 2.915 -3.128 -15.933 538 HA VAL 77 HA VAL 77 2.189 -5.181 -17.916 539 HB VAL 77 HB VAL 77 4.325 -4.560 -19.026 540 HG11 VAL 77 HG11 VAL 77 2.336 -3.437 -19.778 541 HG12 VAL 77 HG12 VAL 77 3.603 -2.218 -19.653 542 HG13 VAL 77 HG13 VAL 77 2.367 -2.337 -18.401 543 HG21 VAL 77 HG21 VAL 77 4.475 -2.285 -17.028 544 HG22 VAL 77 HG22 VAL 77 5.666 -2.729 -18.251 545 HG23 VAL 77 HG23 VAL 77 5.415 -3.768 -16.848 546 H TYR 78 H TYR 78 4.363 -6.550 -18.439 547 HA TYR 78 HA TYR 78 4.648 -8.360 -16.317 548 HB2 TYR 78 HB2 TYR 78 6.329 -7.917 -18.790 549 HB3 TYR 78 HB3 TYR 78 6.540 -9.283 -17.693 550 HD1 TYR 78 HD1 TYR 78 4.359 -7.731 -20.213 551 HD2 TYR 78 HD2 TYR 78 4.812 -11.014 -17.481 552 HE1 TYR 78 HE1 TYR 78 2.506 -8.927 -21.345 553 HE2 TYR 78 HE2 TYR 78 2.960 -12.213 -18.613 554 HH TYR 78 HH TYR 78 0.759 -11.048 -20.267 555 H SER 79 H SER 79 6.695 -5.640 -17.340 556 HA SER 79 HA SER 79 7.955 -5.598 -14.725 557 HB2 SER 79 HB2 SER 79 10.243 -5.692 -15.611 558 HB3 SER 79 HB3 SER 79 9.380 -7.183 -15.976 559 HG SER 79 HG SER 79 8.951 -6.305 -18.055 560 HA PRO 80 HA PRO 80 7.896 -1.253 -15.670 561 HB2 PRO 80 HB2 PRO 80 9.986 -0.253 -14.235 562 HB3 PRO 80 HB3 PRO 80 8.493 -0.837 -13.475 563 HG2 PRO 80 HG2 PRO 80 11.117 -2.222 -13.797 564 HG3 PRO 80 HG3 PRO 80 10.047 -2.149 -12.384 565 HD2 PRO 80 HD2 PRO 80 10.107 -4.306 -14.042 566 HD3 PRO 80 HD3 PRO 80 8.628 -3.794 -13.200 567 HA PRO 81 HA PRO 81 10.933 -0.690 -18.941 568 HB2 PRO 81 HB2 PRO 81 10.319 1.774 -19.823 569 HB3 PRO 81 HB3 PRO 81 9.174 0.428 -19.991 570 HG2 PRO 81 HG2 PRO 81 9.206 2.647 -18.007 571 HG3 PRO 81 HG3 PRO 81 7.836 1.911 -18.854 572 HD2 PRO 81 HD2 PRO 81 8.604 1.292 -16.248 573 HD3 PRO 81 HD3 PRO 81 7.609 0.250 -17.288 574 H GLU 82 H GLU 82 12.163 -0.461 -16.504 575 HA GLU 82 HA GLU 82 14.371 1.216 -17.033 576 HB2 GLU 82 HB2 GLU 82 12.687 2.950 -16.275 577 HB3 GLU 82 HB3 GLU 82 12.692 2.162 -14.697 578 HG2 GLU 82 HG2 GLU 82 15.131 2.519 -14.525 579 HG3 GLU 82 HG3 GLU 82 15.124 3.308 -16.101 580 HA PRO 83 HA PRO 83 14.923 -2.536 -14.253 581 HB2 PRO 83 HB2 PRO 83 17.567 -2.418 -15.646 582 HB3 PRO 83 HB3 PRO 83 16.537 -3.821 -15.296 583 HG2 PRO 83 HG2 PRO 83 16.670 -2.864 -17.744 584 HG3 PRO 83 HG3 PRO 83 15.112 -3.378 -17.070 585 HD2 PRO 83 HD2 PRO 83 16.178 -0.589 -17.425 586 HD3 PRO 83 HD3 PRO 83 14.531 -1.207 -17.691 587 H GLU 84 H GLU 84 15.673 -2.362 -12.224 588 HA GLU 84 HA GLU 84 17.360 -0.081 -11.505 589 HB2 GLU 84 HB2 GLU 84 15.856 -2.098 -9.815 590 HB3 GLU 84 HB3 GLU 84 16.792 -0.751 -9.171 591 HG2 GLU 84 HG2 GLU 84 14.606 0.110 -9.241 592 HG3 GLU 84 HG3 GLU 84 15.326 0.736 -10.719 593 H SER 85 H SER 85 19.285 -0.273 -10.327 594 HA SER 85 HA SER 85 20.859 -2.631 -10.945 595 HB2 SER 85 HB2 SER 85 21.916 -0.448 -11.121 596 HB3 SER 85 HB3 SER 85 21.531 -0.089 -9.442 597 HG SER 85 HG SER 85 23.327 -1.997 -10.505 598 H GLU 86 H GLU 86 20.002 -0.882 -7.961 599 HA GLU 86 HA GLU 86 19.982 -3.462 -6.520 600 HB2 GLU 86 HB2 GLU 86 21.161 -0.869 -5.480 601 HB3 GLU 86 HB3 GLU 86 20.974 -2.349 -4.544 602 HG2 GLU 86 HG2 GLU 86 23.152 -2.632 -5.235 603 HG3 GLU 86 HG3 GLU 86 22.343 -3.390 -6.598 604 HA PRO 87 HA PRO 87 16.033 -1.007 -5.817 605 HB2 PRO 87 HB2 PRO 87 14.263 -3.009 -6.344 606 HB3 PRO 87 HB3 PRO 87 14.946 -1.975 -7.618 607 HG2 PRO 87 HG2 PRO 87 15.755 -4.725 -6.782 608 HG3 PRO 87 HG3 PRO 87 15.551 -4.058 -8.412 609 HD2 PRO 87 HD2 PRO 87 17.998 -4.321 -7.250 610 HD3 PRO 87 HD3 PRO 87 17.625 -3.010 -8.391 611 H ALA 88 H ALA 88 14.646 -1.131 -3.996 612 HA ALA 88 HA ALA 88 14.903 -3.456 -2.220 613 HB1 ALA 88 HB1 ALA 88 15.402 -0.657 -1.198 614 HB2 ALA 88 HB2 ALA 88 16.700 -1.764 -1.650 615 HB3 ALA 88 HB3 ALA 88 15.607 -2.178 -0.330 616 H TYR 89 H TYR 89 13.238 -3.718 -0.770 617 HA TYR 89 HA TYR 89 11.104 -1.743 -0.568 618 HB2 TYR 89 HB2 TYR 89 10.538 -3.033 -2.614 619 HB3 TYR 89 HB3 TYR 89 10.590 -4.522 -1.674 620 HD1 TYR 89 HD1 TYR 89 8.862 -1.227 -1.959 621 HD2 TYR 89 HD2 TYR 89 8.712 -5.222 -0.387 622 HE1 TYR 89 HE1 TYR 89 6.505 -0.871 -1.278 623 HE2 TYR 89 HE2 TYR 89 6.353 -4.866 0.294 624 HH TYR 89 HH TYR 89 4.525 -2.156 -0.766 625 H THR 90 H THR 90 10.121 -1.866 1.423 626 HA THR 90 HA THR 90 10.365 -4.328 2.990 627 HB THR 90 HB THR 90 11.258 -3.113 4.946 628 HG1 THR 90 HG1 THR 90 11.234 -1.038 4.879 629 HG21 THR 90 HG21 THR 90 13.537 -3.012 4.198 630 HG22 THR 90 HG22 THR 90 13.040 -2.695 2.537 631 HG23 THR 90 HG23 THR 90 12.748 -4.276 3.257 632 HA PRO 91 HA PRO 91 6.307 -3.293 4.492 633 HB2 PRO 91 HB2 PRO 91 7.163 -3.924 7.271 634 HB3 PRO 91 HB3 PRO 91 5.874 -4.651 6.294 635 HG2 PRO 91 HG2 PRO 91 8.117 -5.967 6.784 636 HG3 PRO 91 HG3 PRO 91 7.319 -6.072 5.202 637 HD2 PRO 91 HD2 PRO 91 9.741 -4.470 5.989 638 HD3 PRO 91 HD3 PRO 91 9.443 -5.404 4.505 639 HA PRO 92 HA PRO 92 6.278 0.906 6.016 640 HB2 PRO 92 HB2 PRO 92 3.999 0.124 7.795 641 HB3 PRO 92 HB3 PRO 92 4.112 1.462 6.634 642 HG2 PRO 92 HG2 PRO 92 2.698 -0.677 6.044 643 HG3 PRO 92 HG3 PRO 92 3.727 0.083 4.812 644 HD2 PRO 92 HD2 PRO 92 4.225 -2.422 6.400 645 HD3 PRO 92 HD3 PRO 92 4.575 -2.085 4.687 646 HA PRO 93 HA PRO 93 8.677 0.653 9.790 647 HB2 PRO 93 HB2 PRO 93 8.449 3.231 10.749 648 HB3 PRO 93 HB3 PRO 93 9.550 2.738 9.448 649 HG2 PRO 93 HG2 PRO 93 6.869 4.025 9.269 650 HG3 PRO 93 HG3 PRO 93 8.341 4.347 8.336 651 HD2 PRO 93 HD2 PRO 93 6.317 2.886 7.305 652 HD3 PRO 93 HD3 PRO 93 8.015 2.518 6.929 653 H ALA 94 H ALA 94 5.424 2.065 10.006 654 HA ALA 94 HA ALA 94 4.790 0.493 12.309 655 HB1 ALA 94 HB1 ALA 94 4.491 2.279 13.933 656 HB2 ALA 94 HB2 ALA 94 5.051 3.472 12.762 657 HB3 ALA 94 HB3 ALA 94 6.166 2.257 13.382 658 H ALA 95 H ALA 95 2.647 0.462 12.805 659 HA ALA 95 HA ALA 95 0.812 2.312 11.491 660 HB1 ALA 95 HB1 ALA 95 -0.334 -0.226 11.018 661 HB2 ALA 95 HB2 ALA 95 1.351 -0.365 10.514 662 HB3 ALA 95 HB3 ALA 95 0.320 0.886 9.819 663 HA PRO 96 HA PRO 96 -0.090 0.911 15.964 664 HB2 PRO 96 HB2 PRO 96 -0.749 3.823 16.109 665 HB3 PRO 96 HB3 PRO 96 0.096 2.795 17.285 666 HG2 PRO 96 HG2 PRO 96 1.463 4.495 15.824 667 HG3 PRO 96 HG3 PRO 96 2.089 2.855 16.095 668 HD2 PRO 96 HD2 PRO 96 0.726 3.967 13.649 669 HD3 PRO 96 HD3 PRO 96 2.149 2.903 13.758 670 H VAL 97 H VAL 97 -1.895 3.208 13.911 671 HA VAL 97 HA VAL 97 -4.286 1.651 14.004 672 HB VAL 97 HB VAL 97 -4.342 2.604 16.290 673 HG11 VAL 97 HG11 VAL 97 -4.519 5.290 14.899 674 HG12 VAL 97 HG12 VAL 97 -3.103 4.700 15.768 675 HG13 VAL 97 HG13 VAL 97 -4.607 5.000 16.637 676 HG21 VAL 97 HG21 VAL 97 -6.441 2.195 14.909 677 HG22 VAL 97 HG22 VAL 97 -6.454 3.926 14.570 678 HG23 VAL 97 HG23 VAL 97 -6.617 3.351 16.230 679 H PHE 98 H PHE 98 -6.073 2.675 12.823 680 HA PHE 98 HA PHE 98 -5.381 5.014 11.208 681 HB2 PHE 98 HB2 PHE 98 -5.940 3.875 9.097 682 HB3 PHE 98 HB3 PHE 98 -4.552 3.118 9.880 683 HD1 PHE 98 HD1 PHE 98 -8.098 2.736 8.971 684 HD2 PHE 98 HD2 PHE 98 -4.739 0.906 10.924 685 HE1 PHE 98 HE1 PHE 98 -9.285 0.559 8.970 686 HE2 PHE 98 HE2 PHE 98 -5.924 -1.272 10.923 687 HZ PHE 98 HZ PHE 98 -8.198 -1.446 9.945 688 H ASP 99 H ASP 99 -7.238 5.920 10.076 689 HA ASP 99 HA ASP 99 -9.883 4.987 10.328 690 HB2 ASP 99 HB2 ASP 99 -10.673 6.703 12.045 691 HB3 ASP 99 HB3 ASP 99 -9.822 5.298 12.679 692 H ARG 100 H ARG 100 -7.657 7.660 10.024 693 HA ARG 100 HA ARG 100 -9.364 9.679 9.098 694 HB2 ARG 100 HB2 ARG 100 -6.947 9.984 9.668 695 HB3 ARG 100 HB3 ARG 100 -6.524 9.142 8.179 696 HG2 ARG 100 HG2 ARG 100 -7.698 10.853 6.857 697 HG3 ARG 100 HG3 ARG 100 -8.164 11.689 8.338 698 HD2 ARG 100 HD2 ARG 100 -5.788 12.043 8.890 699 HD3 ARG 100 HD3 ARG 100 -5.319 11.205 7.412 700 HE ARG 100 HE ARG 100 -7.070 13.307 6.727 701 HH11 ARG 100 HH11 ARG 100 -3.828 12.857 7.984 702 HH12 ARG 100 HH12 ARG 100 -3.243 14.347 7.324 703 HH21 ARG 100 HH21 ARG 100 -6.267 15.233 5.890 704 HH22 ARG 100 HH22 ARG 100 -4.613 15.682 6.148 705 H ASP 101 H ASP 101 -7.794 7.009 7.388 706 HA ASP 101 HA ASP 101 -8.402 7.669 4.750 707 HB2 ASP 101 HB2 ASP 101 -6.963 5.759 5.606 708 HB3 ASP 101 HB3 ASP 101 -8.453 4.881 5.915 709 H GLU 102 H GLU 102 -10.246 7.770 3.620 710 HA GLU 102 HA GLU 102 -12.653 6.390 4.653 711 HB2 GLU 102 HB2 GLU 102 -12.256 9.275 4.034 712 HB3 GLU 102 HB3 GLU 102 -13.749 8.571 3.427 713 HG2 GLU 102 HG2 GLU 102 -14.426 9.247 5.541 714 HG3 GLU 102 HG3 GLU 102 -13.926 7.593 5.884 715 H VAL 103 H VAL 103 -10.742 5.575 2.611 716 HA VAL 103 HA VAL 103 -12.649 5.203 0.416 717 HB VAL 103 HB VAL 103 -10.910 5.639 -1.298 718 HG11 VAL 103 HG11 VAL 103 -12.561 7.383 -0.559 719 HG12 VAL 103 HG12 VAL 103 -11.058 8.055 -1.195 720 HG13 VAL 103 HG13 VAL 103 -11.336 8.008 0.545 721 HG21 VAL 103 HG21 VAL 103 -8.961 5.279 0.292 722 HG22 VAL 103 HG22 VAL 103 -9.309 6.874 0.966 723 HG23 VAL 103 HG23 VAL 103 -8.826 6.717 -0.723 724 H ALA 104 H ALA 104 -12.373 3.300 -0.761 725 HA ALA 104 HA ALA 104 -10.416 1.388 0.376 726 HB1 ALA 104 HB1 ALA 104 -12.878 0.978 0.879 727 HB2 ALA 104 HB2 ALA 104 -12.013 -0.357 0.119 728 HB3 ALA 104 HB3 ALA 104 -13.081 0.662 -0.844 729 H GLU 105 H GLU 105 -8.957 0.653 -0.999 730 HA GLU 105 HA GLU 105 -9.526 -0.094 -3.699 731 HB2 GLU 105 HB2 GLU 105 -9.355 2.467 -3.790 732 HB3 GLU 105 HB3 GLU 105 -7.645 2.253 -3.426 733 HG2 GLU 105 HG2 GLU 105 -7.644 2.279 -5.768 734 HG3 GLU 105 HG3 GLU 105 -7.697 0.552 -5.425 735 H GLN 106 H GLN 106 -8.083 -1.661 -4.273 736 HA GLN 106 HA GLN 106 -5.408 -1.643 -3.054 737 HB2 GLN 106 HB2 GLN 106 -7.413 -3.898 -2.864 738 HB3 GLN 106 HB3 GLN 106 -5.685 -4.118 -2.584 739 HG2 GLN 106 HG2 GLN 106 -5.711 -2.534 -0.757 740 HG3 GLN 106 HG3 GLN 106 -7.375 -2.081 -1.111 741 HE21 GLN 106 HE21 GLN 106 -6.232 -3.290 1.405 742 HE22 GLN 106 HE22 GLN 106 -7.125 -4.710 1.659 743 H LEU 107 H LEU 107 -6.420 -1.140 -5.803 744 HA LEU 107 HA LEU 107 -5.842 -1.647 -7.987 745 HB2 LEU 107 HB2 LEU 107 -3.558 -1.954 -6.578 746 HB3 LEU 107 HB3 LEU 107 -3.774 -3.619 -7.107 747 HG LEU 107 HG LEU 107 -4.060 -2.628 -9.484 748 HD11 LEU 107 HD11 LEU 107 -4.380 -0.299 -8.874 749 HD12 LEU 107 HD12 LEU 107 -2.877 -0.448 -9.786 750 HD13 LEU 107 HD13 LEU 107 -2.829 -0.276 -8.033 751 HD21 LEU 107 HD21 LEU 107 -2.059 -3.867 -8.784 752 HD22 LEU 107 HD22 LEU 107 -1.400 -2.406 -8.047 753 HD23 LEU 107 HD23 LEU 107 -1.603 -2.497 -9.796 754 H VAL 108 H VAL 108 -5.566 -3.655 -9.520 755 HA VAL 108 HA VAL 108 -7.073 -5.949 -8.444 756 HB VAL 108 HB VAL 108 -8.365 -6.062 -10.539 757 HG11 VAL 108 HG11 VAL 108 -8.736 -3.248 -9.534 758 HG12 VAL 108 HG12 VAL 108 -8.960 -4.591 -8.414 759 HG13 VAL 108 HG13 VAL 108 -9.946 -4.487 -9.874 760 HG21 VAL 108 HG21 VAL 108 -6.917 -3.465 -11.171 761 HG22 VAL 108 HG22 VAL 108 -8.327 -4.050 -12.054 762 HG23 VAL 108 HG23 VAL 108 -6.825 -4.972 -12.082 763 H GLY 109 H GLY 109 -6.840 -7.925 -9.616 764 HA2 GLY 109 HA2 GLY 109 -5.774 -9.368 -11.171 765 HA3 GLY 109 HA3 GLY 109 -4.554 -8.131 -11.450 766 H VAL 110 H VAL 110 -4.405 -7.769 -8.415 767 HA VAL 110 HA VAL 110 -2.123 -9.307 -7.928 768 HB VAL 110 HB VAL 110 -2.397 -8.663 -5.549 769 HG11 VAL 110 HG11 VAL 110 -2.953 -6.515 -7.612 770 HG12 VAL 110 HG12 VAL 110 -1.371 -7.073 -7.069 771 HG13 VAL 110 HG13 VAL 110 -2.424 -6.191 -5.961 772 HG21 VAL 110 HG21 VAL 110 -5.047 -7.523 -6.508 773 HG22 VAL 110 HG22 VAL 110 -4.338 -7.255 -4.915 774 HG23 VAL 110 HG23 VAL 110 -4.851 -8.875 -5.388 775 H SER 111 H SER 111 -5.501 -10.113 -7.449 776 HA SER 111 HA SER 111 -4.801 -12.538 -5.948 777 HB2 SER 111 HB2 SER 111 -6.685 -11.294 -5.078 778 HB3 SER 111 HB3 SER 111 -7.464 -11.287 -6.658 779 HG SER 111 HG SER 111 -8.050 -13.309 -6.384 780 H ALA 112 H ALA 112 -4.462 -14.386 -6.973 781 HA ALA 112 HA ALA 112 -6.101 -15.238 -9.190 782 HB1 ALA 112 HB1 ALA 112 -4.701 -14.154 -10.674 783 HB2 ALA 112 HB2 ALA 112 -3.846 -15.689 -10.515 784 HB3 ALA 112 HB3 ALA 112 -3.303 -14.277 -9.607 785 H ALA 113 H ALA 113 -5.834 -17.468 -9.671 786 HA ALA 113 HA ALA 113 -3.989 -18.972 -7.939 787 HB1 ALA 113 HB1 ALA 113 -6.913 -19.688 -8.249 788 HB2 ALA 113 HB2 ALA 113 -6.249 -18.847 -6.849 789 HB3 ALA 113 HB3 ALA 113 -5.723 -20.489 -7.224 790 H SER 114 H SER 114 -2.714 -19.675 -9.592 791 HA SER 114 HA SER 114 -2.046 -20.812 -11.473 792 HB2 SER 114 HB2 SER 114 -4.409 -22.528 -10.675 793 HB3 SER 114 HB3 SER 114 -3.120 -23.015 -11.770 794 HG SER 114 HG SER 114 -3.170 -23.080 -9.107 795 H ALA 115 H ALA 115 -3.932 -18.603 -11.901 796 HA ALA 115 HA ALA 115 -4.690 -19.245 -14.626 797 HB1 ALA 115 HB1 ALA 115 -6.953 -19.191 -14.422 798 HB2 ALA 115 HB2 ALA 115 -6.913 -17.986 -13.135 799 HB3 ALA 115 HB3 ALA 115 -6.621 -19.685 -12.764 800 H ALA 116 H ALA 116 -5.284 -17.344 -15.838 801 HA ALA 116 HA ALA 116 -4.682 -14.781 -14.547 802 HB1 ALA 116 HB1 ALA 116 -3.446 -15.465 -17.209 803 HB2 ALA 116 HB2 ALA 116 -2.619 -15.827 -15.692 804 HB3 ALA 116 HB3 ALA 116 -3.023 -14.157 -16.102 805 H ALA 117 H ALA 117 -5.590 -16.370 -17.602 806 HA ALA 117 HA ALA 117 -7.903 -14.597 -17.845 807 HB1 ALA 117 HB1 ALA 117 -7.187 -14.367 -20.367 808 HB2 ALA 117 HB2 ALA 117 -5.569 -14.630 -19.719 809 HB3 ALA 117 HB3 ALA 117 -6.530 -13.263 -19.157 810 H SER 118 H SER 118 -9.558 -15.446 -19.135 811 HA SER 118 HA SER 118 -9.251 -18.304 -19.809 812 HB2 SER 118 HB2 SER 118 -11.721 -16.692 -19.137 813 HB3 SER 118 HB3 SER 118 -11.725 -18.391 -19.599 814 HG SER 118 HG SER 118 -10.274 -18.718 -17.793 815 H ALA 119 H ALA 119 -8.585 -15.876 -21.498 816 HA ALA 119 HA ALA 119 -10.519 -15.626 -23.549 817 HB1 ALA 119 HB1 ALA 119 -8.418 -14.155 -22.950 818 HB2 ALA 119 HB2 ALA 119 -8.987 -14.257 -24.616 819 HB3 ALA 119 HB3 ALA 119 -7.605 -15.222 -24.095 820 H PHE 120 H PHE 120 -10.679 -16.601 -25.558 821 HA PHE 120 HA PHE 120 -8.873 -18.854 -26.144 822 HB2 PHE 120 HB2 PHE 120 -11.898 -18.959 -26.207 823 HB3 PHE 120 HB3 PHE 120 -10.844 -20.185 -26.916 824 HD1 PHE 120 HD1 PHE 120 -12.455 -19.061 -23.904 825 HD2 PHE 120 HD2 PHE 120 -9.096 -21.296 -25.384 826 HE1 PHE 120 HE1 PHE 120 -12.219 -20.173 -21.699 827 HE2 PHE 120 HE2 PHE 120 -8.862 -22.405 -23.179 828 HZ PHE 120 HZ PHE 120 -10.424 -21.844 -21.337 829 H GLY 121 H GLY 121 -7.889 -18.151 -27.962 830 HA2 GLY 121 HA2 GLY 121 -7.585 -17.407 -30.110 831 HA3 GLY 121 HA3 GLY 121 -9.216 -17.992 -30.422 832 H SER 122 H SER 122 -9.928 -16.326 -31.683 833 HA SER 122 HA SER 122 -10.922 -13.999 -30.393 834 HB2 SER 122 HB2 SER 122 -8.595 -13.248 -30.538 835 HB3 SER 122 HB3 SER 122 -8.576 -13.593 -32.266 836 HG SER 122 HG SER 122 -9.062 -11.460 -32.095 837 H LEU 123 H LEU 123 -12.872 -14.360 -31.349 838 HA LEU 123 HA LEU 123 -14.479 -14.579 -32.985 839 HB2 LEU 123 HB2 LEU 123 -12.558 -12.603 -34.236 840 HB3 LEU 123 HB3 LEU 123 -14.133 -12.981 -34.926 841 HG LEU 123 HG LEU 123 -13.780 -12.038 -32.067 842 HD11 LEU 123 HD11 LEU 123 -14.588 -9.829 -32.967 843 HD12 LEU 123 HD12 LEU 123 -14.333 -10.458 -34.595 844 HD13 LEU 123 HD13 LEU 123 -12.965 -10.264 -33.501 845 HD21 LEU 123 HD21 LEU 123 -15.900 -13.134 -32.415 846 HD22 LEU 123 HD22 LEU 123 -16.137 -12.317 -33.959 847 HD23 LEU 123 HD23 LEU 123 -16.220 -11.401 -32.455 848 H SER 124 H SER 124 -12.705 -16.706 -32.971 849 HA SER 124 HA SER 124 -12.646 -17.448 -35.823 850 HB2 SER 124 HB2 SER 124 -10.509 -18.629 -35.443 851 HB3 SER 124 HB3 SER 124 -10.351 -16.896 -35.162 852 HG SER 124 HG SER 124 -10.728 -17.402 -32.901 853 H SER 125 H SER 125 -14.598 -17.975 -33.703 854 HA SER 125 HA SER 125 -14.274 -20.872 -33.326 855 HB2 SER 125 HB2 SER 125 -16.037 -18.883 -31.881 856 HB3 SER 125 HB3 SER 125 -16.044 -20.622 -31.593 857 HG SER 125 HG SER 125 -14.368 -20.331 -30.375 858 H ALA 126 H ALA 126 -15.497 -22.162 -34.551 859 HA ALA 126 HA ALA 126 -17.653 -20.940 -36.115 860 HB1 ALA 126 HB1 ALA 126 -16.311 -22.051 -37.629 861 HB2 ALA 126 HB2 ALA 126 -17.468 -23.332 -37.248 862 HB3 ALA 126 HB3 ALA 126 -15.878 -23.318 -36.479 863 H LEU 127 H LEU 127 -19.336 -22.835 -36.725 864 HA LEU 127 HA LEU 127 -21.188 -23.959 -36.050 865 HB2 LEU 127 HB2 LEU 127 -19.182 -25.004 -34.046 866 HB3 LEU 127 HB3 LEU 127 -20.822 -25.637 -34.179 867 HG LEU 127 HG LEU 127 -18.919 -25.495 -36.536 868 HD11 LEU 127 HD11 LEU 127 -18.490 -27.880 -36.153 869 HD12 LEU 127 HD12 LEU 127 -19.514 -27.852 -34.718 870 HD13 LEU 127 HD13 LEU 127 -18.000 -26.948 -34.740 871 HD21 LEU 127 HD21 LEU 127 -21.220 -25.697 -37.230 872 HD22 LEU 127 HD22 LEU 127 -21.551 -26.904 -35.987 873 HD23 LEU 127 HD23 LEU 127 -20.516 -27.310 -37.355 874 H LEU 128 H LEU 128 -21.305 -21.394 -35.326 875 HA LEU 128 HA LEU 128 -22.094 -21.252 -32.499 876 HB2 LEU 128 HB2 LEU 128 -21.296 -19.325 -34.626 877 HB3 LEU 128 HB3 LEU 128 -22.470 -18.739 -33.451 878 HG LEU 128 HG LEU 128 -20.859 -19.592 -31.643 879 HD11 LEU 128 HD11 LEU 128 -19.426 -21.039 -32.880 880 HD12 LEU 128 HD12 LEU 128 -18.439 -19.627 -32.501 881 HD13 LEU 128 HD13 LEU 128 -19.128 -19.814 -34.113 882 HD21 LEU 128 HD21 LEU 128 -19.879 -17.382 -33.479 883 HD22 LEU 128 HD22 LEU 128 -19.488 -17.562 -31.769 884 HD23 LEU 128 HD23 LEU 128 -21.140 -17.192 -32.262 885 H MET 129 H MET 129 -23.680 -22.845 -34.261 886 HA MET 129 HA MET 129 -25.965 -21.454 -35.221 887 HB2 MET 129 HB2 MET 129 -25.537 -24.359 -34.488 888 HB3 MET 129 HB3 MET 129 -27.001 -23.745 -35.257 889 HG2 MET 129 HG2 MET 129 -24.209 -23.436 -36.401 890 HG3 MET 129 HG3 MET 129 -25.353 -24.682 -36.892 891 HE1 MET 129 HE1 MET 129 -28.175 -23.332 -36.966 892 HE2 MET 129 HE2 MET 129 -27.385 -24.444 -38.081 893 HE3 MET 129 HE3 MET 129 -28.139 -22.975 -38.699 894 HA PRO 130 HA PRO 130 -28.184 -20.853 -31.400 895 HB2 PRO 130 HB2 PRO 130 -30.764 -20.767 -32.232 896 HB3 PRO 130 HB3 PRO 130 -29.605 -19.474 -32.599 897 HG2 PRO 130 HG2 PRO 130 -30.523 -21.732 -34.322 898 HG3 PRO 130 HG3 PRO 130 -30.304 -20.022 -34.729 899 HD2 PRO 130 HD2 PRO 130 -28.449 -21.917 -35.357 900 HD3 PRO 130 HD3 PRO 130 -28.011 -20.233 -34.994 901 H LYS 131 H LYS 131 -29.673 -21.851 -29.894 902 HA LYS 131 HA LYS 131 -29.514 -24.683 -29.820 903 HB2 LYS 131 HB2 LYS 131 -31.186 -22.743 -28.205 904 HB3 LYS 131 HB3 LYS 131 -31.031 -24.464 -27.846 905 HG2 LYS 131 HG2 LYS 131 -28.548 -24.159 -27.700 906 HG3 LYS 131 HG3 LYS 131 -28.786 -22.425 -27.912 907 HD2 LYS 131 HD2 LYS 131 -30.116 -24.004 -25.697 908 HD3 LYS 131 HD3 LYS 131 -28.555 -23.210 -25.498 909 HE2 LYS 131 HE2 LYS 131 -29.610 -21.043 -26.126 910 HE3 LYS 131 HE3 LYS 131 -31.172 -21.856 -26.229 911 HZ1 LYS 131 HZ1 LYS 131 -30.956 -20.851 -24.084 912 HZ2 LYS 131 HZ2 LYS 131 -29.454 -21.599 -23.820 913 HZ3 LYS 131 HZ3 LYS 131 -30.872 -22.535 -23.892 914 H ASP 132 H ASP 132 -31.309 -26.198 -29.758 915 HA ASP 132 HA ASP 132 -33.115 -25.803 -31.961 916 HB2 ASP 132 HB2 ASP 132 -32.094 -27.998 -31.458 917 HB3 ASP 132 HB3 ASP 132 -32.980 -28.050 -29.936 918 H GLY 133 H GLY 133 -34.867 -24.608 -31.781 919 HA2 GLY 133 HA2 GLY 133 -37.154 -24.453 -31.012 920 HA3 GLY 133 HA3 GLY 133 -36.601 -24.927 -29.408 921 H LEU 134 H LEU 134 -36.899 -22.325 -31.699 922 HA LEU 134 HA LEU 134 -35.426 -20.320 -30.401 923 HB2 LEU 134 HB2 LEU 134 -37.854 -20.177 -32.195 924 HB3 LEU 134 HB3 LEU 134 -36.980 -18.751 -31.640 925 HG LEU 134 HG LEU 134 -35.622 -21.044 -33.081 926 HD11 LEU 134 HD11 LEU 134 -35.717 -19.589 -35.093 927 HD12 LEU 134 HD12 LEU 134 -36.730 -18.452 -34.205 928 HD13 LEU 134 HD13 LEU 134 -37.326 -20.073 -34.559 929 HD21 LEU 134 HD21 LEU 134 -33.957 -19.174 -33.551 930 HD22 LEU 134 HD22 LEU 134 -34.062 -19.666 -31.863 931 HD23 LEU 134 HD23 LEU 134 -34.858 -18.188 -32.399 932 H GLU 135 H GLU 135 -38.793 -21.377 -29.968 933 HA GLU 135 HA GLU 135 -38.862 -19.877 -27.432 934 HB2 GLU 135 HB2 GLU 135 -41.072 -19.909 -29.505 935 HB3 GLU 135 HB3 GLU 135 -41.207 -19.223 -27.886 936 HG2 GLU 135 HG2 GLU 135 -39.367 -17.653 -28.401 937 HG3 GLU 135 HG3 GLU 135 -39.250 -18.330 -30.025 938 H HIS 136 H HIS 136 -39.923 -20.909 -25.778 939 HA HIS 136 HA HIS 136 -41.653 -23.166 -26.213 940 HB2 HIS 136 HB2 HIS 136 -39.347 -24.125 -26.586 941 HB3 HIS 136 HB3 HIS 136 -38.985 -23.733 -24.905 942 HD2 HIS 136 HD2 HIS 136 -39.617 -25.827 -23.227 943 HE1 HIS 136 HE1 HIS 136 -42.566 -27.667 -25.623 944 HE2 HIS 136 HE2 HIS 136 -41.274 -27.833 -23.444 945 H HIS 137 H HIS 137 -39.355 -22.011 -23.727 946 HA HIS 137 HA HIS 137 -41.557 -22.031 -21.755 947 HB2 HIS 137 HB2 HIS 137 -39.551 -23.442 -21.285 948 HB3 HIS 137 HB3 HIS 137 -38.558 -21.989 -21.307 949 HD2 HIS 137 HD2 HIS 137 -38.366 -20.790 -18.826 950 HE1 HIS 137 HE1 HIS 137 -41.710 -22.627 -17.018 951 HE2 HIS 137 HE2 HIS 137 -39.731 -21.086 -16.621 952 H HIS 138 H HIS 138 -42.490 -20.051 -21.776 953 HA HIS 138 HA HIS 138 -40.783 -17.658 -21.925 954 HB2 HIS 138 HB2 HIS 138 -42.860 -16.427 -22.413 955 HB3 HIS 138 HB3 HIS 138 -42.603 -17.749 -23.546 956 HD2 HIS 138 HD2 HIS 138 -45.266 -16.574 -21.006 957 HE1 HIS 138 HE1 HIS 138 -46.361 -20.477 -22.188 958 HE2 HIS 138 HE2 HIS 138 -47.130 -18.402 -20.942 959 H HIS 139 H HIS 139 -42.519 -19.492 -19.616 960 HA HIS 139 HA HIS 139 -43.376 -17.453 -17.850 961 HB2 HIS 139 HB2 HIS 139 -42.628 -20.339 -17.353 962 HB3 HIS 139 HB3 HIS 139 -43.343 -19.287 -16.133 963 HD2 HIS 139 HD2 HIS 139 -44.513 -21.569 -18.964 964 HE1 HIS 139 HE1 HIS 139 -47.774 -19.033 -18.095 965 HE2 HIS 139 HE2 HIS 139 -47.058 -21.126 -19.341 966 H HIS 140 H HIS 140 -40.330 -19.233 -18.137 967 HA HIS 140 HA HIS 140 -38.266 -18.933 -17.178 968 HB2 HIS 140 HB2 HIS 140 -39.248 -16.069 -16.994 969 HB3 HIS 140 HB3 HIS 140 -37.576 -16.583 -16.782 970 HD2 HIS 140 HD2 HIS 140 -39.861 -15.490 -19.625 971 HE1 HIS 140 HE1 HIS 140 -36.694 -17.599 -21.454 972 HE2 HIS 140 HE2 HIS 140 -38.674 -16.067 -21.879 973 H HIS 141 H HIS 141 -40.337 -19.858 -15.470 974 HA HIS 141 HA HIS 141 -39.446 -18.767 -12.865 975 HB2 HIS 141 HB2 HIS 141 -41.840 -18.221 -13.456 976 HB3 HIS 141 HB3 HIS 141 -42.172 -19.952 -13.440 977 HD2 HIS 141 HD2 HIS 141 -42.945 -20.815 -10.940 978 HE1 HIS 141 HE1 HIS 141 -41.111 -17.780 -8.648 979 HE2 HIS 141 HE2 HIS 141 -42.571 -19.856 -8.541 Start of MODEL 15 1 H1 MET 1 HT1 MET 1 3.372 3.261 -14.077 2 H2 MET 1 HT2 MET 1 2.511 3.329 -12.615 3 H3 MET 1 HT3 MET 1 3.604 4.567 -13.018 4 HA MET 1 HA MET 1 1.014 3.954 -14.318 5 HB2 MET 1 HB2 MET 1 1.218 5.339 -12.130 6 HB3 MET 1 HB3 MET 1 1.954 6.573 -13.151 7 HG2 MET 1 HG2 MET 1 -0.414 7.045 -13.016 8 HG3 MET 1 HG3 MET 1 -0.076 6.449 -14.639 9 HE1 MET 1 HE1 MET 1 -3.603 5.050 -13.971 10 HE2 MET 1 HE2 MET 1 -2.538 5.772 -15.172 11 HE3 MET 1 HE3 MET 1 -2.863 6.629 -13.669 12 H SER 2 H SER 2 0.655 4.805 -16.318 13 HA SER 2 HA SER 2 2.846 5.349 -18.021 14 HB2 SER 2 HB2 SER 2 1.149 5.904 -19.696 15 HB3 SER 2 HB3 SER 2 0.697 4.444 -18.823 16 HG SER 2 HG SER 2 -0.946 6.184 -19.116 17 H ASP 3 H ASP 3 0.608 7.444 -16.276 18 HA ASP 3 HA ASP 3 1.943 9.835 -17.359 19 HB2 ASP 3 HB2 ASP 3 -0.605 9.578 -15.744 20 HB3 ASP 3 HB3 ASP 3 0.044 11.076 -16.407 21 H GLN 4 H GLN 4 2.815 11.408 -16.002 22 HA GLN 4 HA GLN 4 2.984 10.863 -13.132 23 HB2 GLN 4 HB2 GLN 4 5.449 11.045 -13.123 24 HB3 GLN 4 HB3 GLN 4 4.903 9.642 -14.034 25 HG2 GLN 4 HG2 GLN 4 6.516 10.558 -15.464 26 HG3 GLN 4 HG3 GLN 4 5.028 11.252 -16.103 27 HE21 GLN 4 HE21 GLN 4 6.050 13.199 -16.899 28 HE22 GLN 4 HE22 GLN 4 6.685 14.374 -15.851 29 H SER 5 H SER 5 3.700 12.662 -11.887 30 HA SER 5 HA SER 5 4.028 15.225 -13.264 31 HB2 SER 5 HB2 SER 5 1.598 15.006 -12.921 32 HB3 SER 5 HB3 SER 5 1.866 14.727 -11.203 33 HG SER 5 HG SER 5 2.194 17.059 -12.732 34 H GLN 6 H GLN 6 3.524 13.782 -10.046 35 HA GLN 6 HA GLN 6 5.909 15.250 -9.083 36 HB2 GLN 6 HB2 GLN 6 3.389 14.605 -7.523 37 HB3 GLN 6 HB3 GLN 6 4.828 15.387 -6.870 38 HG2 GLN 6 HG2 GLN 6 3.115 16.485 -9.122 39 HG3 GLN 6 HG3 GLN 6 3.059 17.032 -7.449 40 HE21 GLN 6 HE21 GLN 6 4.319 17.898 -10.386 41 HE22 GLN 6 HE22 GLN 6 5.703 18.734 -9.869 42 H GLU 7 H GLU 7 3.801 12.430 -8.546 43 HA GLU 7 HA GLU 7 5.993 10.620 -8.366 44 HB2 GLU 7 HB2 GLU 7 5.956 11.945 -6.123 45 HB3 GLU 7 HB3 GLU 7 4.547 10.955 -5.748 46 HG2 GLU 7 HG2 GLU 7 6.480 9.809 -4.860 47 HG3 GLU 7 HG3 GLU 7 5.934 8.913 -6.275 48 HA PRO 8 HA PRO 8 1.900 8.657 -9.266 49 HB2 PRO 8 HB2 PRO 8 2.695 6.970 -11.226 50 HB3 PRO 8 HB3 PRO 8 2.404 8.696 -11.529 51 HG2 PRO 8 HG2 PRO 8 4.980 7.253 -11.121 52 HG3 PRO 8 HG3 PRO 8 4.573 8.526 -12.284 53 HD2 PRO 8 HD2 PRO 8 5.926 8.998 -9.936 54 HD3 PRO 8 HD3 PRO 8 4.932 10.218 -10.760 55 H THR 9 H THR 9 2.768 7.910 -6.944 56 HA THR 9 HA THR 9 3.948 5.311 -6.765 57 HB THR 9 HB THR 9 3.390 5.457 -4.376 58 HG1 THR 9 HG1 THR 9 1.927 7.714 -5.249 59 HG21 THR 9 HG21 THR 9 4.826 7.245 -3.851 60 HG22 THR 9 HG22 THR 9 4.268 8.213 -5.215 61 HG23 THR 9 HG23 THR 9 5.306 6.812 -5.491 62 H MET 10 H MET 10 2.895 3.514 -5.615 63 HA MET 10 HA MET 10 0.752 2.443 -7.007 64 HB2 MET 10 HB2 MET 10 0.672 0.741 -5.230 65 HB3 MET 10 HB3 MET 10 2.329 1.096 -5.709 66 HG2 MET 10 HG2 MET 10 2.491 2.681 -3.763 67 HG3 MET 10 HG3 MET 10 0.891 2.145 -3.249 68 HE1 MET 10 HE1 MET 10 3.610 1.851 -1.338 69 HE2 MET 10 HE2 MET 10 2.904 0.430 -0.574 70 HE3 MET 10 HE3 MET 10 1.864 1.764 -1.068 71 H GLU 11 H GLU 11 0.655 4.727 -4.431 72 HA GLU 11 HA GLU 11 -2.006 4.139 -3.482 73 HB2 GLU 11 HB2 GLU 11 -0.267 6.609 -3.275 74 HB3 GLU 11 HB3 GLU 11 -1.867 6.487 -2.541 75 HG2 GLU 11 HG2 GLU 11 -1.176 4.624 -1.171 76 HG3 GLU 11 HG3 GLU 11 0.362 4.505 -2.016 77 H GLU 12 H GLU 12 -0.614 6.610 -5.583 78 HA GLU 12 HA GLU 12 -3.036 7.764 -6.436 79 HB2 GLU 12 HB2 GLU 12 -0.284 7.728 -7.684 80 HB3 GLU 12 HB3 GLU 12 -1.632 8.667 -8.333 81 HG2 GLU 12 HG2 GLU 12 -1.863 9.856 -6.198 82 HG3 GLU 12 HG3 GLU 12 -0.571 8.890 -5.499 83 H ILE 13 H ILE 13 -1.153 5.068 -7.725 84 HA ILE 13 HA ILE 13 -2.475 4.822 -10.210 85 HB ILE 13 HB ILE 13 -1.055 2.751 -8.502 86 HG12 ILE 13 HG12 ILE 13 -0.146 4.156 -11.031 87 HG13 ILE 13 HG13 ILE 13 0.190 4.795 -9.423 88 HG21 ILE 13 HG21 ILE 13 -2.479 1.511 -10.017 89 HG22 ILE 13 HG22 ILE 13 -0.865 1.511 -10.727 90 HG23 ILE 13 HG23 ILE 13 -2.104 2.600 -11.353 91 HD11 ILE 13 HD11 ILE 13 1.995 3.299 -10.539 92 HD12 ILE 13 HD12 ILE 13 0.923 1.954 -10.145 93 HD13 ILE 13 HD13 ILE 13 1.576 2.968 -8.858 94 H LEU 14 H LEU 14 -3.116 3.151 -7.088 95 HA LEU 14 HA LEU 14 -5.342 1.662 -7.981 96 HB2 LEU 14 HB2 LEU 14 -4.040 1.231 -5.913 97 HB3 LEU 14 HB3 LEU 14 -4.756 2.666 -5.188 98 HG LEU 14 HG LEU 14 -6.576 0.551 -6.343 99 HD11 LEU 14 HD11 LEU 14 -5.458 0.448 -3.532 100 HD12 LEU 14 HD12 LEU 14 -4.871 -0.564 -4.851 101 HD13 LEU 14 HD13 LEU 14 -6.539 -0.716 -4.299 102 HD21 LEU 14 HD21 LEU 14 -7.860 1.369 -4.182 103 HD22 LEU 14 HD22 LEU 14 -7.818 2.407 -5.601 104 HD23 LEU 14 HD23 LEU 14 -6.735 2.724 -4.252 105 H ALA 15 H ALA 15 -5.070 4.868 -6.541 106 HA ALA 15 HA ALA 15 -7.870 5.356 -6.232 107 HB1 ALA 15 HB1 ALA 15 -5.884 6.673 -5.224 108 HB2 ALA 15 HB2 ALA 15 -7.287 7.592 -5.769 109 HB3 ALA 15 HB3 ALA 15 -5.839 7.515 -6.773 110 H SER 16 H SER 16 -5.541 6.312 -8.657 111 HA SER 16 HA SER 16 -7.006 7.764 -10.417 112 HB2 SER 16 HB2 SER 16 -4.629 7.322 -10.761 113 HB3 SER 16 HB3 SER 16 -4.984 5.652 -11.195 114 HG SER 16 HG SER 16 -5.678 8.036 -12.557 115 H ILE 17 H ILE 17 -6.832 4.156 -10.566 116 HA ILE 17 HA ILE 17 -8.714 3.968 -12.712 117 HB ILE 17 HB ILE 17 -7.881 1.942 -10.601 118 HG12 ILE 17 HG12 ILE 17 -7.092 2.116 -13.525 119 HG13 ILE 17 HG13 ILE 17 -6.155 2.889 -12.248 120 HG21 ILE 17 HG21 ILE 17 -9.376 1.516 -13.219 121 HG22 ILE 17 HG22 ILE 17 -10.090 1.375 -11.611 122 HG23 ILE 17 HG23 ILE 17 -8.835 0.245 -12.121 123 HD11 ILE 17 HD11 ILE 17 -5.843 0.710 -11.141 124 HD12 ILE 17 HD12 ILE 17 -5.246 0.653 -12.801 125 HD13 ILE 17 HD13 ILE 17 -6.801 -0.072 -12.396 126 H ARG 18 H ARG 18 -8.981 3.513 -9.237 127 HA ARG 18 HA ARG 18 -11.859 3.298 -9.262 128 HB2 ARG 18 HB2 ARG 18 -9.841 3.410 -7.021 129 HB3 ARG 18 HB3 ARG 18 -11.577 3.235 -6.752 130 HG2 ARG 18 HG2 ARG 18 -11.593 1.200 -8.149 131 HG3 ARG 18 HG3 ARG 18 -9.858 1.371 -8.417 132 HD2 ARG 18 HD2 ARG 18 -9.465 1.168 -5.987 133 HD3 ARG 18 HD3 ARG 18 -11.196 0.990 -5.722 134 HE ARG 18 HE ARG 18 -9.383 -1.024 -6.777 135 HH11 ARG 18 HH11 ARG 18 -12.722 -0.014 -6.432 136 HH12 ARG 18 HH12 ARG 18 -13.349 -1.610 -6.680 137 HH21 ARG 18 HH21 ARG 18 -10.242 -3.077 -7.099 138 HH22 ARG 18 HH22 ARG 18 -11.955 -3.329 -7.056 139 H ARG 19 H ARG 19 -10.543 5.964 -10.073 140 HA ARG 19 HA ARG 19 -12.331 7.631 -8.425 141 HB2 ARG 19 HB2 ARG 19 -9.977 7.851 -7.574 142 HB3 ARG 19 HB3 ARG 19 -9.516 8.474 -9.158 143 HG2 ARG 19 HG2 ARG 19 -11.250 10.272 -8.887 144 HG3 ARG 19 HG3 ARG 19 -11.526 9.697 -7.244 145 HD2 ARG 19 HD2 ARG 19 -9.959 11.526 -7.116 146 HD3 ARG 19 HD3 ARG 19 -9.070 10.039 -6.796 147 HE ARG 19 HE ARG 19 -7.898 10.355 -8.782 148 HH11 ARG 19 HH11 ARG 19 -10.647 12.531 -8.694 149 HH12 ARG 19 HH12 ARG 19 -10.136 13.416 -10.093 150 HH21 ARG 19 HH21 ARG 19 -7.275 11.533 -10.593 151 HH22 ARG 19 HH22 ARG 19 -8.241 12.854 -11.158 152 H ILE 20 H ILE 20 -13.567 8.939 -9.591 153 HA ILE 20 HA ILE 20 -12.719 9.694 -12.314 154 HB ILE 20 HB ILE 20 -15.029 9.314 -13.134 155 HG12 ILE 20 HG12 ILE 20 -15.486 7.828 -10.525 156 HG13 ILE 20 HG13 ILE 20 -16.061 9.471 -10.796 157 HG21 ILE 20 HG21 ILE 20 -13.680 6.894 -11.890 158 HG22 ILE 20 HG22 ILE 20 -13.295 7.601 -13.459 159 HG23 ILE 20 HG23 ILE 20 -14.863 6.840 -13.196 160 HD11 ILE 20 HD11 ILE 20 -17.245 8.595 -12.870 161 HD12 ILE 20 HD12 ILE 20 -17.887 8.008 -11.335 162 HD13 ILE 20 HD13 ILE 20 -16.850 6.969 -12.311 163 H ILE 21 H ILE 21 -13.564 11.661 -13.082 164 HA ILE 21 HA ILE 21 -13.854 13.693 -11.140 165 HB ILE 21 HB ILE 21 -14.402 13.683 -14.127 166 HG12 ILE 21 HG12 ILE 21 -12.085 14.872 -12.575 167 HG13 ILE 21 HG13 ILE 21 -12.052 13.230 -13.211 168 HG21 ILE 21 HG21 ILE 21 -15.638 15.545 -13.103 169 HG22 ILE 21 HG22 ILE 21 -14.220 16.176 -13.936 170 HG23 ILE 21 HG23 ILE 21 -14.209 16.016 -12.180 171 HD11 ILE 21 HD11 ILE 21 -12.579 14.215 -15.493 172 HD12 ILE 21 HD12 ILE 21 -10.989 14.632 -14.853 173 HD13 ILE 21 HD13 ILE 21 -12.302 15.806 -14.785 174 H SER 22 H SER 22 -16.248 12.113 -13.262 175 HA SER 22 HA SER 22 -18.354 12.531 -11.339 176 HB2 SER 22 HB2 SER 22 -19.762 13.977 -12.678 177 HB3 SER 22 HB3 SER 22 -18.210 14.768 -12.417 178 HG SER 22 HG SER 22 -19.065 13.335 -14.717 179 H GLU 23 H GLU 23 -20.471 11.744 -12.138 180 HA GLU 23 HA GLU 23 -20.441 10.006 -14.474 181 HB2 GLU 23 HB2 GLU 23 -19.502 8.644 -12.563 182 HB3 GLU 23 HB3 GLU 23 -21.051 8.844 -11.748 183 HG2 GLU 23 HG2 GLU 23 -22.198 7.798 -13.667 184 HG3 GLU 23 HG3 GLU 23 -20.652 7.597 -14.484 185 H ASP 24 H ASP 24 -22.420 10.001 -15.411 186 HA ASP 24 HA ASP 24 -24.851 10.288 -13.866 187 HB2 ASP 24 HB2 ASP 24 -23.811 12.654 -14.341 188 HB3 ASP 24 HB3 ASP 24 -24.422 12.373 -15.974 189 H ASP 25 H ASP 25 -26.779 10.390 -15.408 190 HA ASP 25 HA ASP 25 -26.345 8.402 -17.482 191 HB2 ASP 25 HB2 ASP 25 -28.257 8.227 -15.884 192 HB3 ASP 25 HB3 ASP 25 -28.935 9.692 -16.593 193 H ALA 26 H ALA 26 -25.018 9.999 -18.687 194 HA ALA 26 HA ALA 26 -25.965 12.326 -19.855 195 HB1 ALA 26 HB1 ALA 26 -23.649 11.840 -20.048 196 HB2 ALA 26 HB2 ALA 26 -24.279 11.794 -21.696 197 HB3 ALA 26 HB3 ALA 26 -23.964 10.291 -20.829 198 HA PRO 27 HA PRO 27 -29.030 10.817 -22.752 199 HB2 PRO 27 HB2 PRO 27 -29.279 12.932 -24.425 200 HB3 PRO 27 HB3 PRO 27 -29.862 12.977 -22.747 201 HG2 PRO 27 HG2 PRO 27 -27.336 14.072 -23.901 202 HG3 PRO 27 HG3 PRO 27 -28.462 14.812 -22.749 203 HD2 PRO 27 HD2 PRO 27 -26.136 13.618 -21.965 204 HD3 PRO 27 HD3 PRO 27 -27.586 13.664 -20.940 205 H ALA 28 H ALA 28 -29.403 10.457 -25.109 206 HA ALA 28 HA ALA 28 -28.798 9.633 -27.147 207 HB1 ALA 28 HB1 ALA 28 -26.782 11.739 -26.656 208 HB2 ALA 28 HB2 ALA 28 -27.796 11.449 -28.066 209 HB3 ALA 28 HB3 ALA 28 -26.317 10.518 -27.841 210 H GLU 29 H GLU 29 -28.724 7.674 -25.704 211 HA GLU 29 HA GLU 29 -26.188 6.297 -26.175 212 HB2 GLU 29 HB2 GLU 29 -26.307 5.236 -23.902 213 HB3 GLU 29 HB3 GLU 29 -25.960 6.963 -23.854 214 HG2 GLU 29 HG2 GLU 29 -28.348 7.423 -23.382 215 HG3 GLU 29 HG3 GLU 29 -28.688 5.696 -23.408 216 HA PRO 30 HA PRO 30 -30.271 4.121 -27.322 217 HB2 PRO 30 HB2 PRO 30 -28.753 3.723 -29.856 218 HB3 PRO 30 HB3 PRO 30 -30.462 4.140 -29.625 219 HG2 PRO 30 HG2 PRO 30 -28.749 5.959 -30.446 220 HG3 PRO 30 HG3 PRO 30 -29.985 6.372 -29.243 221 HD2 PRO 30 HD2 PRO 30 -27.062 5.799 -28.814 222 HD3 PRO 30 HD3 PRO 30 -28.083 7.061 -28.092 223 H ALA 31 H ALA 31 -30.565 1.861 -27.389 224 HA ALA 31 HA ALA 31 -28.370 0.054 -27.842 225 HB1 ALA 31 HB1 ALA 31 -27.655 0.394 -25.656 226 HB2 ALA 31 HB2 ALA 31 -28.778 -0.948 -25.446 227 HB3 ALA 31 HB3 ALA 31 -29.287 0.696 -25.060 228 H ALA 32 H ALA 32 -29.135 -1.896 -28.482 229 HA ALA 32 HA ALA 32 -31.684 -2.926 -27.621 230 HB1 ALA 32 HB1 ALA 32 -31.517 -2.430 -30.572 231 HB2 ALA 32 HB2 ALA 32 -32.094 -1.150 -29.504 232 HB3 ALA 32 HB3 ALA 32 -32.939 -2.696 -29.563 233 H GLU 33 H GLU 33 -32.024 -5.085 -28.238 234 HA GLU 33 HA GLU 33 -31.284 -7.245 -28.574 235 HB2 GLU 33 HB2 GLU 33 -30.239 -5.888 -31.075 236 HB3 GLU 33 HB3 GLU 33 -30.371 -7.635 -30.864 237 HG2 GLU 33 HG2 GLU 33 -32.801 -7.413 -30.505 238 HG3 GLU 33 HG3 GLU 33 -32.672 -5.666 -30.706 239 H ALA 34 H ALA 34 -29.709 -6.161 -26.735 240 HA ALA 34 HA ALA 34 -26.975 -5.878 -27.232 241 HB1 ALA 34 HB1 ALA 34 -26.657 -6.026 -24.916 242 HB2 ALA 34 HB2 ALA 34 -27.979 -7.180 -24.714 243 HB3 ALA 34 HB3 ALA 34 -28.330 -5.483 -25.048 244 H ALA 35 H ALA 35 -25.461 -7.194 -27.849 245 HA ALA 35 HA ALA 35 -25.432 -10.004 -27.127 246 HB1 ALA 35 HB1 ALA 35 -25.172 -9.755 -30.034 247 HB2 ALA 35 HB2 ALA 35 -26.771 -9.294 -29.448 248 HB3 ALA 35 HB3 ALA 35 -26.123 -10.892 -29.081 249 HA PRO 36 HA PRO 36 -21.024 -9.582 -27.410 250 HB2 PRO 36 HB2 PRO 36 -20.894 -11.835 -29.376 251 HB3 PRO 36 HB3 PRO 36 -20.034 -11.630 -27.836 252 HG2 PRO 36 HG2 PRO 36 -22.045 -13.318 -28.012 253 HG3 PRO 36 HG3 PRO 36 -21.864 -12.288 -26.579 254 HD2 PRO 36 HD2 PRO 36 -23.760 -11.976 -28.892 255 HD3 PRO 36 HD3 PRO 36 -24.047 -11.708 -27.157 256 HA PRO 37 HA PRO 37 -20.440 -7.172 -31.170 257 HB2 PRO 37 HB2 PRO 37 -17.792 -6.578 -31.024 258 HB3 PRO 37 HB3 PRO 37 -18.998 -5.833 -29.954 259 HG2 PRO 37 HG2 PRO 37 -17.148 -8.112 -29.418 260 HG3 PRO 37 HG3 PRO 37 -17.557 -6.727 -28.388 261 HD2 PRO 37 HD2 PRO 37 -18.689 -9.180 -28.050 262 HD3 PRO 37 HD3 PRO 37 -19.554 -7.671 -27.678 263 HA PRO 38 HA PRO 38 -19.054 -9.884 -34.428 264 HB2 PRO 38 HB2 PRO 38 -17.583 -7.593 -35.653 265 HB3 PRO 38 HB3 PRO 38 -18.821 -8.645 -36.365 266 HG2 PRO 38 HG2 PRO 38 -19.409 -6.167 -35.673 267 HG3 PRO 38 HG3 PRO 38 -20.560 -7.484 -35.377 268 HD2 PRO 38 HD2 PRO 38 -18.739 -6.098 -33.424 269 HD3 PRO 38 HD3 PRO 38 -20.423 -6.638 -33.210 270 HA PRO 39 HA PRO 39 -14.977 -11.330 -33.306 271 HB2 PRO 39 HB2 PRO 39 -14.557 -11.918 -36.213 272 HB3 PRO 39 HB3 PRO 39 -14.347 -12.984 -34.809 273 HG2 PRO 39 HG2 PRO 39 -16.445 -13.265 -36.372 274 HG3 PRO 39 HG3 PRO 39 -16.621 -13.385 -34.609 275 HD2 PRO 39 HD2 PRO 39 -17.354 -11.105 -36.427 276 HD3 PRO 39 HD3 PRO 39 -18.215 -11.731 -35.001 277 HA PRO 40 HA PRO 40 -12.365 -7.803 -34.194 278 HB2 PRO 40 HB2 PRO 40 -9.864 -8.813 -33.663 279 HB3 PRO 40 HB3 PRO 40 -11.018 -8.328 -32.407 280 HG2 PRO 40 HG2 PRO 40 -10.416 -11.049 -33.468 281 HG3 PRO 40 HG3 PRO 40 -10.662 -10.520 -31.794 282 HD2 PRO 40 HD2 PRO 40 -12.621 -11.765 -33.175 283 HD3 PRO 40 HD3 PRO 40 -12.985 -10.477 -32.002 284 H GLU 41 H GLU 41 -11.110 -6.935 -35.823 285 HA GLU 41 HA GLU 41 -11.032 -8.339 -38.302 286 HB2 GLU 41 HB2 GLU 41 -9.918 -5.666 -37.434 287 HB3 GLU 41 HB3 GLU 41 -9.782 -6.277 -39.083 288 HG2 GLU 41 HG2 GLU 41 -11.741 -4.887 -39.022 289 HG3 GLU 41 HG3 GLU 41 -12.298 -6.554 -39.086 290 HA PRO 42 HA PRO 42 -7.097 -10.377 -38.381 291 HB2 PRO 42 HB2 PRO 42 -6.405 -8.684 -40.762 292 HB3 PRO 42 HB3 PRO 42 -6.267 -10.442 -40.554 293 HG2 PRO 42 HG2 PRO 42 -8.239 -9.461 -41.975 294 HG3 PRO 42 HG3 PRO 42 -8.549 -10.780 -40.830 295 HD2 PRO 42 HD2 PRO 42 -9.186 -7.856 -40.551 296 HD3 PRO 42 HD3 PRO 42 -10.132 -9.272 -40.034 297 H GLU 43 H GLU 43 -7.002 -6.881 -38.952 298 HA GLU 43 HA GLU 43 -4.363 -6.687 -37.677 299 HB2 GLU 43 HB2 GLU 43 -6.019 -4.609 -39.128 300 HB3 GLU 43 HB3 GLU 43 -4.415 -4.331 -38.454 301 HG2 GLU 43 HG2 GLU 43 -3.490 -6.091 -39.917 302 HG3 GLU 43 HG3 GLU 43 -5.093 -6.371 -40.594 303 HA PRO 44 HA PRO 44 -6.655 -5.704 -33.843 304 HB2 PRO 44 HB2 PRO 44 -3.979 -4.716 -32.960 305 HB3 PRO 44 HB3 PRO 44 -5.089 -5.844 -32.154 306 HG2 PRO 44 HG2 PRO 44 -2.900 -6.739 -33.316 307 HG3 PRO 44 HG3 PRO 44 -4.428 -7.633 -33.465 308 HD2 PRO 44 HD2 PRO 44 -3.090 -5.842 -35.482 309 HD3 PRO 44 HD3 PRO 44 -3.912 -7.401 -35.731 310 H GLU 45 H GLU 45 -7.548 -3.837 -32.977 311 HA GLU 45 HA GLU 45 -7.556 -1.488 -34.482 312 HB2 GLU 45 HB2 GLU 45 -8.344 -2.001 -31.611 313 HB3 GLU 45 HB3 GLU 45 -8.607 -0.458 -32.418 314 HG2 GLU 45 HG2 GLU 45 -9.662 -3.129 -33.395 315 HG3 GLU 45 HG3 GLU 45 -10.612 -1.934 -32.519 316 HA PRO 46 HA PRO 46 -4.467 0.556 -31.418 317 HB2 PRO 46 HB2 PRO 46 -3.041 -0.914 -29.667 318 HB3 PRO 46 HB3 PRO 46 -4.696 -0.380 -29.292 319 HG2 PRO 46 HG2 PRO 46 -3.757 -3.016 -30.341 320 HG3 PRO 46 HG3 PRO 46 -4.869 -2.681 -28.995 321 HD2 PRO 46 HD2 PRO 46 -5.769 -3.347 -31.462 322 HD3 PRO 46 HD3 PRO 46 -6.657 -2.218 -30.417 323 H VAL 47 H VAL 47 -2.267 1.012 -31.855 324 HA VAL 47 HA VAL 47 -1.131 -0.340 -34.071 325 HB VAL 47 HB VAL 47 0.050 1.692 -32.150 326 HG11 VAL 47 HG11 VAL 47 1.136 0.553 -34.739 327 HG12 VAL 47 HG12 VAL 47 1.934 0.619 -33.169 328 HG13 VAL 47 HG13 VAL 47 1.672 2.102 -34.086 329 HG21 VAL 47 HG21 VAL 47 -1.828 2.575 -33.389 330 HG22 VAL 47 HG22 VAL 47 -1.213 1.900 -34.898 331 HG23 VAL 47 HG23 VAL 47 -0.355 3.222 -34.109 332 H SER 48 H SER 48 -0.353 -0.324 -30.604 333 HA SER 48 HA SER 48 0.585 -3.016 -30.638 334 HB2 SER 48 HB2 SER 48 2.541 -1.972 -31.706 335 HB3 SER 48 HB3 SER 48 2.688 -0.854 -30.352 336 HG SER 48 HG SER 48 3.812 -2.372 -29.446 337 H PHE 49 H PHE 49 1.356 0.009 -28.890 338 HA PHE 49 HA PHE 49 0.114 -1.114 -26.469 339 HB2 PHE 49 HB2 PHE 49 2.564 -1.550 -26.380 340 HB3 PHE 49 HB3 PHE 49 2.854 0.181 -26.543 341 HD1 PHE 49 HD1 PHE 49 1.180 -2.370 -24.386 342 HD2 PHE 49 HD2 PHE 49 2.794 1.602 -24.644 343 HE1 PHE 49 HE1 PHE 49 0.922 -2.107 -21.934 344 HE2 PHE 49 HE2 PHE 49 2.537 1.865 -22.194 345 HZ PHE 49 HZ PHE 49 1.601 0.011 -20.838 346 H ASP 50 H ASP 50 -1.563 0.280 -26.357 347 HA ASP 50 HA ASP 50 -0.963 3.181 -26.334 348 HB2 ASP 50 HB2 ASP 50 -2.385 2.525 -28.231 349 HB3 ASP 50 HB3 ASP 50 -3.533 1.787 -27.120 350 H ASP 51 H ASP 51 -0.854 3.799 -24.254 351 HA ASP 51 HA ASP 51 -2.086 2.505 -22.075 352 HB2 ASP 51 HB2 ASP 51 -0.998 5.305 -22.401 353 HB3 ASP 51 HB3 ASP 51 -1.589 4.677 -20.867 354 H GLU 52 H GLU 52 -3.968 2.828 -20.989 355 HA GLU 52 HA GLU 52 -5.706 5.047 -21.355 356 HB2 GLU 52 HB2 GLU 52 -5.988 3.759 -23.548 357 HB3 GLU 52 HB3 GLU 52 -6.716 2.475 -22.583 358 HG2 GLU 52 HG2 GLU 52 -8.397 4.063 -21.733 359 HG3 GLU 52 HG3 GLU 52 -7.671 5.350 -22.690 360 H VAL 53 H VAL 53 -5.950 5.080 -19.173 361 HA VAL 53 HA VAL 53 -6.327 2.750 -17.591 362 HB VAL 53 HB VAL 53 -5.297 4.834 -16.740 363 HG11 VAL 53 HG11 VAL 53 -6.601 6.796 -16.268 364 HG12 VAL 53 HG12 VAL 53 -8.101 5.978 -16.707 365 HG13 VAL 53 HG13 VAL 53 -6.910 6.369 -17.949 366 HG21 VAL 53 HG21 VAL 53 -6.375 3.153 -15.210 367 HG22 VAL 53 HG22 VAL 53 -7.836 4.141 -15.232 368 HG23 VAL 53 HG23 VAL 53 -6.342 4.789 -14.553 369 H LEU 54 H LEU 54 -8.521 4.995 -19.156 370 HA LEU 54 HA LEU 54 -10.873 4.385 -17.737 371 HB2 LEU 54 HB2 LEU 54 -10.421 5.364 -20.560 372 HB3 LEU 54 HB3 LEU 54 -12.022 5.204 -19.841 373 HG LEU 54 HG LEU 54 -9.806 6.817 -18.551 374 HD11 LEU 54 HD11 LEU 54 -10.906 8.806 -19.501 375 HD12 LEU 54 HD12 LEU 54 -12.054 7.775 -20.352 376 HD13 LEU 54 HD13 LEU 54 -10.345 7.741 -20.788 377 HD21 LEU 54 HD21 LEU 54 -12.809 6.607 -18.171 378 HD22 LEU 54 HD22 LEU 54 -11.843 7.905 -17.471 379 HD23 LEU 54 HD23 LEU 54 -11.549 6.233 -16.993 380 H GLU 55 H GLU 55 -9.412 2.910 -20.594 381 HA GLU 55 HA GLU 55 -9.905 1.005 -21.790 382 HB2 GLU 55 HB2 GLU 55 -10.714 0.077 -19.020 383 HB3 GLU 55 HB3 GLU 55 -10.408 -0.981 -20.397 384 HG2 GLU 55 HG2 GLU 55 -8.092 -0.106 -20.538 385 HG3 GLU 55 HG3 GLU 55 -8.402 0.910 -19.132 386 H LEU 56 H LEU 56 -12.009 3.010 -21.667 387 HA LEU 56 HA LEU 56 -14.405 1.294 -21.969 388 HB2 LEU 56 HB2 LEU 56 -14.124 4.137 -21.000 389 HB3 LEU 56 HB3 LEU 56 -15.662 3.507 -21.587 390 HG LEU 56 HG LEU 56 -14.064 2.115 -19.427 391 HD11 LEU 56 HD11 LEU 56 -16.362 4.058 -19.058 392 HD12 LEU 56 HD12 LEU 56 -14.671 4.450 -18.743 393 HD13 LEU 56 HD13 LEU 56 -15.482 3.213 -17.784 394 HD21 LEU 56 HD21 LEU 56 -16.916 1.963 -20.436 395 HD22 LEU 56 HD22 LEU 56 -16.405 1.238 -18.912 396 HD23 LEU 56 HD23 LEU 56 -15.706 0.679 -20.432 397 H THR 57 H THR 57 -12.373 1.822 -24.016 398 HA THR 57 HA THR 57 -14.021 3.318 -25.970 399 HB THR 57 HB THR 57 -11.889 3.737 -27.195 400 HG1 THR 57 HG1 THR 57 -10.302 2.528 -26.590 401 HG21 THR 57 HG21 THR 57 -12.792 5.436 -25.672 402 HG22 THR 57 HG22 THR 57 -11.031 5.433 -25.612 403 HG23 THR 57 HG23 THR 57 -11.957 4.680 -24.315 404 H ASP 58 H ASP 58 -11.422 0.856 -25.936 405 HA ASP 58 HA ASP 58 -12.675 -0.501 -28.202 406 HB2 ASP 58 HB2 ASP 58 -10.621 -1.817 -28.291 407 HB3 ASP 58 HB3 ASP 58 -10.231 -0.104 -28.231 408 HA PRO 59 HA PRO 59 -14.606 -3.685 -25.789 409 HB2 PRO 59 HB2 PRO 59 -13.356 -5.758 -27.534 410 HB3 PRO 59 HB3 PRO 59 -15.072 -5.464 -27.181 411 HG2 PRO 59 HG2 PRO 59 -14.056 -4.815 -29.530 412 HG3 PRO 59 HG3 PRO 59 -15.230 -3.753 -28.729 413 HD2 PRO 59 HD2 PRO 59 -12.241 -3.452 -28.909 414 HD3 PRO 59 HD3 PRO 59 -13.509 -2.212 -29.072 415 H ILE 60 H ILE 60 -14.147 -4.943 -24.004 416 HA ILE 60 HA ILE 60 -11.290 -5.498 -23.479 417 HB ILE 60 HB ILE 60 -11.899 -5.485 -21.077 418 HG12 ILE 60 HG12 ILE 60 -14.608 -4.441 -21.969 419 HG13 ILE 60 HG13 ILE 60 -14.342 -6.128 -21.534 420 HG21 ILE 60 HG21 ILE 60 -12.442 -3.004 -20.996 421 HG22 ILE 60 HG22 ILE 60 -12.617 -3.062 -22.750 422 HG23 ILE 60 HG23 ILE 60 -11.061 -3.434 -22.004 423 HD11 ILE 60 HD11 ILE 60 -13.801 -5.579 -19.289 424 HD12 ILE 60 HD12 ILE 60 -15.194 -4.567 -19.671 425 HD13 ILE 60 HD13 ILE 60 -13.571 -3.875 -19.674 426 H ALA 61 H ALA 61 -14.467 -6.945 -23.664 427 HA ALA 61 HA ALA 61 -13.282 -9.602 -23.605 428 HB1 ALA 61 HB1 ALA 61 -13.695 -9.461 -21.279 429 HB2 ALA 61 HB2 ALA 61 -15.083 -10.335 -21.924 430 HB3 ALA 61 HB3 ALA 61 -15.228 -8.625 -21.519 431 HA PRO 62 HA PRO 62 -16.369 -10.460 -26.687 432 HB2 PRO 62 HB2 PRO 62 -17.052 -12.945 -25.161 433 HB3 PRO 62 HB3 PRO 62 -16.632 -12.755 -26.876 434 HG2 PRO 62 HG2 PRO 62 -14.864 -13.747 -25.210 435 HG3 PRO 62 HG3 PRO 62 -14.360 -12.557 -26.427 436 HD2 PRO 62 HD2 PRO 62 -14.850 -12.147 -23.486 437 HD3 PRO 62 HD3 PRO 62 -13.554 -11.488 -24.513 438 H GLU 63 H GLU 63 -17.393 -11.151 -23.352 439 HA GLU 63 HA GLU 63 -19.760 -9.520 -23.665 440 HB2 GLU 63 HB2 GLU 63 -20.417 -11.774 -24.593 441 HB3 GLU 63 HB3 GLU 63 -20.139 -12.444 -22.985 442 HG2 GLU 63 HG2 GLU 63 -21.790 -10.872 -22.041 443 HG3 GLU 63 HG3 GLU 63 -22.072 -10.202 -23.647 444 HA PRO 64 HA PRO 64 -17.907 -9.756 -19.361 445 HB2 PRO 64 HB2 PRO 64 -17.632 -7.083 -18.930 446 HB3 PRO 64 HB3 PRO 64 -16.401 -8.049 -19.768 447 HG2 PRO 64 HG2 PRO 64 -18.508 -6.272 -20.907 448 HG3 PRO 64 HG3 PRO 64 -16.806 -6.447 -21.372 449 HD2 PRO 64 HD2 PRO 64 -18.835 -7.640 -22.755 450 HD3 PRO 64 HD3 PRO 64 -17.205 -8.338 -22.646 451 H GLU 65 H GLU 65 -19.127 -9.715 -17.536 452 HA GLU 65 HA GLU 65 -21.902 -9.189 -17.659 453 HB2 GLU 65 HB2 GLU 65 -20.034 -9.624 -15.321 454 HB3 GLU 65 HB3 GLU 65 -21.779 -9.469 -15.146 455 HG2 GLU 65 HG2 GLU 65 -20.371 -11.546 -16.854 456 HG3 GLU 65 HG3 GLU 65 -21.077 -11.846 -15.270 457 H LEU 66 H LEU 66 -19.185 -7.334 -16.365 458 HA LEU 66 HA LEU 66 -20.297 -4.815 -16.807 459 HB2 LEU 66 HB2 LEU 66 -21.644 -5.951 -14.686 460 HB3 LEU 66 HB3 LEU 66 -20.366 -5.079 -13.853 461 HG LEU 66 HG LEU 66 -21.019 -3.015 -15.143 462 HD11 LEU 66 HD11 LEU 66 -22.148 -3.876 -17.060 463 HD12 LEU 66 HD12 LEU 66 -23.408 -3.117 -16.089 464 HD13 LEU 66 HD13 LEU 66 -23.220 -4.871 -16.077 465 HD21 LEU 66 HD21 LEU 66 -22.975 -2.545 -13.760 466 HD22 LEU 66 HD22 LEU 66 -21.825 -3.507 -12.829 467 HD23 LEU 66 HD23 LEU 66 -23.256 -4.271 -13.521 468 HA PRO 67 HA PRO 67 -16.447 -4.249 -13.982 469 HB2 PRO 67 HB2 PRO 67 -15.208 -6.405 -12.891 470 HB3 PRO 67 HB3 PRO 67 -16.551 -5.567 -12.087 471 HG2 PRO 67 HG2 PRO 67 -16.582 -8.081 -13.695 472 HG3 PRO 67 HG3 PRO 67 -17.389 -7.716 -12.158 473 HD2 PRO 67 HD2 PRO 67 -18.697 -7.639 -14.534 474 HD3 PRO 67 HD3 PRO 67 -19.127 -6.577 -13.181 475 HA PRO 68 HA PRO 68 -13.551 -5.060 -17.271 476 HB2 PRO 68 HB2 PRO 68 -11.104 -4.721 -16.072 477 HB3 PRO 68 HB3 PRO 68 -12.177 -3.381 -16.520 478 HG2 PRO 68 HG2 PRO 68 -11.789 -4.686 -13.865 479 HG3 PRO 68 HG3 PRO 68 -11.935 -2.965 -14.266 480 HD2 PRO 68 HD2 PRO 68 -14.021 -4.354 -13.260 481 HD3 PRO 68 HD3 PRO 68 -14.254 -3.061 -14.458 482 H LEU 69 H LEU 69 -13.551 -7.030 -14.468 483 HA LEU 69 HA LEU 69 -12.957 -9.200 -14.052 484 HB2 LEU 69 HB2 LEU 69 -12.820 -9.251 -17.074 485 HB3 LEU 69 HB3 LEU 69 -12.569 -10.680 -16.076 486 HG LEU 69 HG LEU 69 -15.047 -8.950 -15.861 487 HD11 LEU 69 HD11 LEU 69 -16.136 -10.804 -17.188 488 HD12 LEU 69 HD12 LEU 69 -14.521 -11.411 -17.550 489 HD13 LEU 69 HD13 LEU 69 -15.010 -9.816 -18.118 490 HD21 LEU 69 HD21 LEU 69 -15.938 -11.144 -14.905 491 HD22 LEU 69 HD22 LEU 69 -14.725 -10.331 -13.914 492 HD23 LEU 69 HD23 LEU 69 -14.271 -11.722 -14.902 493 H GLU 70 H GLU 70 -11.158 -9.664 -13.053 494 HA GLU 70 HA GLU 70 -8.929 -9.864 -12.512 495 HB2 GLU 70 HB2 GLU 70 -9.036 -10.494 -15.444 496 HB3 GLU 70 HB3 GLU 70 -7.451 -10.276 -14.699 497 HG2 GLU 70 HG2 GLU 70 -9.569 -12.153 -13.612 498 HG3 GLU 70 HG3 GLU 70 -8.282 -12.663 -14.704 499 H THR 71 H THR 71 -6.691 -8.913 -12.979 500 HA THR 71 HA THR 71 -6.674 -6.348 -14.330 501 HB THR 71 HB THR 71 -7.674 -5.728 -12.182 502 HG1 THR 71 HG1 THR 71 -4.947 -4.988 -12.396 503 HG21 THR 71 HG21 THR 71 -5.161 -6.907 -10.955 504 HG22 THR 71 HG22 THR 71 -6.784 -7.580 -10.815 505 HG23 THR 71 HG23 THR 71 -6.412 -6.020 -10.083 506 H VAL 72 H VAL 72 -4.578 -5.456 -14.567 507 HA VAL 72 HA VAL 72 -2.438 -7.454 -14.286 508 HB VAL 72 HB VAL 72 -2.552 -4.904 -15.938 509 HG11 VAL 72 HG11 VAL 72 -0.541 -5.937 -17.070 510 HG12 VAL 72 HG12 VAL 72 -0.491 -7.122 -15.764 511 HG13 VAL 72 HG13 VAL 72 -0.247 -5.412 -15.412 512 HG21 VAL 72 HG21 VAL 72 -4.095 -6.577 -16.802 513 HG22 VAL 72 HG22 VAL 72 -2.858 -7.831 -16.680 514 HG23 VAL 72 HG23 VAL 72 -2.677 -6.524 -17.852 515 H GLY 73 H GLY 73 -0.925 -7.228 -12.787 516 HA2 GLY 73 HA2 GLY 73 0.772 -5.853 -11.713 517 HA3 GLY 73 HA3 GLY 73 -0.421 -4.559 -11.614 518 H ASP 74 H ASP 74 1.083 -5.612 -9.431 519 HA ASP 74 HA ASP 74 -1.091 -6.270 -7.614 520 HB2 ASP 74 HB2 ASP 74 -0.261 -8.478 -8.472 521 HB3 ASP 74 HB3 ASP 74 1.321 -8.082 -7.804 522 H ILE 75 H ILE 75 -0.859 -4.979 -5.905 523 HA ILE 75 HA ILE 75 1.736 -3.779 -5.374 524 HB ILE 75 HB ILE 75 -0.961 -3.347 -4.031 525 HG12 ILE 75 HG12 ILE 75 0.477 -1.536 -5.997 526 HG13 ILE 75 HG13 ILE 75 -0.747 -2.699 -6.500 527 HG21 ILE 75 HG21 ILE 75 0.228 -1.182 -3.305 528 HG22 ILE 75 HG22 ILE 75 1.729 -1.971 -3.785 529 HG23 ILE 75 HG23 ILE 75 0.743 -2.663 -2.497 530 HD11 ILE 75 HD11 ILE 75 -1.952 -0.674 -6.201 531 HD12 ILE 75 HD12 ILE 75 -1.083 -0.282 -4.718 532 HD13 ILE 75 HD13 ILE 75 -2.266 -1.588 -4.726 533 H ASP 76 H ASP 76 2.933 -5.452 -4.584 534 HA ASP 76 HA ASP 76 2.146 -7.377 -2.720 535 HB2 ASP 76 HB2 ASP 76 4.861 -6.169 -3.288 536 HB3 ASP 76 HB3 ASP 76 4.627 -7.524 -2.189 537 H VAL 77 H VAL 77 2.312 -7.514 -0.465 538 HA VAL 77 HA VAL 77 3.332 -5.474 1.207 539 HB VAL 77 HB VAL 77 1.371 -4.235 0.322 540 HG11 VAL 77 HG11 VAL 77 -0.337 -6.332 1.682 541 HG12 VAL 77 HG12 VAL 77 -0.025 -6.314 -0.055 542 HG13 VAL 77 HG13 VAL 77 -0.882 -4.971 0.701 543 HG21 VAL 77 HG21 VAL 77 0.834 -5.022 3.193 544 HG22 VAL 77 HG22 VAL 77 0.559 -3.458 2.426 545 HG23 VAL 77 HG23 VAL 77 2.207 -4.014 2.731 546 H TYR 78 H TYR 78 2.705 -5.940 3.560 547 HA TYR 78 HA TYR 78 3.066 -8.643 4.171 548 HB2 TYR 78 HB2 TYR 78 1.935 -6.373 5.823 549 HB3 TYR 78 HB3 TYR 78 2.286 -7.970 6.481 550 HD1 TYR 78 HD1 TYR 78 3.732 -4.881 5.103 551 HD2 TYR 78 HD2 TYR 78 4.587 -8.789 6.671 552 HE1 TYR 78 HE1 TYR 78 6.120 -4.258 5.354 553 HE2 TYR 78 HE2 TYR 78 6.976 -8.163 6.923 554 HH TYR 78 HH TYR 78 8.067 -4.916 6.612 555 H SER 79 H SER 79 1.665 -10.260 4.902 556 HA SER 79 HA SER 79 -1.088 -9.991 3.917 557 HB2 SER 79 HB2 SER 79 0.228 -11.858 3.046 558 HB3 SER 79 HB3 SER 79 0.504 -12.442 4.686 559 HG SER 79 HG SER 79 -2.013 -12.129 3.399 560 HA PRO 80 HA PRO 80 -2.154 -9.632 8.391 561 HB2 PRO 80 HB2 PRO 80 -4.915 -9.543 7.269 562 HB3 PRO 80 HB3 PRO 80 -4.126 -8.436 8.412 563 HG2 PRO 80 HG2 PRO 80 -4.555 -7.704 5.910 564 HG3 PRO 80 HG3 PRO 80 -3.047 -7.270 6.737 565 HD2 PRO 80 HD2 PRO 80 -3.521 -9.447 4.714 566 HD3 PRO 80 HD3 PRO 80 -2.149 -8.323 4.855 567 HA PRO 81 HA PRO 81 -3.132 -13.925 9.237 568 HB2 PRO 81 HB2 PRO 81 -5.012 -12.891 11.332 569 HB3 PRO 81 HB3 PRO 81 -3.735 -14.115 11.472 570 HG2 PRO 81 HG2 PRO 81 -3.343 -11.703 12.438 571 HG3 PRO 81 HG3 PRO 81 -2.045 -12.531 11.556 572 HD2 PRO 81 HD2 PRO 81 -3.843 -10.314 10.618 573 HD3 PRO 81 HD3 PRO 81 -2.112 -10.570 10.299 574 H GLU 82 H GLU 82 -4.569 -15.353 8.397 575 HA GLU 82 HA GLU 82 -7.358 -14.516 7.982 576 HB2 GLU 82 HB2 GLU 82 -7.279 -15.464 5.652 577 HB3 GLU 82 HB3 GLU 82 -6.345 -13.987 5.871 578 HG2 GLU 82 HG2 GLU 82 -4.280 -15.339 6.112 579 HG3 GLU 82 HG3 GLU 82 -5.215 -16.808 5.869 580 HA PRO 83 HA PRO 83 -6.897 -18.886 9.778 581 HB2 PRO 83 HB2 PRO 83 -9.339 -17.890 11.187 582 HB3 PRO 83 HB3 PRO 83 -7.982 -18.841 11.822 583 HG2 PRO 83 HG2 PRO 83 -8.192 -16.283 12.413 584 HG3 PRO 83 HG3 PRO 83 -6.609 -16.984 12.021 585 HD2 PRO 83 HD2 PRO 83 -8.396 -15.286 10.296 586 HD3 PRO 83 HD3 PRO 83 -6.625 -15.246 10.465 587 H GLU 84 H GLU 84 -7.979 -20.622 8.925 588 HA GLU 84 HA GLU 84 -10.563 -20.126 7.564 589 HB2 GLU 84 HB2 GLU 84 -8.235 -21.749 6.505 590 HB3 GLU 84 HB3 GLU 84 -9.825 -21.643 5.752 591 HG2 GLU 84 HG2 GLU 84 -9.546 -19.201 5.505 592 HG3 GLU 84 HG3 GLU 84 -7.953 -19.310 6.250 593 H SER 85 H SER 85 -12.104 -21.626 7.822 594 HA SER 85 HA SER 85 -11.458 -23.992 9.472 595 HB2 SER 85 HB2 SER 85 -13.065 -22.469 10.510 596 HB3 SER 85 HB3 SER 85 -14.081 -22.529 9.074 597 HG SER 85 HG SER 85 -14.883 -24.316 9.810 598 H GLU 86 H GLU 86 -13.499 -22.897 6.778 599 HA GLU 86 HA GLU 86 -14.503 -24.014 5.047 600 HB2 GLU 86 HB2 GLU 86 -11.868 -25.502 5.201 601 HB3 GLU 86 HB3 GLU 86 -12.978 -25.567 3.833 602 HG2 GLU 86 HG2 GLU 86 -12.778 -23.115 3.561 603 HG3 GLU 86 HG3 GLU 86 -11.655 -23.060 4.917 604 HA PRO 87 HA PRO 87 -15.776 -27.592 7.982 605 HB2 PRO 87 HB2 PRO 87 -18.432 -26.376 7.332 606 HB3 PRO 87 HB3 PRO 87 -17.838 -27.033 8.871 607 HG2 PRO 87 HG2 PRO 87 -18.019 -24.432 8.541 608 HG3 PRO 87 HG3 PRO 87 -16.603 -25.130 9.353 609 HD2 PRO 87 HD2 PRO 87 -16.836 -24.097 6.537 610 HD3 PRO 87 HD3 PRO 87 -15.509 -23.900 7.705 611 H ALA 88 H ALA 88 -17.039 -26.308 4.955 612 HA ALA 88 HA ALA 88 -18.458 -28.567 4.045 613 HB1 ALA 88 HB1 ALA 88 -18.045 -27.553 1.757 614 HB2 ALA 88 HB2 ALA 88 -17.090 -26.314 2.571 615 HB3 ALA 88 HB3 ALA 88 -18.808 -26.485 2.934 616 H TYR 89 H TYR 89 -17.896 -30.327 2.842 617 HA TYR 89 HA TYR 89 -15.326 -31.439 3.138 618 HB2 TYR 89 HB2 TYR 89 -17.401 -32.761 2.777 619 HB3 TYR 89 HB3 TYR 89 -17.468 -32.174 1.119 620 HD1 TYR 89 HD1 TYR 89 -15.353 -34.082 3.529 621 HD2 TYR 89 HD2 TYR 89 -16.186 -33.222 -0.595 622 HE1 TYR 89 HE1 TYR 89 -13.815 -35.901 2.836 623 HE2 TYR 89 HE2 TYR 89 -14.651 -35.039 -1.288 624 HH TYR 89 HH TYR 89 -13.484 -37.378 0.867 625 H THR 90 H THR 90 -16.912 -29.900 0.352 626 HA THR 90 HA THR 90 -14.282 -29.686 -0.992 627 HB THR 90 HB THR 90 -15.544 -29.420 -3.089 628 HG1 THR 90 HG1 THR 90 -17.800 -29.855 -1.431 629 HG21 THR 90 HG21 THR 90 -16.770 -31.827 -1.780 630 HG22 THR 90 HG22 THR 90 -15.019 -31.748 -1.977 631 HG23 THR 90 HG23 THR 90 -16.071 -31.671 -3.388 632 HA PRO 91 HA PRO 91 -14.232 -25.265 -0.637 633 HB2 PRO 91 HB2 PRO 91 -14.246 -25.048 -3.626 634 HB3 PRO 91 HB3 PRO 91 -13.145 -24.304 -2.449 635 HG2 PRO 91 HG2 PRO 91 -12.344 -26.365 -3.870 636 HG3 PRO 91 HG3 PRO 91 -11.940 -26.262 -2.145 637 HD2 PRO 91 HD2 PRO 91 -14.025 -27.953 -3.494 638 HD3 PRO 91 HD3 PRO 91 -12.956 -28.358 -2.131 639 HA PRO 92 HA PRO 92 -18.644 -24.407 -1.411 640 HB2 PRO 92 HB2 PRO 92 -18.968 -22.209 0.105 641 HB3 PRO 92 HB3 PRO 92 -18.710 -23.808 0.836 642 HG2 PRO 92 HG2 PRO 92 -16.757 -21.592 0.401 643 HG3 PRO 92 HG3 PRO 92 -16.995 -22.620 1.826 644 HD2 PRO 92 HD2 PRO 92 -15.024 -23.062 -0.041 645 HD3 PRO 92 HD3 PRO 92 -15.740 -24.349 0.955 646 HA PRO 93 HA PRO 93 -18.631 -21.358 -4.700 647 HB2 PRO 93 HB2 PRO 93 -21.160 -20.290 -4.541 648 HB3 PRO 93 HB3 PRO 93 -20.807 -21.882 -5.238 649 HG2 PRO 93 HG2 PRO 93 -21.808 -21.192 -2.515 650 HG3 PRO 93 HG3 PRO 93 -22.320 -22.490 -3.610 651 HD2 PRO 93 HD2 PRO 93 -20.668 -22.973 -1.524 652 HD3 PRO 93 HD3 PRO 93 -20.510 -23.853 -3.062 653 H ALA 94 H ALA 94 -19.356 -20.444 -1.443 654 HA ALA 94 HA ALA 94 -18.191 -17.796 -1.847 655 HB1 ALA 94 HB1 ALA 94 -20.011 -16.783 -0.434 656 HB2 ALA 94 HB2 ALA 94 -20.912 -18.290 -0.609 657 HB3 ALA 94 HB3 ALA 94 -20.556 -17.304 -2.028 658 H ALA 95 H ALA 95 -17.488 -16.847 0.199 659 HA ALA 95 HA ALA 95 -17.395 -18.693 2.468 660 HB1 ALA 95 HB1 ALA 95 -14.812 -17.428 1.690 661 HB2 ALA 95 HB2 ALA 95 -15.366 -18.812 0.744 662 HB3 ALA 95 HB3 ALA 95 -15.118 -18.974 2.484 663 HA PRO 96 HA PRO 96 -17.829 -14.171 3.633 664 HB2 PRO 96 HB2 PRO 96 -20.179 -14.289 4.977 665 HB3 PRO 96 HB3 PRO 96 -20.103 -14.106 3.210 666 HG2 PRO 96 HG2 PRO 96 -20.653 -16.534 4.841 667 HG3 PRO 96 HG3 PRO 96 -21.402 -15.996 3.327 668 HD2 PRO 96 HD2 PRO 96 -19.441 -17.933 3.460 669 HD3 PRO 96 HD3 PRO 96 -19.749 -16.930 2.026 670 H VAL 97 H VAL 97 -16.359 -13.920 5.217 671 HA VAL 97 HA VAL 97 -16.935 -15.087 7.869 672 HB VAL 97 HB VAL 97 -14.510 -15.469 8.211 673 HG11 VAL 97 HG11 VAL 97 -15.851 -17.355 7.519 674 HG12 VAL 97 HG12 VAL 97 -14.330 -17.420 6.627 675 HG13 VAL 97 HG13 VAL 97 -15.794 -16.838 5.833 676 HG21 VAL 97 HG21 VAL 97 -13.642 -13.837 6.573 677 HG22 VAL 97 HG22 VAL 97 -14.317 -14.792 5.253 678 HG23 VAL 97 HG23 VAL 97 -13.008 -15.449 6.235 679 H PHE 98 H PHE 98 -16.090 -13.908 9.662 680 HA PHE 98 HA PHE 98 -15.410 -11.089 9.049 681 HB2 PHE 98 HB2 PHE 98 -17.160 -12.151 11.285 682 HB3 PHE 98 HB3 PHE 98 -16.645 -10.471 11.117 683 HD1 PHE 98 HD1 PHE 98 -18.848 -13.102 9.832 684 HD2 PHE 98 HD2 PHE 98 -17.448 -9.089 9.230 685 HE1 PHE 98 HE1 PHE 98 -20.731 -12.680 8.276 686 HE2 PHE 98 HE2 PHE 98 -19.330 -8.664 7.673 687 HZ PHE 98 HZ PHE 98 -20.974 -10.460 7.197 688 H ASP 99 H ASP 99 -13.468 -10.538 9.763 689 HA ASP 99 HA ASP 99 -12.494 -11.581 12.324 690 HB2 ASP 99 HB2 ASP 99 -11.690 -12.998 10.302 691 HB3 ASP 99 HB3 ASP 99 -10.660 -11.618 9.938 692 H ARG 100 H ARG 100 -13.455 -8.974 11.361 693 HA ARG 100 HA ARG 100 -12.980 -6.762 11.721 694 HB2 ARG 100 HB2 ARG 100 -11.736 -7.632 13.746 695 HB3 ARG 100 HB3 ARG 100 -10.271 -7.615 12.765 696 HG2 ARG 100 HG2 ARG 100 -10.650 -5.191 12.306 697 HG3 ARG 100 HG3 ARG 100 -12.033 -5.232 13.400 698 HD2 ARG 100 HD2 ARG 100 -10.145 -4.429 14.661 699 HD3 ARG 100 HD3 ARG 100 -10.480 -6.073 15.198 700 HE ARG 100 HE ARG 100 -8.576 -6.107 13.087 701 HH11 ARG 100 HH11 ARG 100 -8.860 -5.304 16.487 702 HH12 ARG 100 HH12 ARG 100 -7.188 -5.619 16.818 703 HH21 ARG 100 HH21 ARG 100 -6.415 -6.502 13.560 704 HH22 ARG 100 HH22 ARG 100 -5.817 -6.291 15.172 705 H ASP 101 H ASP 101 -9.780 -8.118 10.843 706 HA ASP 101 HA ASP 101 -8.329 -7.615 9.138 707 HB2 ASP 101 HB2 ASP 101 -10.518 -8.443 7.927 708 HB3 ASP 101 HB3 ASP 101 -10.639 -6.757 7.431 709 H GLU 102 H GLU 102 -7.907 -5.773 7.371 710 HA GLU 102 HA GLU 102 -8.679 -3.139 8.411 711 HB2 GLU 102 HB2 GLU 102 -5.807 -4.007 7.969 712 HB3 GLU 102 HB3 GLU 102 -6.331 -2.362 8.336 713 HG2 GLU 102 HG2 GLU 102 -7.297 -3.152 10.472 714 HG3 GLU 102 HG3 GLU 102 -6.746 -4.789 10.112 715 H VAL 103 H VAL 103 -8.865 -1.590 6.822 716 HA VAL 103 HA VAL 103 -7.817 -2.180 4.149 717 HB VAL 103 HB VAL 103 -10.083 -3.156 4.214 718 HG11 VAL 103 HG11 VAL 103 -11.054 -0.329 4.718 719 HG12 VAL 103 HG12 VAL 103 -10.993 -1.592 5.948 720 HG13 VAL 103 HG13 VAL 103 -12.049 -1.775 4.549 721 HG21 VAL 103 HG21 VAL 103 -9.258 -2.213 2.099 722 HG22 VAL 103 HG22 VAL 103 -9.880 -0.624 2.549 723 HG23 VAL 103 HG23 VAL 103 -10.996 -1.955 2.247 724 H ALA 104 H ALA 104 -7.407 -0.394 2.896 725 HA ALA 104 HA ALA 104 -8.276 2.255 3.686 726 HB1 ALA 104 HB1 ALA 104 -6.200 1.636 5.101 727 HB2 ALA 104 HB2 ALA 104 -6.178 3.174 4.238 728 HB3 ALA 104 HB3 ALA 104 -5.301 1.788 3.592 729 H GLU 105 H GLU 105 -5.625 0.734 1.838 730 HA GLU 105 HA GLU 105 -6.798 1.402 -0.704 731 HB2 GLU 105 HB2 GLU 105 -5.772 3.590 0.117 732 HB3 GLU 105 HB3 GLU 105 -4.203 2.798 -0.022 733 HG2 GLU 105 HG2 GLU 105 -4.584 2.380 -2.410 734 HG3 GLU 105 HG3 GLU 105 -6.204 3.067 -2.281 735 H GLN 106 H GLN 106 -6.512 -0.761 -1.219 736 HA GLN 106 HA GLN 106 -3.779 -1.547 -1.881 737 HB2 GLN 106 HB2 GLN 106 -5.596 -3.191 -0.098 738 HB3 GLN 106 HB3 GLN 106 -4.122 -3.798 -0.853 739 HG2 GLN 106 HG2 GLN 106 -2.817 -2.041 0.305 740 HG3 GLN 106 HG3 GLN 106 -4.291 -1.465 1.077 741 HE21 GLN 106 HE21 GLN 106 -3.966 -2.074 3.250 742 HE22 GLN 106 HE22 GLN 106 -3.645 -3.665 3.747 743 H LEU 107 H LEU 107 -3.731 -2.543 -3.815 744 HA LEU 107 HA LEU 107 -6.297 -3.193 -5.083 745 HB2 LEU 107 HB2 LEU 107 -3.837 -2.040 -6.023 746 HB3 LEU 107 HB3 LEU 107 -4.060 -3.578 -6.874 747 HG LEU 107 HG LEU 107 -6.270 -1.510 -6.639 748 HD11 LEU 107 HD11 LEU 107 -4.253 -0.537 -7.758 749 HD12 LEU 107 HD12 LEU 107 -5.632 -0.696 -8.845 750 HD13 LEU 107 HD13 LEU 107 -4.308 -1.857 -8.926 751 HD21 LEU 107 HD21 LEU 107 -7.104 -3.660 -7.267 752 HD22 LEU 107 HD22 LEU 107 -5.748 -3.948 -8.357 753 HD23 LEU 107 HD23 LEU 107 -6.974 -2.751 -8.772 754 H VAL 108 H VAL 108 -6.674 -5.164 -6.115 755 HA VAL 108 HA VAL 108 -6.682 -7.444 -6.300 756 HB VAL 108 HB VAL 108 -3.683 -7.013 -6.058 757 HG11 VAL 108 HG11 VAL 108 -4.101 -9.342 -5.692 758 HG12 VAL 108 HG12 VAL 108 -3.583 -9.155 -7.364 759 HG13 VAL 108 HG13 VAL 108 -5.291 -9.396 -6.994 760 HG21 VAL 108 HG21 VAL 108 -3.745 -7.109 -8.528 761 HG22 VAL 108 HG22 VAL 108 -4.737 -5.781 -7.919 762 HG23 VAL 108 HG23 VAL 108 -5.499 -7.270 -8.474 763 H GLY 109 H GLY 109 -3.835 -7.792 -4.237 764 HA2 GLY 109 HA2 GLY 109 -3.569 -8.625 -2.107 765 HA3 GLY 109 HA3 GLY 109 -5.097 -7.847 -1.717 766 H VAL 110 H VAL 110 -4.698 -10.351 -4.174 767 HA VAL 110 HA VAL 110 -6.292 -12.196 -2.486 768 HB VAL 110 HB VAL 110 -6.353 -11.893 -5.510 769 HG11 VAL 110 HG11 VAL 110 -8.028 -13.650 -3.687 770 HG12 VAL 110 HG12 VAL 110 -6.728 -14.229 -4.727 771 HG13 VAL 110 HG13 VAL 110 -8.181 -13.526 -5.437 772 HG21 VAL 110 HG21 VAL 110 -8.723 -11.171 -5.061 773 HG22 VAL 110 HG22 VAL 110 -7.514 -10.048 -4.438 774 HG23 VAL 110 HG23 VAL 110 -8.339 -11.154 -3.339 775 H SER 111 H SER 111 -5.288 -14.011 -1.958 776 HA SER 111 HA SER 111 -3.056 -14.974 -3.649 777 HB2 SER 111 HB2 SER 111 -1.974 -15.777 -1.624 778 HB3 SER 111 HB3 SER 111 -2.314 -14.056 -1.465 779 HG SER 111 HG SER 111 -3.058 -15.972 0.146 780 H ALA 112 H ALA 112 -2.568 -17.360 -3.039 781 HA ALA 112 HA ALA 112 -4.763 -18.953 -3.860 782 HB1 ALA 112 HB1 ALA 112 -3.290 -20.745 -3.799 783 HB2 ALA 112 HB2 ALA 112 -2.454 -20.141 -2.367 784 HB3 ALA 112 HB3 ALA 112 -2.167 -19.394 -3.940 785 H ALA 113 H ALA 113 -3.256 -18.387 -0.726 786 HA ALA 113 HA ALA 113 -3.847 -18.984 1.425 787 HB1 ALA 113 HB1 ALA 113 -6.520 -18.649 1.634 788 HB2 ALA 113 HB2 ALA 113 -6.234 -17.830 0.097 789 HB3 ALA 113 HB3 ALA 113 -5.382 -17.303 1.548 790 H SER 114 H SER 114 -3.230 -21.242 0.869 791 HA SER 114 HA SER 114 -5.414 -23.056 1.537 792 HB2 SER 114 HB2 SER 114 -5.469 -23.044 -0.911 793 HB3 SER 114 HB3 SER 114 -3.746 -23.411 -0.963 794 HG SER 114 HG SER 114 -5.157 -25.264 -1.163 795 H ALA 115 H ALA 115 -4.720 -25.023 2.437 796 HA ALA 115 HA ALA 115 -1.909 -25.646 2.605 797 HB1 ALA 115 HB1 ALA 115 -1.446 -24.749 4.608 798 HB2 ALA 115 HB2 ALA 115 -2.810 -25.598 5.336 799 HB3 ALA 115 HB3 ALA 115 -3.042 -24.000 4.628 800 H ALA 116 H ALA 116 -4.506 -26.437 4.929 801 HA ALA 116 HA ALA 116 -5.392 -28.801 3.733 802 HB1 ALA 116 HB1 ALA 116 -3.651 -29.637 5.983 803 HB2 ALA 116 HB2 ALA 116 -2.833 -29.188 4.485 804 HB3 ALA 116 HB3 ALA 116 -4.034 -30.481 4.481 805 H ALA 117 H ALA 117 -6.854 -26.941 4.843 806 HA ALA 117 HA ALA 117 -7.722 -28.072 7.437 807 HB1 ALA 117 HB1 ALA 117 -8.083 -25.956 8.346 808 HB2 ALA 117 HB2 ALA 117 -8.136 -25.177 6.764 809 HB3 ALA 117 HB3 ALA 117 -6.594 -25.716 7.431 810 H SER 118 H SER 118 -9.679 -28.937 7.302 811 HA SER 118 HA SER 118 -11.970 -27.646 6.342 812 HB2 SER 118 HB2 SER 118 -11.066 -27.973 4.091 813 HB3 SER 118 HB3 SER 118 -10.830 -29.690 4.409 814 HG SER 118 HG SER 118 -12.840 -28.953 3.279 815 H ALA 119 H ALA 119 -12.409 -28.510 8.475 816 HA ALA 119 HA ALA 119 -13.324 -31.315 8.359 817 HB1 ALA 119 HB1 ALA 119 -11.787 -29.957 10.575 818 HB2 ALA 119 HB2 ALA 119 -11.339 -31.407 9.676 819 HB3 ALA 119 HB3 ALA 119 -12.687 -31.454 10.811 820 H PHE 120 H PHE 120 -15.402 -31.555 8.871 821 HA PHE 120 HA PHE 120 -17.108 -29.416 9.492 822 HB2 PHE 120 HB2 PHE 120 -17.462 -32.408 9.708 823 HB3 PHE 120 HB3 PHE 120 -18.765 -31.263 10.019 824 HD1 PHE 120 HD1 PHE 120 -16.509 -32.657 7.453 825 HD2 PHE 120 HD2 PHE 120 -19.766 -29.965 8.227 826 HE1 PHE 120 HE1 PHE 120 -16.955 -32.498 5.020 827 HE2 PHE 120 HE2 PHE 120 -20.213 -29.806 5.792 828 HZ PHE 120 HZ PHE 120 -18.807 -31.071 4.189 829 H GLY 121 H GLY 121 -18.377 -29.036 11.353 830 HA2 GLY 121 HA2 GLY 121 -16.905 -29.391 13.859 831 HA3 GLY 121 HA3 GLY 121 -18.268 -28.310 13.594 832 H SER 122 H SER 122 -18.428 -31.623 12.534 833 HA SER 122 HA SER 122 -19.850 -32.540 14.909 834 HB2 SER 122 HB2 SER 122 -21.629 -31.459 13.606 835 HB3 SER 122 HB3 SER 122 -21.182 -32.409 12.193 836 HG SER 122 HG SER 122 -22.839 -33.074 14.117 837 H LEU 123 H LEU 123 -19.867 -34.780 15.099 838 HA LEU 123 HA LEU 123 -17.862 -36.185 13.656 839 HB2 LEU 123 HB2 LEU 123 -18.633 -38.174 14.919 840 HB3 LEU 123 HB3 LEU 123 -18.332 -36.780 15.947 841 HG LEU 123 HG LEU 123 -21.000 -36.400 15.408 842 HD11 LEU 123 HD11 LEU 123 -22.212 -38.392 15.231 843 HD12 LEU 123 HD12 LEU 123 -20.881 -39.385 15.825 844 HD13 LEU 123 HD13 LEU 123 -20.831 -38.734 14.192 845 HD21 LEU 123 HD21 LEU 123 -20.066 -38.269 17.602 846 HD22 LEU 123 HD22 LEU 123 -21.424 -37.145 17.643 847 HD23 LEU 123 HD23 LEU 123 -19.770 -36.529 17.639 848 H SER 124 H SER 124 -21.418 -36.326 13.555 849 HA SER 124 HA SER 124 -21.473 -36.927 10.780 850 HB2 SER 124 HB2 SER 124 -20.789 -39.149 12.138 851 HB3 SER 124 HB3 SER 124 -22.538 -39.296 12.215 852 HG SER 124 HG SER 124 -20.827 -39.222 9.984 853 H SER 125 H SER 125 -23.488 -38.071 13.523 854 HA SER 125 HA SER 125 -25.542 -36.132 12.880 855 HB2 SER 125 HB2 SER 125 -26.023 -37.926 11.279 856 HB3 SER 125 HB3 SER 125 -26.042 -39.102 12.587 857 HG SER 125 HG SER 125 -27.712 -36.810 12.482 858 H ALA 126 H ALA 126 -27.227 -36.065 14.441 859 HA ALA 126 HA ALA 126 -26.915 -37.697 16.830 860 HB1 ALA 126 HB1 ALA 126 -25.816 -36.146 18.026 861 HB2 ALA 126 HB2 ALA 126 -27.199 -35.066 17.855 862 HB3 ALA 126 HB3 ALA 126 -25.884 -35.009 16.682 863 H LEU 127 H LEU 127 -28.565 -34.569 16.498 864 HA LEU 127 HA LEU 127 -30.757 -33.970 16.652 865 HB2 LEU 127 HB2 LEU 127 -31.042 -36.590 15.159 866 HB3 LEU 127 HB3 LEU 127 -32.406 -35.520 15.480 867 HG LEU 127 HG LEU 127 -29.883 -34.585 14.086 868 HD11 LEU 127 HD11 LEU 127 -31.131 -34.833 11.980 869 HD12 LEU 127 HD12 LEU 127 -32.496 -35.521 12.859 870 HD13 LEU 127 HD13 LEU 127 -30.967 -36.395 12.783 871 HD21 LEU 127 HD21 LEU 127 -31.175 -32.758 14.985 872 HD22 LEU 127 HD22 LEU 127 -32.685 -33.472 14.423 873 HD23 LEU 127 HD23 LEU 127 -31.530 -32.825 13.258 874 H LEU 128 H LEU 128 -30.355 -34.239 18.940 875 HA LEU 128 HA LEU 128 -31.077 -36.503 20.452 876 HB2 LEU 128 HB2 LEU 128 -30.975 -33.554 21.097 877 HB3 LEU 128 HB3 LEU 128 -31.279 -34.797 22.313 878 HG LEU 128 HG LEU 128 -28.867 -34.919 20.484 879 HD11 LEU 128 HD11 LEU 128 -28.622 -32.826 21.601 880 HD12 LEU 128 HD12 LEU 128 -27.624 -33.977 22.497 881 HD13 LEU 128 HD13 LEU 128 -29.200 -33.492 23.130 882 HD21 LEU 128 HD21 LEU 128 -29.369 -36.996 21.619 883 HD22 LEU 128 HD22 LEU 128 -29.614 -36.159 23.152 884 HD23 LEU 128 HD23 LEU 128 -27.998 -36.261 22.449 885 H MET 129 H MET 129 -32.942 -33.699 19.353 886 HA MET 129 HA MET 129 -35.397 -34.888 20.482 887 HB2 MET 129 HB2 MET 129 -34.819 -32.065 19.550 888 HB3 MET 129 HB3 MET 129 -36.393 -32.632 20.107 889 HG2 MET 129 HG2 MET 129 -35.466 -31.676 22.043 890 HG3 MET 129 HG3 MET 129 -35.108 -33.391 22.248 891 HE1 MET 129 HE1 MET 129 -31.977 -31.798 23.793 892 HE2 MET 129 HE2 MET 129 -33.301 -32.948 23.969 893 HE3 MET 129 HE3 MET 129 -33.647 -31.223 23.883 894 HA PRO 130 HA PRO 130 -37.018 -36.030 16.511 895 HB2 PRO 130 HB2 PRO 130 -39.525 -34.547 17.134 896 HB3 PRO 130 HB3 PRO 130 -39.301 -36.251 16.698 897 HG2 PRO 130 HG2 PRO 130 -39.877 -35.520 19.188 898 HG3 PRO 130 HG3 PRO 130 -38.781 -36.872 18.843 899 HD2 PRO 130 HD2 PRO 130 -38.125 -34.100 19.767 900 HD3 PRO 130 HD3 PRO 130 -37.335 -35.643 20.169 901 H LYS 131 H LYS 131 -38.497 -34.900 14.645 902 HA LYS 131 HA LYS 131 -36.929 -32.883 13.504 903 HB2 LYS 131 HB2 LYS 131 -39.786 -33.700 12.940 904 HB3 LYS 131 HB3 LYS 131 -38.869 -32.578 11.934 905 HG2 LYS 131 HG2 LYS 131 -37.146 -34.307 11.570 906 HG3 LYS 131 HG3 LYS 131 -38.067 -35.435 12.565 907 HD2 LYS 131 HD2 LYS 131 -39.966 -35.277 10.998 908 HD3 LYS 131 HD3 LYS 131 -39.049 -34.148 9.998 909 HE2 LYS 131 HE2 LYS 131 -37.322 -35.869 9.629 910 HE3 LYS 131 HE3 LYS 131 -38.234 -37.000 10.630 911 HZ1 LYS 131 HZ1 LYS 131 -38.928 -37.537 8.519 912 HZ2 LYS 131 HZ2 LYS 131 -38.889 -35.932 7.969 913 HZ3 LYS 131 HZ3 LYS 131 -40.136 -36.448 8.998 914 H ASP 132 H ASP 132 -37.221 -30.676 13.234 915 HA ASP 132 HA ASP 132 -38.608 -29.362 15.443 916 HB2 ASP 132 HB2 ASP 132 -36.264 -28.789 14.933 917 HB3 ASP 132 HB3 ASP 132 -36.749 -28.253 13.324 918 H GLY 133 H GLY 133 -40.780 -29.482 14.850 919 HA2 GLY 133 HA2 GLY 133 -41.846 -28.777 12.321 920 HA3 GLY 133 HA3 GLY 133 -42.743 -28.830 13.836 921 H LEU 134 H LEU 134 -41.279 -26.928 15.277 922 HA LEU 134 HA LEU 134 -42.023 -24.435 13.865 923 HB2 LEU 134 HB2 LEU 134 -42.182 -25.316 16.727 924 HB3 LEU 134 HB3 LEU 134 -41.886 -23.615 16.410 925 HG LEU 134 HG LEU 134 -44.294 -24.076 16.707 926 HD11 LEU 134 HD11 LEU 134 -43.406 -22.317 15.059 927 HD12 LEU 134 HD12 LEU 134 -45.093 -22.800 14.888 928 HD13 LEU 134 HD13 LEU 134 -43.875 -23.446 13.788 929 HD21 LEU 134 HD21 LEU 134 -44.107 -26.443 15.722 930 HD22 LEU 134 HD22 LEU 134 -44.224 -25.671 14.141 931 HD23 LEU 134 HD23 LEU 134 -45.548 -25.519 15.297 932 H GLU 135 H GLU 135 -40.559 -22.769 13.710 933 HA GLU 135 HA GLU 135 -37.807 -23.374 14.619 934 HB2 GLU 135 HB2 GLU 135 -38.243 -23.196 12.128 935 HB3 GLU 135 HB3 GLU 135 -38.610 -21.493 12.394 936 HG2 GLU 135 HG2 GLU 135 -36.279 -21.677 11.746 937 HG3 GLU 135 HG3 GLU 135 -36.351 -21.227 13.449 938 H HIS 136 H HIS 136 -37.399 -22.320 16.446 939 HA HIS 136 HA HIS 136 -38.673 -19.892 17.241 940 HB2 HIS 136 HB2 HIS 136 -36.233 -21.330 18.302 941 HB3 HIS 136 HB3 HIS 136 -36.957 -19.918 19.070 942 HD2 HIS 136 HD2 HIS 136 -37.417 -23.716 19.061 943 HE1 HIS 136 HE1 HIS 136 -40.960 -22.116 20.707 944 HE2 HIS 136 HE2 HIS 136 -39.631 -24.247 20.338 945 H HIS 137 H HIS 137 -35.547 -20.683 15.803 946 HA HIS 137 HA HIS 137 -34.906 -17.801 15.594 947 HB2 HIS 137 HB2 HIS 137 -33.283 -19.230 16.825 948 HB3 HIS 137 HB3 HIS 137 -33.085 -20.219 15.382 949 HD2 HIS 137 HD2 HIS 137 -31.178 -19.252 13.612 950 HE1 HIS 137 HE1 HIS 137 -30.705 -15.422 15.325 951 HE2 HIS 137 HE2 HIS 137 -29.827 -17.017 13.555 952 H HIS 138 H HIS 138 -35.417 -16.970 13.654 953 HA HIS 138 HA HIS 138 -34.582 -18.365 11.225 954 HB2 HIS 138 HB2 HIS 138 -36.951 -19.088 11.732 955 HB3 HIS 138 HB3 HIS 138 -37.436 -17.406 11.521 956 HD2 HIS 138 HD2 HIS 138 -36.524 -20.488 9.339 957 HE1 HIS 138 HE1 HIS 138 -37.031 -17.213 6.722 958 HE2 HIS 138 HE2 HIS 138 -36.726 -19.732 6.848 959 H HIS 139 H HIS 139 -33.695 -16.968 9.858 960 HA HIS 139 HA HIS 139 -34.613 -14.179 9.785 961 HB2 HIS 139 HB2 HIS 139 -31.724 -15.019 10.115 962 HB3 HIS 139 HB3 HIS 139 -32.256 -13.382 9.734 963 HD2 HIS 139 HD2 HIS 139 -31.665 -15.546 12.831 964 HE1 HIS 139 HE1 HIS 139 -34.082 -12.325 14.105 965 HE2 HIS 139 HE2 HIS 139 -32.654 -14.275 14.888 966 H HIS 140 H HIS 140 -34.038 -13.056 7.840 967 HA HIS 140 HA HIS 140 -34.272 -14.650 5.507 968 HB2 HIS 140 HB2 HIS 140 -34.055 -12.541 4.278 969 HB3 HIS 140 HB3 HIS 140 -35.152 -12.360 5.643 970 HD2 HIS 140 HD2 HIS 140 -31.876 -10.800 4.318 971 HE1 HIS 140 HE1 HIS 140 -32.421 -9.318 8.234 972 HE2 HIS 140 HE2 HIS 140 -31.070 -9.067 6.096 973 H HIS 141 H HIS 141 -31.506 -13.607 7.300 974 HA HIS 141 HA HIS 141 -29.721 -15.101 5.615 975 HB2 HIS 141 HB2 HIS 141 -29.946 -12.943 4.351 976 HB3 HIS 141 HB3 HIS 141 -29.294 -12.102 5.755 977 HD2 HIS 141 HD2 HIS 141 -26.537 -11.957 5.718 978 HE1 HIS 141 HE1 HIS 141 -25.800 -15.114 3.016 979 HE2 HIS 141 HE2 HIS 141 -24.717 -13.269 4.383 Start of MODEL 16 1 H1 MET 1 HT1 MET 1 -3.355 11.098 -7.375 2 H2 MET 1 HT2 MET 1 -1.845 11.596 -7.975 3 H3 MET 1 HT3 MET 1 -3.096 12.726 -7.770 4 HA MET 1 HA MET 1 -2.864 12.828 -5.516 5 HB2 MET 1 HB2 MET 1 -1.835 10.008 -5.850 6 HB3 MET 1 HB3 MET 1 -1.514 10.895 -4.361 7 HG2 MET 1 HG2 MET 1 -4.286 10.524 -5.532 8 HG3 MET 1 HG3 MET 1 -3.603 9.485 -4.281 9 HE1 MET 1 HE1 MET 1 -6.203 10.768 -4.083 10 HE2 MET 1 HE2 MET 1 -6.339 11.778 -2.646 11 HE3 MET 1 HE3 MET 1 -5.675 10.152 -2.510 12 H SER 2 H SER 2 -1.215 13.737 -7.717 13 HA SER 2 HA SER 2 1.552 13.456 -7.212 14 HB2 SER 2 HB2 SER 2 1.813 15.408 -8.654 15 HB3 SER 2 HB3 SER 2 0.620 14.307 -9.335 16 HG SER 2 HG SER 2 -0.555 16.065 -9.348 17 H ASP 3 H ASP 3 -0.897 15.401 -5.684 18 HA ASP 3 HA ASP 3 0.695 17.462 -4.605 19 HB2 ASP 3 HB2 ASP 3 -1.864 16.175 -3.642 20 HB3 ASP 3 HB3 ASP 3 -1.132 17.561 -2.842 21 H GLN 4 H GLN 4 -0.056 14.205 -3.439 22 HA GLN 4 HA GLN 4 1.180 14.458 -0.893 23 HB2 GLN 4 HB2 GLN 4 0.495 12.059 -2.599 24 HB3 GLN 4 HB3 GLN 4 1.171 11.930 -0.974 25 HG2 GLN 4 HG2 GLN 4 -0.716 13.105 -0.023 26 HG3 GLN 4 HG3 GLN 4 -1.350 13.479 -1.622 27 HE21 GLN 4 HE21 GLN 4 -2.620 11.880 0.602 28 HE22 GLN 4 HE22 GLN 4 -2.972 10.369 -0.085 29 H SER 5 H SER 5 2.310 13.389 -4.072 30 HA SER 5 HA SER 5 5.072 13.833 -3.287 31 HB2 SER 5 HB2 SER 5 4.626 11.501 -2.589 32 HB3 SER 5 HB3 SER 5 4.123 11.117 -4.231 33 HG SER 5 HG SER 5 6.677 11.985 -3.344 34 H GLN 6 H GLN 6 6.452 14.107 -5.105 35 HA GLN 6 HA GLN 6 5.092 14.881 -7.519 36 HB2 GLN 6 HB2 GLN 6 7.331 15.572 -8.291 37 HB3 GLN 6 HB3 GLN 6 6.941 16.231 -6.706 38 HG2 GLN 6 HG2 GLN 6 8.368 13.610 -6.707 39 HG3 GLN 6 HG3 GLN 6 9.292 14.996 -7.268 40 HE21 GLN 6 HE21 GLN 6 10.640 15.126 -5.371 41 HE22 GLN 6 HE22 GLN 6 10.025 15.575 -3.853 42 H GLU 7 H GLU 7 5.681 11.869 -6.558 43 HA GLU 7 HA GLU 7 6.282 10.928 -9.291 44 HB2 GLU 7 HB2 GLU 7 7.324 9.752 -6.699 45 HB3 GLU 7 HB3 GLU 7 7.487 8.996 -8.283 46 HG2 GLU 7 HG2 GLU 7 8.746 10.951 -9.097 47 HG3 GLU 7 HG3 GLU 7 8.577 11.718 -7.520 48 HA PRO 8 HA PRO 8 2.545 8.567 -8.804 49 HB2 PRO 8 HB2 PRO 8 3.146 6.165 -10.020 50 HB3 PRO 8 HB3 PRO 8 2.750 7.653 -10.902 51 HG2 PRO 8 HG2 PRO 8 5.410 6.443 -10.328 52 HG3 PRO 8 HG3 PRO 8 4.820 7.233 -11.801 53 HD2 PRO 8 HD2 PRO 8 6.452 8.508 -10.047 54 HD3 PRO 8 HD3 PRO 8 5.208 9.371 -10.980 55 H THR 9 H THR 9 1.983 7.909 -6.824 56 HA THR 9 HA THR 9 3.626 5.922 -5.403 57 HB THR 9 HB THR 9 2.370 6.611 -3.396 58 HG1 THR 9 HG1 THR 9 0.784 8.068 -3.524 59 HG21 THR 9 HG21 THR 9 3.205 8.975 -3.303 60 HG22 THR 9 HG22 THR 9 3.562 8.869 -5.027 61 HG23 THR 9 HG23 THR 9 4.409 7.826 -3.886 62 H MET 10 H MET 10 2.452 4.301 -4.116 63 HA MET 10 HA MET 10 0.837 2.642 -5.682 64 HB2 MET 10 HB2 MET 10 2.121 1.953 -3.627 65 HB3 MET 10 HB3 MET 10 0.858 2.707 -2.654 66 HG2 MET 10 HG2 MET 10 0.325 0.365 -2.811 67 HG3 MET 10 HG3 MET 10 -0.814 1.225 -3.845 68 HE1 MET 10 HE1 MET 10 -1.184 1.095 -5.914 69 HE2 MET 10 HE2 MET 10 -1.305 -0.651 -6.116 70 HE3 MET 10 HE3 MET 10 -0.322 0.291 -7.235 71 H GLU 11 H GLU 11 -0.081 4.952 -3.143 72 HA GLU 11 HA GLU 11 -2.893 4.505 -3.302 73 HB2 GLU 11 HB2 GLU 11 -1.264 6.835 -2.272 74 HB3 GLU 11 HB3 GLU 11 -3.017 6.727 -2.124 75 HG2 GLU 11 HG2 GLU 11 -2.794 4.606 -0.890 76 HG3 GLU 11 HG3 GLU 11 -1.040 4.697 -1.045 77 H GLU 12 H GLU 12 -0.664 6.310 -5.216 78 HA GLU 12 HA GLU 12 -2.586 8.127 -6.397 79 HB2 GLU 12 HB2 GLU 12 -0.092 8.559 -6.246 80 HB3 GLU 12 HB3 GLU 12 0.115 7.357 -7.518 81 HG2 GLU 12 HG2 GLU 12 -1.823 9.634 -7.907 82 HG3 GLU 12 HG3 GLU 12 -0.102 9.885 -8.173 83 H ILE 13 H ILE 13 -0.723 5.378 -7.701 84 HA ILE 13 HA ILE 13 -2.105 5.122 -10.119 85 HB ILE 13 HB ILE 13 -0.652 3.048 -8.453 86 HG12 ILE 13 HG12 ILE 13 0.743 4.980 -9.122 87 HG13 ILE 13 HG13 ILE 13 1.260 3.506 -9.926 88 HG21 ILE 13 HG21 ILE 13 -2.080 1.895 -10.056 89 HG22 ILE 13 HG22 ILE 13 -0.398 1.781 -10.574 90 HG23 ILE 13 HG23 ILE 13 -1.488 2.921 -11.365 91 HD11 ILE 13 HD11 ILE 13 1.263 5.375 -11.519 92 HD12 ILE 13 HD12 ILE 13 -0.427 5.714 -11.165 93 HD13 ILE 13 HD13 ILE 13 0.018 4.213 -11.974 94 H LEU 14 H LEU 14 -2.626 3.392 -7.030 95 HA LEU 14 HA LEU 14 -4.772 1.779 -7.824 96 HB2 LEU 14 HB2 LEU 14 -3.618 1.466 -5.688 97 HB3 LEU 14 HB3 LEU 14 -4.181 3.033 -5.120 98 HG LEU 14 HG LEU 14 -6.537 2.208 -5.271 99 HD11 LEU 14 HD11 LEU 14 -5.134 -0.313 -6.148 100 HD12 LEU 14 HD12 LEU 14 -6.504 0.494 -6.903 101 HD13 LEU 14 HD13 LEU 14 -6.723 -0.382 -5.387 102 HD21 LEU 14 HD21 LEU 14 -5.064 2.018 -3.194 103 HD22 LEU 14 HD22 LEU 14 -4.836 0.323 -3.621 104 HD23 LEU 14 HD23 LEU 14 -6.451 0.929 -3.248 105 H ALA 15 H ALA 15 -4.818 5.029 -6.311 106 HA ALA 15 HA ALA 15 -7.585 5.379 -6.244 107 HB1 ALA 15 HB1 ALA 15 -7.039 7.832 -6.216 108 HB2 ALA 15 HB2 ALA 15 -5.355 7.398 -6.506 109 HB3 ALA 15 HB3 ALA 15 -6.159 6.875 -5.028 110 H SER 16 H SER 16 -5.268 6.179 -8.841 111 HA SER 16 HA SER 16 -7.064 7.516 -10.537 112 HB2 SER 16 HB2 SER 16 -4.580 5.913 -11.164 113 HB3 SER 16 HB3 SER 16 -5.434 6.907 -12.341 114 HG SER 16 HG SER 16 -3.957 8.258 -11.501 115 H ILE 17 H ILE 17 -6.244 4.082 -10.240 116 HA ILE 17 HA ILE 17 -7.643 3.134 -12.491 117 HB ILE 17 HB ILE 17 -6.972 1.796 -9.845 118 HG12 ILE 17 HG12 ILE 17 -5.713 1.438 -12.582 119 HG13 ILE 17 HG13 ILE 17 -5.136 2.642 -11.433 120 HG21 ILE 17 HG21 ILE 17 -8.824 0.562 -10.877 121 HG22 ILE 17 HG22 ILE 17 -7.332 -0.348 -11.109 122 HG23 ILE 17 HG23 ILE 17 -8.009 0.589 -12.442 123 HD11 ILE 17 HD11 ILE 17 -5.398 -0.295 -10.741 124 HD12 ILE 17 HD12 ILE 17 -4.561 0.956 -9.821 125 HD13 ILE 17 HD13 ILE 17 -3.910 0.414 -11.368 126 H ARG 18 H ARG 18 -8.697 3.552 -9.101 127 HA ARG 18 HA ARG 18 -11.379 2.681 -9.662 128 HB2 ARG 18 HB2 ARG 18 -11.832 3.407 -7.308 129 HB3 ARG 18 HB3 ARG 18 -10.484 2.284 -7.451 130 HG2 ARG 18 HG2 ARG 18 -8.882 4.104 -7.261 131 HG3 ARG 18 HG3 ARG 18 -10.174 5.300 -7.281 132 HD2 ARG 18 HD2 ARG 18 -9.862 3.141 -5.178 133 HD3 ARG 18 HD3 ARG 18 -9.339 4.811 -4.979 134 HE ARG 18 HE ARG 18 -12.026 4.894 -5.727 135 HH11 ARG 18 HH11 ARG 18 -10.135 3.675 -3.039 136 HH12 ARG 18 HH12 ARG 18 -11.424 3.863 -1.900 137 HH21 ARG 18 HH21 ARG 18 -13.675 5.110 -4.214 138 HH22 ARG 18 HH22 ARG 18 -13.413 4.669 -2.559 139 H ARG 19 H ARG 19 -12.087 5.308 -7.793 140 HA ARG 19 HA ARG 19 -12.510 7.086 -10.119 141 HB2 ARG 19 HB2 ARG 19 -14.451 6.487 -7.872 142 HB3 ARG 19 HB3 ARG 19 -14.684 7.729 -9.103 143 HG2 ARG 19 HG2 ARG 19 -14.613 6.017 -10.867 144 HG3 ARG 19 HG3 ARG 19 -14.342 4.765 -9.654 145 HD2 ARG 19 HD2 ARG 19 -16.692 4.774 -10.214 146 HD3 ARG 19 HD3 ARG 19 -16.516 5.413 -8.587 147 HE ARG 19 HE ARG 19 -17.105 6.995 -11.017 148 HH11 ARG 19 HH11 ARG 19 -16.868 6.854 -7.505 149 HH12 ARG 19 HH12 ARG 19 -17.689 8.357 -7.291 150 HH21 ARG 19 HH21 ARG 19 -18.174 8.931 -10.662 151 HH22 ARG 19 HH22 ARG 19 -18.417 9.520 -9.052 152 H ILE 20 H ILE 20 -12.474 9.316 -9.697 153 HA ILE 20 HA ILE 20 -10.646 10.116 -7.670 154 HB ILE 20 HB ILE 20 -11.078 12.419 -8.467 155 HG12 ILE 20 HG12 ILE 20 -13.048 11.156 -10.405 156 HG13 ILE 20 HG13 ILE 20 -13.556 11.989 -8.938 157 HG21 ILE 20 HG21 ILE 20 -9.425 11.167 -9.658 158 HG22 ILE 20 HG22 ILE 20 -10.431 11.931 -10.890 159 HG23 ILE 20 HG23 ILE 20 -10.648 10.224 -10.508 160 HD11 ILE 20 HD11 ILE 20 -11.979 13.189 -11.233 161 HD12 ILE 20 HD12 ILE 20 -12.330 14.027 -9.720 162 HD13 ILE 20 HD13 ILE 20 -13.648 13.559 -10.796 163 H ILE 21 H ILE 21 -14.152 10.140 -7.872 164 HA ILE 21 HA ILE 21 -15.797 10.910 -6.430 165 HB ILE 21 HB ILE 21 -13.848 9.668 -4.457 166 HG12 ILE 21 HG12 ILE 21 -16.227 8.389 -5.837 167 HG13 ILE 21 HG13 ILE 21 -14.592 8.282 -6.484 168 HG21 ILE 21 HG21 ILE 21 -16.863 10.043 -4.274 169 HG22 ILE 21 HG22 ILE 21 -15.679 11.020 -3.404 170 HG23 ILE 21 HG23 ILE 21 -15.827 9.298 -3.055 171 HD11 ILE 21 HD11 ILE 21 -15.255 7.463 -3.647 172 HD12 ILE 21 HD12 ILE 21 -13.811 7.070 -4.582 173 HD13 ILE 21 HD13 ILE 21 -15.358 6.334 -4.999 174 H SER 22 H SER 22 -15.837 13.143 -6.513 175 HA SER 22 HA SER 22 -14.479 14.517 -4.290 176 HB2 SER 22 HB2 SER 22 -14.530 15.453 -7.166 177 HB3 SER 22 HB3 SER 22 -14.032 16.454 -5.806 178 HG SER 22 HG SER 22 -12.209 15.499 -6.636 179 H GLU 23 H GLU 23 -16.582 15.619 -6.972 180 HA GLU 23 HA GLU 23 -18.504 16.894 -6.943 181 HB2 GLU 23 HB2 GLU 23 -19.141 14.996 -4.666 182 HB3 GLU 23 HB3 GLU 23 -20.318 15.989 -5.522 183 HG2 GLU 23 HG2 GLU 23 -18.561 13.872 -6.807 184 HG3 GLU 23 HG3 GLU 23 -20.257 13.658 -6.389 185 H ASP 24 H ASP 24 -16.255 17.808 -5.297 186 HA ASP 24 HA ASP 24 -17.030 18.834 -2.800 187 HB2 ASP 24 HB2 ASP 24 -15.042 19.873 -4.828 188 HB3 ASP 24 HB3 ASP 24 -15.241 20.584 -3.229 189 H ASP 25 H ASP 25 -17.095 20.422 -6.005 190 HA ASP 25 HA ASP 25 -19.019 22.372 -4.898 191 HB2 ASP 25 HB2 ASP 25 -16.913 23.373 -5.699 192 HB3 ASP 25 HB3 ASP 25 -17.179 22.657 -7.285 193 H ALA 26 H ALA 26 -20.820 20.935 -5.246 194 HA ALA 26 HA ALA 26 -21.410 20.088 -7.963 195 HB1 ALA 26 HB1 ALA 26 -23.403 19.066 -6.956 196 HB2 ALA 26 HB2 ALA 26 -23.037 19.855 -5.422 197 HB3 ALA 26 HB3 ALA 26 -21.951 18.620 -6.060 198 HA PRO 27 HA PRO 27 -23.980 23.653 -8.778 199 HB2 PRO 27 HB2 PRO 27 -25.353 22.857 -10.947 200 HB3 PRO 27 HB3 PRO 27 -23.590 23.058 -10.998 201 HG2 PRO 27 HG2 PRO 27 -25.205 20.568 -10.784 202 HG3 PRO 27 HG3 PRO 27 -23.719 20.877 -11.700 203 HD2 PRO 27 HD2 PRO 27 -23.830 19.612 -9.211 204 HD3 PRO 27 HD3 PRO 27 -22.378 20.353 -9.920 205 H ALA 28 H ALA 28 -25.082 23.078 -6.616 206 HA ALA 28 HA ALA 28 -26.990 22.916 -5.348 207 HB1 ALA 28 HB1 ALA 28 -28.630 23.227 -7.849 208 HB2 ALA 28 HB2 ALA 28 -27.700 24.585 -7.212 209 HB3 ALA 28 HB3 ALA 28 -28.957 23.837 -6.225 210 H GLU 29 H GLU 29 -27.180 20.900 -4.570 211 HA GLU 29 HA GLU 29 -29.115 19.113 -5.449 212 HB2 GLU 29 HB2 GLU 29 -26.559 18.819 -6.846 213 HB3 GLU 29 HB3 GLU 29 -26.918 17.378 -5.906 214 HG2 GLU 29 HG2 GLU 29 -28.782 18.660 -7.935 215 HG3 GLU 29 HG3 GLU 29 -27.821 17.209 -8.204 216 HA PRO 30 HA PRO 30 -26.579 17.270 -1.898 217 HB2 PRO 30 HB2 PRO 30 -24.092 18.081 -1.271 218 HB3 PRO 30 HB3 PRO 30 -24.384 16.940 -2.602 219 HG2 PRO 30 HG2 PRO 30 -23.884 19.881 -2.705 220 HG3 PRO 30 HG3 PRO 30 -23.236 18.589 -3.733 221 HD2 PRO 30 HD2 PRO 30 -25.360 20.192 -4.453 222 HD3 PRO 30 HD3 PRO 30 -25.095 18.553 -5.090 223 H ALA 31 H ALA 31 -25.943 17.875 0.390 224 HA ALA 31 HA ALA 31 -27.507 20.022 1.336 225 HB1 ALA 31 HB1 ALA 31 -26.841 19.369 3.465 226 HB2 ALA 31 HB2 ALA 31 -25.208 18.957 2.934 227 HB3 ALA 31 HB3 ALA 31 -26.557 17.887 2.551 228 H ALA 32 H ALA 32 -24.042 19.685 0.750 229 HA ALA 32 HA ALA 32 -22.334 21.181 0.657 230 HB1 ALA 32 HB1 ALA 32 -23.486 23.617 -0.023 231 HB2 ALA 32 HB2 ALA 32 -24.648 22.429 -0.616 232 HB3 ALA 32 HB3 ALA 32 -22.971 22.366 -1.153 233 H GLU 33 H GLU 33 -22.451 20.778 3.053 234 HA GLU 33 HA GLU 33 -22.776 23.347 4.492 235 HB2 GLU 33 HB2 GLU 33 -23.258 20.510 5.405 236 HB3 GLU 33 HB3 GLU 33 -23.136 21.873 6.522 237 HG2 GLU 33 HG2 GLU 33 -25.028 22.971 5.479 238 HG3 GLU 33 HG3 GLU 33 -25.078 21.769 4.196 239 H ALA 34 H ALA 34 -21.118 23.968 5.853 240 HA ALA 34 HA ALA 34 -18.634 22.377 5.672 241 HB1 ALA 34 HB1 ALA 34 -18.927 25.341 6.220 242 HB2 ALA 34 HB2 ALA 34 -18.581 24.652 4.635 243 HB3 ALA 34 HB3 ALA 34 -17.423 24.459 5.952 244 H ALA 35 H ALA 35 -17.622 21.744 7.455 245 HA ALA 35 HA ALA 35 -18.596 22.699 10.071 246 HB1 ALA 35 HB1 ALA 35 -17.861 19.836 9.855 247 HB2 ALA 35 HB2 ALA 35 -19.360 20.318 9.051 248 HB3 ALA 35 HB3 ALA 35 -19.150 20.609 10.781 249 HA PRO 36 HA PRO 36 -14.305 22.995 11.153 250 HB2 PRO 36 HB2 PRO 36 -14.223 22.240 13.774 251 HB3 PRO 36 HB3 PRO 36 -14.925 23.778 13.236 252 HG2 PRO 36 HG2 PRO 36 -16.290 21.214 13.928 253 HG3 PRO 36 HG3 PRO 36 -16.724 22.876 14.368 254 HD2 PRO 36 HD2 PRO 36 -17.966 21.566 12.346 255 HD3 PRO 36 HD3 PRO 36 -17.690 23.322 12.302 256 HA PRO 37 HA PRO 37 -12.219 19.105 10.543 257 HB2 PRO 37 HB2 PRO 37 -10.213 19.923 12.599 258 HB3 PRO 37 HB3 PRO 37 -9.961 19.417 10.916 259 HG2 PRO 37 HG2 PRO 37 -9.727 21.954 11.589 260 HG3 PRO 37 HG3 PRO 37 -10.519 21.496 10.070 261 HD2 PRO 37 HD2 PRO 37 -11.774 22.385 12.654 262 HD3 PRO 37 HD3 PRO 37 -12.223 22.799 10.982 263 HA PRO 38 HA PRO 38 -13.639 16.509 13.925 264 HB2 PRO 38 HB2 PRO 38 -12.369 14.157 13.387 265 HB3 PRO 38 HB3 PRO 38 -13.740 14.752 12.428 266 HG2 PRO 38 HG2 PRO 38 -10.818 14.920 11.848 267 HG3 PRO 38 HG3 PRO 38 -12.157 14.495 10.767 268 HD2 PRO 38 HD2 PRO 38 -11.053 16.972 10.765 269 HD3 PRO 38 HD3 PRO 38 -12.780 16.710 10.439 270 HA PRO 39 HA PRO 39 -10.500 16.725 17.093 271 HB2 PRO 39 HB2 PRO 39 -11.255 14.772 18.848 272 HB3 PRO 39 HB3 PRO 39 -12.131 16.307 18.675 273 HG2 PRO 39 HG2 PRO 39 -12.757 13.632 17.507 274 HG3 PRO 39 HG3 PRO 39 -13.841 14.813 18.263 275 HD2 PRO 39 HD2 PRO 39 -13.648 14.574 15.568 276 HD3 PRO 39 HD3 PRO 39 -13.960 16.137 16.356 277 HA PRO 40 HA PRO 40 -7.393 13.679 16.057 278 HB2 PRO 40 HB2 PRO 40 -5.672 13.851 18.160 279 HB3 PRO 40 HB3 PRO 40 -5.812 15.122 16.930 280 HG2 PRO 40 HG2 PRO 40 -7.028 14.988 19.654 281 HG3 PRO 40 HG3 PRO 40 -6.230 16.349 18.843 282 HD2 PRO 40 HD2 PRO 40 -8.935 16.136 18.966 283 HD3 PRO 40 HD3 PRO 40 -8.107 16.874 17.577 284 H GLU 41 H GLU 41 -6.639 11.573 16.548 285 HA GLU 41 HA GLU 41 -7.862 10.252 18.890 286 HB2 GLU 41 HB2 GLU 41 -8.382 8.293 17.474 287 HB3 GLU 41 HB3 GLU 41 -9.240 9.730 16.926 288 HG2 GLU 41 HG2 GLU 41 -7.528 10.086 15.178 289 HG3 GLU 41 HG3 GLU 41 -6.665 8.652 15.729 290 HA PRO 42 HA PRO 42 -3.799 8.561 19.498 291 HB2 PRO 42 HB2 PRO 42 -4.271 6.096 20.563 292 HB3 PRO 42 HB3 PRO 42 -4.547 7.602 21.462 293 HG2 PRO 42 HG2 PRO 42 -6.508 5.874 20.020 294 HG3 PRO 42 HG3 PRO 42 -6.645 6.649 21.608 295 HD2 PRO 42 HD2 PRO 42 -7.813 7.698 19.392 296 HD3 PRO 42 HD3 PRO 42 -7.193 8.719 20.709 297 H GLU 43 H GLU 43 -2.231 7.258 18.536 298 HA GLU 43 HA GLU 43 -3.131 5.306 16.512 299 HB2 GLU 43 HB2 GLU 43 -2.580 7.519 15.454 300 HB3 GLU 43 HB3 GLU 43 -0.933 7.341 16.058 301 HG2 GLU 43 HG2 GLU 43 -0.703 5.218 14.818 302 HG3 GLU 43 HG3 GLU 43 -2.345 5.399 14.207 303 HA PRO 44 HA PRO 44 0.199 3.518 19.246 304 HB2 PRO 44 HB2 PRO 44 -0.867 1.031 19.501 305 HB3 PRO 44 HB3 PRO 44 -1.362 2.393 20.528 306 HG2 PRO 44 HG2 PRO 44 -2.705 1.262 18.113 307 HG3 PRO 44 HG3 PRO 44 -3.409 1.770 19.658 308 HD2 PRO 44 HD2 PRO 44 -3.487 3.347 17.441 309 HD3 PRO 44 HD3 PRO 44 -3.392 4.019 19.086 310 H GLU 45 H GLU 45 1.886 2.127 18.677 311 HA GLU 45 HA GLU 45 1.683 0.730 16.085 312 HB2 GLU 45 HB2 GLU 45 2.825 2.956 15.821 313 HB3 GLU 45 HB3 GLU 45 4.069 2.390 16.937 314 HG2 GLU 45 HG2 GLU 45 4.560 0.494 15.433 315 HG3 GLU 45 HG3 GLU 45 3.320 1.060 14.317 316 HA PRO 46 HA PRO 46 3.449 -2.026 19.410 317 HB2 PRO 46 HB2 PRO 46 2.119 -4.294 18.714 318 HB3 PRO 46 HB3 PRO 46 1.401 -3.046 19.752 319 HG2 PRO 46 HG2 PRO 46 1.014 -3.526 16.831 320 HG3 PRO 46 HG3 PRO 46 -0.187 -3.146 18.080 321 HD2 PRO 46 HD2 PRO 46 0.784 -1.256 16.380 322 HD3 PRO 46 HD3 PRO 46 0.289 -0.875 18.045 323 H VAL 47 H VAL 47 5.093 -3.545 19.227 324 HA VAL 47 HA VAL 47 5.843 -4.396 16.489 325 HB VAL 47 HB VAL 47 7.714 -3.468 18.699 326 HG11 VAL 47 HG11 VAL 47 9.471 -3.708 16.951 327 HG12 VAL 47 HG12 VAL 47 8.273 -4.419 15.869 328 HG13 VAL 47 HG13 VAL 47 8.726 -5.254 17.354 329 HG21 VAL 47 HG21 VAL 47 8.207 -1.595 17.197 330 HG22 VAL 47 HG22 VAL 47 6.481 -1.634 17.553 331 HG23 VAL 47 HG23 VAL 47 7.073 -2.229 16.002 332 H SER 48 H SER 48 6.016 -6.533 16.290 333 HA SER 48 HA SER 48 6.956 -8.185 18.499 334 HB2 SER 48 HB2 SER 48 4.546 -8.072 18.926 335 HB3 SER 48 HB3 SER 48 4.214 -8.577 17.272 336 HG SER 48 HG SER 48 5.035 -10.558 17.709 337 H PHE 49 H PHE 49 7.898 -10.066 17.833 338 HA PHE 49 HA PHE 49 7.601 -10.931 15.050 339 HB2 PHE 49 HB2 PHE 49 9.515 -9.309 15.129 340 HB3 PHE 49 HB3 PHE 49 10.315 -10.375 16.285 341 HD1 PHE 49 HD1 PHE 49 8.968 -10.172 12.819 342 HD2 PHE 49 HD2 PHE 49 11.454 -12.350 15.562 343 HE1 PHE 49 HE1 PHE 49 9.837 -11.542 10.944 344 HE2 PHE 49 HE2 PHE 49 12.321 -13.722 13.688 345 HZ PHE 49 HZ PHE 49 11.513 -13.318 11.380 346 H ASP 50 H ASP 50 6.945 -12.955 15.349 347 HA ASP 50 HA ASP 50 8.371 -14.648 17.315 348 HB2 ASP 50 HB2 ASP 50 6.030 -14.260 17.943 349 HB3 ASP 50 HB3 ASP 50 5.502 -14.840 16.368 350 H ASP 51 H ASP 51 9.807 -15.811 16.184 351 HA ASP 51 HA ASP 51 9.188 -16.741 13.487 352 HB2 ASP 51 HB2 ASP 51 11.428 -15.827 13.989 353 HB3 ASP 51 HB3 ASP 51 11.679 -17.110 15.170 354 H GLU 52 H GLU 52 7.715 -18.368 13.598 355 HA GLU 52 HA GLU 52 8.587 -20.964 14.317 356 HB2 GLU 52 HB2 GLU 52 7.970 -19.880 16.592 357 HB3 GLU 52 HB3 GLU 52 6.302 -19.974 16.026 358 HG2 GLU 52 HG2 GLU 52 6.781 -21.967 17.322 359 HG3 GLU 52 HG3 GLU 52 6.633 -22.427 15.628 360 H VAL 53 H VAL 53 7.593 -22.222 12.868 361 HA VAL 53 HA VAL 53 4.961 -21.334 11.862 362 HB VAL 53 HB VAL 53 5.594 -22.423 9.696 363 HG11 VAL 53 HG11 VAL 53 5.790 -20.005 9.986 364 HG12 VAL 53 HG12 VAL 53 7.139 -20.595 9.015 365 HG13 VAL 53 HG13 VAL 53 7.384 -20.199 10.717 366 HG21 VAL 53 HG21 VAL 53 8.437 -22.385 10.735 367 HG22 VAL 53 HG22 VAL 53 7.818 -23.140 9.265 368 HG23 VAL 53 HG23 VAL 53 7.442 -23.837 10.840 369 H LEU 54 H LEU 54 3.349 -22.809 11.704 370 HA LEU 54 HA LEU 54 3.488 -25.181 13.261 371 HB2 LEU 54 HB2 LEU 54 1.402 -24.129 11.344 372 HB3 LEU 54 HB3 LEU 54 1.189 -25.596 12.296 373 HG LEU 54 HG LEU 54 1.883 -22.925 13.545 374 HD11 LEU 54 HD11 LEU 54 -0.563 -22.891 14.183 375 HD12 LEU 54 HD12 LEU 54 -0.815 -24.208 13.036 376 HD13 LEU 54 HD13 LEU 54 -0.257 -22.636 12.464 377 HD21 LEU 54 HD21 LEU 54 0.872 -25.585 14.594 378 HD22 LEU 54 HD22 LEU 54 0.850 -24.108 15.555 379 HD23 LEU 54 HD23 LEU 54 2.384 -24.776 15.003 380 H GLU 55 H GLU 55 3.522 -24.590 9.767 381 HA GLU 55 HA GLU 55 3.951 -25.954 7.973 382 HB2 GLU 55 HB2 GLU 55 5.571 -27.426 10.065 383 HB3 GLU 55 HB3 GLU 55 5.698 -27.687 8.328 384 HG2 GLU 55 HG2 GLU 55 6.176 -25.036 9.716 385 HG3 GLU 55 HG3 GLU 55 7.449 -26.133 9.194 386 H LEU 56 H LEU 56 1.580 -26.535 9.652 387 HA LEU 56 HA LEU 56 1.298 -29.450 9.357 388 HB2 LEU 56 HB2 LEU 56 -0.400 -27.369 10.749 389 HB3 LEU 56 HB3 LEU 56 -0.872 -29.058 10.586 390 HG LEU 56 HG LEU 56 1.753 -28.201 11.836 391 HD11 LEU 56 HD11 LEU 56 0.694 -28.500 14.007 392 HD12 LEU 56 HD12 LEU 56 -0.827 -28.956 13.240 393 HD13 LEU 56 HD13 LEU 56 -0.223 -27.305 13.091 394 HD21 LEU 56 HD21 LEU 56 1.522 -30.516 12.859 395 HD22 LEU 56 HD22 LEU 56 1.766 -30.507 11.113 396 HD23 LEU 56 HD23 LEU 56 0.156 -30.781 11.773 397 H THR 57 H THR 57 -0.177 -26.394 8.342 398 HA THR 57 HA THR 57 -1.639 -25.863 6.652 399 HB THR 57 HB THR 57 -0.619 -28.317 5.221 400 HG1 THR 57 HG1 THR 57 1.120 -26.892 4.590 401 HG21 THR 57 HG21 THR 57 -0.657 -26.564 3.326 402 HG22 THR 57 HG22 THR 57 -1.616 -25.578 4.428 403 HG23 THR 57 HG23 THR 57 -2.212 -27.155 3.910 404 H ASP 58 H ASP 58 -2.431 -27.969 8.742 405 HA ASP 58 HA ASP 58 -4.432 -29.529 7.288 406 HB2 ASP 58 HB2 ASP 58 -3.688 -29.455 10.221 407 HB3 ASP 58 HB3 ASP 58 -4.906 -30.517 9.524 408 HA PRO 59 HA PRO 59 -7.693 -26.613 8.115 409 HB2 PRO 59 HB2 PRO 59 -9.890 -28.227 8.338 410 HB3 PRO 59 HB3 PRO 59 -9.102 -27.861 6.788 411 HG2 PRO 59 HG2 PRO 59 -8.835 -30.272 8.524 412 HG3 PRO 59 HG3 PRO 59 -8.988 -30.162 6.761 413 HD2 PRO 59 HD2 PRO 59 -6.590 -30.561 7.977 414 HD3 PRO 59 HD3 PRO 59 -6.742 -29.645 6.461 415 H ILE 60 H ILE 60 -7.080 -29.210 10.340 416 HA ILE 60 HA ILE 60 -8.876 -28.583 12.422 417 HB ILE 60 HB ILE 60 -6.110 -29.842 12.499 418 HG12 ILE 60 HG12 ILE 60 -8.829 -31.166 12.701 419 HG13 ILE 60 HG13 ILE 60 -8.006 -30.940 11.161 420 HG21 ILE 60 HG21 ILE 60 -6.637 -29.059 14.741 421 HG22 ILE 60 HG22 ILE 60 -6.924 -30.800 14.698 422 HG23 ILE 60 HG23 ILE 60 -8.284 -29.680 14.618 423 HD11 ILE 60 HD11 ILE 60 -7.186 -33.022 11.668 424 HD12 ILE 60 HD12 ILE 60 -7.356 -32.791 13.405 425 HD13 ILE 60 HD13 ILE 60 -5.985 -32.084 12.549 426 H ALA 61 H ALA 61 -5.547 -27.540 11.776 427 HA ALA 61 HA ALA 61 -5.367 -25.808 14.044 428 HB1 ALA 61 HB1 ALA 61 -3.399 -24.859 12.609 429 HB2 ALA 61 HB2 ALA 61 -3.726 -26.249 11.574 430 HB3 ALA 61 HB3 ALA 61 -3.284 -26.491 13.264 431 HA PRO 62 HA PRO 62 -7.712 -22.532 11.885 432 HB2 PRO 62 HB2 PRO 62 -8.095 -20.843 13.942 433 HB3 PRO 62 HB3 PRO 62 -8.967 -22.387 13.837 434 HG2 PRO 62 HG2 PRO 62 -6.552 -21.687 15.448 435 HG3 PRO 62 HG3 PRO 62 -7.997 -22.597 15.923 436 HD2 PRO 62 HD2 PRO 62 -5.637 -23.797 15.186 437 HD3 PRO 62 HD3 PRO 62 -7.228 -24.566 14.988 438 H GLU 63 H GLU 63 -7.338 -20.347 11.211 439 HA GLU 63 HA GLU 63 -4.575 -19.621 10.979 440 HB2 GLU 63 HB2 GLU 63 -7.127 -18.184 10.216 441 HB3 GLU 63 HB3 GLU 63 -5.517 -17.552 9.877 442 HG2 GLU 63 HG2 GLU 63 -6.217 -18.709 7.900 443 HG3 GLU 63 HG3 GLU 63 -5.023 -19.734 8.683 444 HA PRO 64 HA PRO 64 -4.109 -17.159 14.647 445 HB2 PRO 64 HB2 PRO 64 -2.585 -15.033 13.755 446 HB3 PRO 64 HB3 PRO 64 -1.936 -16.639 14.132 447 HG2 PRO 64 HG2 PRO 64 -2.648 -15.460 11.491 448 HG3 PRO 64 HG3 PRO 64 -1.260 -16.467 11.942 449 HD2 PRO 64 HD2 PRO 64 -3.387 -17.502 10.631 450 HD3 PRO 64 HD3 PRO 64 -2.486 -18.447 11.841 451 H GLU 65 H GLU 65 -5.023 -15.381 11.713 452 HA GLU 65 HA GLU 65 -6.765 -13.642 13.365 453 HB2 GLU 65 HB2 GLU 65 -5.266 -12.937 10.831 454 HB3 GLU 65 HB3 GLU 65 -6.431 -11.890 11.640 455 HG2 GLU 65 HG2 GLU 65 -5.045 -11.909 13.679 456 HG3 GLU 65 HG3 GLU 65 -3.880 -12.961 12.879 457 H LEU 66 H LEU 66 -8.830 -13.349 12.720 458 HA LEU 66 HA LEU 66 -9.899 -15.197 10.762 459 HB2 LEU 66 HB2 LEU 66 -11.174 -13.205 12.648 460 HB3 LEU 66 HB3 LEU 66 -12.110 -14.094 11.459 461 HG LEU 66 HG LEU 66 -12.227 -15.194 13.650 462 HD11 LEU 66 HD11 LEU 66 -10.469 -16.902 11.884 463 HD12 LEU 66 HD12 LEU 66 -12.153 -16.547 11.499 464 HD13 LEU 66 HD13 LEU 66 -11.753 -17.427 12.974 465 HD21 LEU 66 HD21 LEU 66 -9.904 -14.373 14.372 466 HD22 LEU 66 HD22 LEU 66 -9.263 -15.755 13.481 467 HD23 LEU 66 HD23 LEU 66 -10.348 -16.014 14.848 468 HA PRO 67 HA PRO 67 -10.200 -12.514 7.238 469 HB2 PRO 67 HB2 PRO 67 -13.102 -13.170 7.010 470 HB3 PRO 67 HB3 PRO 67 -11.805 -13.362 5.815 471 HG2 PRO 67 HG2 PRO 67 -12.803 -15.467 7.053 472 HG3 PRO 67 HG3 PRO 67 -11.060 -15.340 6.747 473 HD2 PRO 67 HD2 PRO 67 -12.559 -14.871 9.313 474 HD3 PRO 67 HD3 PRO 67 -11.002 -15.692 9.053 475 HA PRO 68 HA PRO 68 -11.878 -8.662 8.820 476 HB2 PRO 68 HB2 PRO 68 -12.019 -7.137 6.561 477 HB3 PRO 68 HB3 PRO 68 -10.488 -7.528 7.369 478 HG2 PRO 68 HG2 PRO 68 -11.739 -8.801 4.977 479 HG3 PRO 68 HG3 PRO 68 -10.050 -8.334 5.249 480 HD2 PRO 68 HD2 PRO 68 -10.884 -10.900 5.523 481 HD3 PRO 68 HD3 PRO 68 -9.594 -10.216 6.539 482 H LEU 69 H LEU 69 -13.817 -7.489 8.984 483 HA LEU 69 HA LEU 69 -16.195 -8.865 8.253 484 HB2 LEU 69 HB2 LEU 69 -15.532 -6.266 9.585 485 HB3 LEU 69 HB3 LEU 69 -17.163 -6.460 8.949 486 HG LEU 69 HG LEU 69 -17.229 -8.693 10.220 487 HD11 LEU 69 HD11 LEU 69 -14.792 -7.417 11.497 488 HD12 LEU 69 HD12 LEU 69 -14.843 -8.954 10.636 489 HD13 LEU 69 HD13 LEU 69 -15.674 -8.783 12.181 490 HD21 LEU 69 HD21 LEU 69 -16.949 -6.134 11.831 491 HD22 LEU 69 HD22 LEU 69 -17.823 -7.583 12.331 492 HD23 LEU 69 HD23 LEU 69 -18.402 -6.634 10.963 493 H GLU 70 H GLU 70 -15.133 -5.587 7.276 494 HA GLU 70 HA GLU 70 -16.684 -5.911 4.780 495 HB2 GLU 70 HB2 GLU 70 -15.700 -3.397 6.154 496 HB3 GLU 70 HB3 GLU 70 -16.609 -3.439 4.644 497 HG2 GLU 70 HG2 GLU 70 -17.593 -4.530 7.300 498 HG3 GLU 70 HG3 GLU 70 -18.068 -2.984 6.607 499 H THR 71 H THR 71 -13.703 -4.259 5.874 500 HA THR 71 HA THR 71 -12.207 -5.405 3.662 501 HB THR 71 HB THR 71 -13.242 -3.456 2.597 502 HG1 THR 71 HG1 THR 71 -11.295 -3.724 1.773 503 HG21 THR 71 HG21 THR 71 -13.560 -2.119 4.692 504 HG22 THR 71 HG22 THR 71 -12.824 -1.192 3.384 505 HG23 THR 71 HG23 THR 71 -11.826 -1.799 4.705 506 H VAL 72 H VAL 72 -9.933 -5.089 3.829 507 HA VAL 72 HA VAL 72 -8.936 -5.161 6.481 508 HB VAL 72 HB VAL 72 -7.514 -4.855 3.819 509 HG11 VAL 72 HG11 VAL 72 -5.525 -5.762 5.173 510 HG12 VAL 72 HG12 VAL 72 -6.432 -5.298 6.612 511 HG13 VAL 72 HG13 VAL 72 -5.948 -4.070 5.443 512 HG21 VAL 72 HG21 VAL 72 -8.084 -7.219 5.628 513 HG22 VAL 72 HG22 VAL 72 -7.001 -7.282 4.236 514 HG23 VAL 72 HG23 VAL 72 -8.717 -6.949 4.004 515 H GLY 73 H GLY 73 -8.998 -2.638 3.987 516 HA2 GLY 73 HA2 GLY 73 -8.903 -0.335 4.204 517 HA3 GLY 73 HA3 GLY 73 -8.842 -0.538 5.951 518 H ASP 74 H ASP 74 -6.599 -2.079 3.723 519 HA ASP 74 HA ASP 74 -4.484 -0.147 4.363 520 HB2 ASP 74 HB2 ASP 74 -4.565 -2.121 6.047 521 HB3 ASP 74 HB3 ASP 74 -3.951 -3.088 4.706 522 H ILE 75 H ILE 75 -2.682 -0.264 2.955 523 HA ILE 75 HA ILE 75 -3.368 -1.301 0.323 524 HB ILE 75 HB ILE 75 -2.578 1.076 0.771 525 HG12 ILE 75 HG12 ILE 75 -1.037 1.073 -1.266 526 HG13 ILE 75 HG13 ILE 75 -1.208 -0.676 -1.283 527 HG21 ILE 75 HG21 ILE 75 -0.276 1.544 1.114 528 HG22 ILE 75 HG22 ILE 75 0.190 -0.133 0.831 529 HG23 ILE 75 HG23 ILE 75 -0.683 0.303 2.301 530 HD11 ILE 75 HD11 ILE 75 -2.837 0.670 -2.755 531 HD12 ILE 75 HD12 ILE 75 -3.617 1.147 -1.245 532 HD13 ILE 75 HD13 ILE 75 -3.543 -0.557 -1.699 533 H ASP 76 H ASP 76 -1.986 -2.708 2.896 534 HA ASP 76 HA ASP 76 0.154 -4.063 1.398 535 HB2 ASP 76 HB2 ASP 76 -0.397 -3.987 4.371 536 HB3 ASP 76 HB3 ASP 76 0.949 -4.826 3.601 537 H VAL 77 H VAL 77 -2.911 -4.546 1.408 538 HA VAL 77 HA VAL 77 -3.440 -7.013 2.666 539 HB VAL 77 HB VAL 77 -5.375 -7.163 1.118 540 HG11 VAL 77 HG11 VAL 77 -4.778 -4.517 2.452 541 HG12 VAL 77 HG12 VAL 77 -5.703 -5.872 3.093 542 HG13 VAL 77 HG13 VAL 77 -6.359 -4.904 1.774 543 HG21 VAL 77 HG21 VAL 77 -5.737 -5.221 -0.446 544 HG22 VAL 77 HG22 VAL 77 -4.403 -6.270 -0.926 545 HG23 VAL 77 HG23 VAL 77 -4.072 -4.724 -0.143 546 H TYR 78 H TYR 78 -2.939 -9.024 2.203 547 HA TYR 78 HA TYR 78 -1.937 -9.691 -0.503 548 HB2 TYR 78 HB2 TYR 78 -0.137 -9.596 1.277 549 HB3 TYR 78 HB3 TYR 78 -0.956 -10.938 2.075 550 HD1 TYR 78 HD1 TYR 78 0.789 -9.886 -1.028 551 HD2 TYR 78 HD2 TYR 78 -0.824 -13.178 1.210 552 HE1 TYR 78 HE1 TYR 78 1.907 -11.478 -2.564 553 HE2 TYR 78 HE2 TYR 78 0.295 -14.771 -0.325 554 HH TYR 78 HH TYR 78 2.639 -14.358 -2.010 555 H SER 79 H SER 79 -3.000 -11.244 2.522 556 HA SER 79 HA SER 79 -3.979 -13.606 1.381 557 HB2 SER 79 HB2 SER 79 -3.563 -13.233 3.820 558 HB3 SER 79 HB3 SER 79 -5.023 -12.247 3.876 559 HG SER 79 HG SER 79 -4.909 -14.936 2.965 560 HA PRO 80 HA PRO 80 -7.658 -11.990 -0.638 561 HB2 PRO 80 HB2 PRO 80 -9.037 -14.290 -1.101 562 HB3 PRO 80 HB3 PRO 80 -7.592 -13.833 -2.026 563 HG2 PRO 80 HG2 PRO 80 -7.846 -15.723 0.271 564 HG3 PRO 80 HG3 PRO 80 -6.942 -15.906 -1.244 565 HD2 PRO 80 HD2 PRO 80 -5.731 -15.181 1.077 566 HD3 PRO 80 HD3 PRO 80 -5.168 -14.603 -0.505 567 HA PRO 81 HA PRO 81 -10.694 -11.662 2.648 568 HB2 PRO 81 HB2 PRO 81 -12.883 -10.779 1.317 569 HB3 PRO 81 HB3 PRO 81 -11.450 -9.760 1.561 570 HG2 PRO 81 HG2 PRO 81 -12.263 -11.330 -0.844 571 HG3 PRO 81 HG3 PRO 81 -11.634 -9.676 -0.741 572 HD2 PRO 81 HD2 PRO 81 -10.055 -11.797 -1.407 573 HD3 PRO 81 HD3 PRO 81 -9.434 -10.377 -0.535 574 H GLU 82 H GLU 82 -12.785 -12.532 3.407 575 HA GLU 82 HA GLU 82 -14.276 -14.233 3.768 576 HB2 GLU 82 HB2 GLU 82 -14.173 -13.992 0.810 577 HB3 GLU 82 HB3 GLU 82 -14.769 -15.537 1.402 578 HG2 GLU 82 HG2 GLU 82 -16.657 -14.036 1.121 579 HG3 GLU 82 HG3 GLU 82 -16.402 -14.294 2.843 580 HA PRO 83 HA PRO 83 -11.925 -17.937 4.310 581 HB2 PRO 83 HB2 PRO 83 -13.707 -19.992 4.075 582 HB3 PRO 83 HB3 PRO 83 -13.685 -18.885 5.464 583 HG2 PRO 83 HG2 PRO 83 -15.445 -18.856 3.052 584 HG3 PRO 83 HG3 PRO 83 -15.865 -18.614 4.758 585 HD2 PRO 83 HD2 PRO 83 -15.571 -16.531 3.049 586 HD3 PRO 83 HD3 PRO 83 -15.137 -16.407 4.768 587 H GLU 84 H GLU 84 -10.952 -19.774 3.310 588 HA GLU 84 HA GLU 84 -10.448 -19.519 0.556 589 HB2 GLU 84 HB2 GLU 84 -8.909 -20.621 2.161 590 HB3 GLU 84 HB3 GLU 84 -10.043 -21.960 2.312 591 HG2 GLU 84 HG2 GLU 84 -8.290 -22.563 0.722 592 HG3 GLU 84 HG3 GLU 84 -9.820 -22.396 -0.129 593 H SER 85 H SER 85 -12.556 -21.787 2.325 594 HA SER 85 HA SER 85 -13.439 -23.239 0.052 595 HB2 SER 85 HB2 SER 85 -14.765 -22.793 2.738 596 HB3 SER 85 HB3 SER 85 -15.299 -23.966 1.538 597 HG SER 85 HG SER 85 -13.852 -24.799 3.181 598 H GLU 86 H GLU 86 -15.195 -22.965 -1.287 599 HA GLU 86 HA GLU 86 -16.693 -21.767 -2.549 600 HB2 GLU 86 HB2 GLU 86 -17.998 -22.330 -0.432 601 HB3 GLU 86 HB3 GLU 86 -17.663 -20.683 0.103 602 HG2 GLU 86 HG2 GLU 86 -18.727 -19.801 -1.941 603 HG3 GLU 86 HG3 GLU 86 -19.070 -21.445 -2.472 604 HA PRO 87 HA PRO 87 -13.894 -17.921 -2.006 605 HB2 PRO 87 HB2 PRO 87 -13.780 -18.413 -4.960 606 HB3 PRO 87 HB3 PRO 87 -12.495 -17.883 -3.854 607 HG2 PRO 87 HG2 PRO 87 -12.525 -20.361 -4.713 608 HG3 PRO 87 HG3 PRO 87 -12.172 -20.022 -3.005 609 HD2 PRO 87 HD2 PRO 87 -14.722 -21.042 -4.235 610 HD3 PRO 87 HD3 PRO 87 -13.930 -21.526 -2.715 611 H ALA 88 H ALA 88 -16.320 -18.732 -4.483 612 HA ALA 88 HA ALA 88 -17.887 -17.450 -5.590 613 HB1 ALA 88 HB1 ALA 88 -18.052 -16.345 -2.776 614 HB2 ALA 88 HB2 ALA 88 -18.981 -17.684 -3.450 615 HB3 ALA 88 HB3 ALA 88 -19.254 -16.043 -4.034 616 H TYR 89 H TYR 89 -16.369 -16.382 -6.987 617 HA TYR 89 HA TYR 89 -15.432 -14.557 -8.012 618 HB2 TYR 89 HB2 TYR 89 -17.401 -13.111 -6.220 619 HB3 TYR 89 HB3 TYR 89 -16.484 -12.338 -7.510 620 HD1 TYR 89 HD1 TYR 89 -19.200 -14.684 -6.714 621 HD2 TYR 89 HD2 TYR 89 -16.916 -12.870 -9.867 622 HE1 TYR 89 HE1 TYR 89 -20.885 -15.438 -8.370 623 HE2 TYR 89 HE2 TYR 89 -18.601 -13.624 -11.523 624 HH TYR 89 HH TYR 89 -21.112 -15.861 -10.699 625 H THR 90 H THR 90 -13.900 -15.651 -6.047 626 HA THR 90 HA THR 90 -12.449 -13.309 -5.031 627 HB THR 90 HB THR 90 -13.031 -15.781 -3.371 628 HG1 THR 90 HG1 THR 90 -14.162 -14.165 -2.106 629 HG21 THR 90 HG21 THR 90 -10.835 -14.812 -2.874 630 HG22 THR 90 HG22 THR 90 -11.956 -14.451 -1.560 631 HG23 THR 90 HG23 THR 90 -11.552 -13.206 -2.742 632 HA PRO 91 HA PRO 91 -9.452 -15.849 -7.414 633 HB2 PRO 91 HB2 PRO 91 -7.565 -13.804 -6.315 634 HB3 PRO 91 HB3 PRO 91 -7.742 -14.395 -7.979 635 HG2 PRO 91 HG2 PRO 91 -8.661 -12.021 -7.325 636 HG3 PRO 91 HG3 PRO 91 -9.612 -13.086 -8.379 637 HD2 PRO 91 HD2 PRO 91 -10.003 -12.497 -5.456 638 HD3 PRO 91 HD3 PRO 91 -11.222 -12.671 -6.743 639 HA PRO 92 HA PRO 92 -7.910 -18.119 -3.810 640 HB2 PRO 92 HB2 PRO 92 -6.453 -20.052 -5.022 641 HB3 PRO 92 HB3 PRO 92 -8.227 -20.036 -5.075 642 HG2 PRO 92 HG2 PRO 92 -6.270 -19.125 -7.137 643 HG3 PRO 92 HG3 PRO 92 -7.746 -20.091 -7.333 644 HD2 PRO 92 HD2 PRO 92 -7.667 -17.410 -7.845 645 HD3 PRO 92 HD3 PRO 92 -9.132 -18.237 -7.274 646 HA PRO 93 HA PRO 93 -3.874 -16.388 -2.893 647 HB2 PRO 93 HB2 PRO 93 -3.196 -18.953 -1.529 648 HB3 PRO 93 HB3 PRO 93 -3.175 -17.298 -0.892 649 HG2 PRO 93 HG2 PRO 93 -5.075 -18.984 -0.178 650 HG3 PRO 93 HG3 PRO 93 -5.453 -17.280 -0.501 651 HD2 PRO 93 HD2 PRO 93 -5.928 -19.679 -2.255 652 HD3 PRO 93 HD3 PRO 93 -6.978 -18.274 -1.958 653 H ALA 94 H ALA 94 -1.776 -16.416 -3.720 654 HA ALA 94 HA ALA 94 -0.777 -18.827 -5.039 655 HB1 ALA 94 HB1 ALA 94 -0.726 -16.295 -6.635 656 HB2 ALA 94 HB2 ALA 94 -2.196 -17.271 -6.628 657 HB3 ALA 94 HB3 ALA 94 -0.675 -17.969 -7.189 658 H ALA 95 H ALA 95 1.440 -18.814 -5.428 659 HA ALA 95 HA ALA 95 3.002 -16.519 -4.504 660 HB1 ALA 95 HB1 ALA 95 3.889 -19.139 -3.434 661 HB2 ALA 95 HB2 ALA 95 2.431 -18.457 -2.710 662 HB3 ALA 95 HB3 ALA 95 3.938 -17.539 -2.693 663 HA PRO 96 HA PRO 96 4.685 -18.365 -8.444 664 HB2 PRO 96 HB2 PRO 96 6.112 -15.732 -8.350 665 HB3 PRO 96 HB3 PRO 96 5.314 -16.536 -9.719 666 HG2 PRO 96 HG2 PRO 96 4.154 -14.492 -8.544 667 HG3 PRO 96 HG3 PRO 96 3.195 -15.909 -9.018 668 HD2 PRO 96 HD2 PRO 96 4.171 -15.126 -6.281 669 HD3 PRO 96 HD3 PRO 96 2.603 -15.819 -6.763 670 H VAL 97 H VAL 97 6.498 -19.558 -8.611 671 HA VAL 97 HA VAL 97 8.238 -19.952 -6.461 672 HB VAL 97 HB VAL 97 9.659 -21.232 -8.035 673 HG11 VAL 97 HG11 VAL 97 6.660 -21.591 -8.241 674 HG12 VAL 97 HG12 VAL 97 7.759 -22.374 -7.107 675 HG13 VAL 97 HG13 VAL 97 7.822 -22.786 -8.821 676 HG21 VAL 97 HG21 VAL 97 8.732 -21.421 -10.426 677 HG22 VAL 97 HG22 VAL 97 9.602 -19.937 -10.042 678 HG23 VAL 97 HG23 VAL 97 7.839 -19.938 -10.082 679 H PHE 98 H PHE 98 8.649 -17.948 -9.366 680 HA PHE 98 HA PHE 98 11.327 -17.135 -8.728 681 HB2 PHE 98 HB2 PHE 98 9.257 -15.899 -10.565 682 HB3 PHE 98 HB3 PHE 98 10.944 -15.394 -10.468 683 HD1 PHE 98 HD1 PHE 98 8.616 -17.932 -11.687 684 HD2 PHE 98 HD2 PHE 98 12.763 -16.954 -11.146 685 HE1 PHE 98 HE1 PHE 98 9.246 -19.734 -13.271 686 HE2 PHE 98 HE2 PHE 98 13.396 -18.756 -12.728 687 HZ PHE 98 HZ PHE 98 11.638 -20.146 -13.791 688 H ASP 99 H ASP 99 8.153 -15.574 -8.499 689 HA ASP 99 HA ASP 99 7.335 -13.907 -7.103 690 HB2 ASP 99 HB2 ASP 99 8.505 -15.246 -5.278 691 HB3 ASP 99 HB3 ASP 99 9.890 -14.182 -5.488 692 H ARG 100 H ARG 100 8.216 -13.165 -9.342 693 HA ARG 100 HA ARG 100 9.496 -10.569 -8.911 694 HB2 ARG 100 HB2 ARG 100 10.490 -12.604 -10.920 695 HB3 ARG 100 HB3 ARG 100 10.942 -10.899 -10.935 696 HG2 ARG 100 HG2 ARG 100 11.908 -11.094 -8.700 697 HG3 ARG 100 HG3 ARG 100 11.381 -12.773 -8.592 698 HD2 ARG 100 HD2 ARG 100 13.735 -12.718 -9.214 699 HD3 ARG 100 HD3 ARG 100 12.787 -13.312 -10.573 700 HE ARG 100 HE ARG 100 13.114 -10.487 -10.753 701 HH11 ARG 100 HH11 ARG 100 14.886 -13.478 -11.187 702 HH12 ARG 100 HH12 ARG 100 15.968 -12.801 -12.359 703 HH21 ARG 100 HH21 ARG 100 14.534 -9.651 -12.283 704 HH22 ARG 100 HH22 ARG 100 15.768 -10.652 -12.974 705 H ASP 101 H ASP 101 7.627 -12.775 -10.870 706 HA ASP 101 HA ASP 101 6.947 -11.091 -13.022 707 HB2 ASP 101 HB2 ASP 101 5.655 -13.500 -11.746 708 HB3 ASP 101 HB3 ASP 101 4.944 -12.696 -13.149 709 H GLU 102 H GLU 102 5.232 -9.723 -13.365 710 HA GLU 102 HA GLU 102 3.309 -9.249 -11.200 711 HB2 GLU 102 HB2 GLU 102 5.034 -7.067 -12.402 712 HB3 GLU 102 HB3 GLU 102 3.670 -6.803 -11.319 713 HG2 GLU 102 HG2 GLU 102 4.800 -8.135 -9.571 714 HG3 GLU 102 HG3 GLU 102 6.172 -8.383 -10.651 715 H VAL 103 H VAL 103 1.312 -8.715 -11.932 716 HA VAL 103 HA VAL 103 0.990 -7.780 -14.696 717 HB VAL 103 HB VAL 103 -0.773 -9.464 -15.150 718 HG11 VAL 103 HG11 VAL 103 1.638 -9.770 -15.829 719 HG12 VAL 103 HG12 VAL 103 0.737 -11.277 -15.654 720 HG13 VAL 103 HG13 VAL 103 1.854 -10.766 -14.390 721 HG21 VAL 103 HG21 VAL 103 -0.856 -11.492 -13.689 722 HG22 VAL 103 HG22 VAL 103 -1.406 -10.038 -12.854 723 HG23 VAL 103 HG23 VAL 103 0.208 -10.679 -12.543 724 H ALA 104 H ALA 104 -0.888 -6.613 -15.079 725 HA ALA 104 HA ALA 104 -2.648 -5.235 -14.591 726 HB1 ALA 104 HB1 ALA 104 -3.339 -6.968 -12.228 727 HB2 ALA 104 HB2 ALA 104 -3.590 -7.552 -13.873 728 HB3 ALA 104 HB3 ALA 104 -4.418 -6.098 -13.318 729 H GLU 105 H GLU 105 -0.732 -3.880 -13.972 730 HA GLU 105 HA GLU 105 0.195 -2.247 -12.636 731 HB2 GLU 105 HB2 GLU 105 -2.454 -2.041 -12.178 732 HB3 GLU 105 HB3 GLU 105 -1.949 -2.531 -10.562 733 HG2 GLU 105 HG2 GLU 105 -1.921 -0.116 -10.604 734 HG3 GLU 105 HG3 GLU 105 -0.242 -0.654 -10.635 735 H GLN 106 H GLN 106 1.187 -1.881 -10.469 736 HA GLN 106 HA GLN 106 2.390 -4.281 -9.480 737 HB2 GLN 106 HB2 GLN 106 3.545 -2.805 -7.896 738 HB3 GLN 106 HB3 GLN 106 3.608 -2.144 -9.527 739 HG2 GLN 106 HG2 GLN 106 1.612 -0.716 -8.942 740 HG3 GLN 106 HG3 GLN 106 1.771 -1.277 -7.279 741 HE21 GLN 106 HE21 GLN 106 3.164 -0.072 -5.966 742 HE22 GLN 106 HE22 GLN 106 4.329 1.018 -6.544 743 H LEU 107 H LEU 107 -0.485 -2.607 -8.735 744 HA LEU 107 HA LEU 107 -0.934 -2.942 -6.040 745 HB2 LEU 107 HB2 LEU 107 -2.499 -1.831 -7.617 746 HB3 LEU 107 HB3 LEU 107 -2.936 -3.407 -8.275 747 HG LEU 107 HG LEU 107 -3.620 -4.053 -5.892 748 HD11 LEU 107 HD11 LEU 107 -3.290 -1.059 -5.559 749 HD12 LEU 107 HD12 LEU 107 -2.483 -2.333 -4.639 750 HD13 LEU 107 HD13 LEU 107 -4.217 -2.071 -4.449 751 HD21 LEU 107 HD21 LEU 107 -5.040 -1.916 -7.494 752 HD22 LEU 107 HD22 LEU 107 -5.772 -2.654 -6.070 753 HD23 LEU 107 HD23 LEU 107 -5.360 -3.651 -7.466 754 H VAL 108 H VAL 108 -1.689 -5.361 -8.607 755 HA VAL 108 HA VAL 108 -1.427 -7.472 -6.560 756 HB VAL 108 HB VAL 108 -3.324 -8.675 -7.601 757 HG11 VAL 108 HG11 VAL 108 -4.151 -5.882 -6.786 758 HG12 VAL 108 HG12 VAL 108 -3.572 -7.085 -5.634 759 HG13 VAL 108 HG13 VAL 108 -5.047 -7.381 -6.554 760 HG21 VAL 108 HG21 VAL 108 -4.826 -7.454 -9.141 761 HG22 VAL 108 HG22 VAL 108 -3.221 -7.632 -9.845 762 HG23 VAL 108 HG23 VAL 108 -3.712 -6.088 -9.149 763 H GLY 109 H GLY 109 -0.999 -9.603 -7.430 764 HA2 GLY 109 HA2 GLY 109 -0.272 -10.054 -10.145 765 HA3 GLY 109 HA3 GLY 109 1.161 -9.732 -9.171 766 H VAL 110 H VAL 110 -1.732 -11.769 -9.339 767 HA VAL 110 HA VAL 110 -0.172 -13.987 -8.167 768 HB VAL 110 HB VAL 110 -2.167 -14.710 -6.887 769 HG11 VAL 110 HG11 VAL 110 -1.961 -13.042 -5.124 770 HG12 VAL 110 HG12 VAL 110 -1.330 -11.862 -6.272 771 HG13 VAL 110 HG13 VAL 110 -0.381 -13.292 -5.869 772 HG21 VAL 110 HG21 VAL 110 -3.311 -11.992 -7.610 773 HG22 VAL 110 HG22 VAL 110 -4.078 -13.239 -6.625 774 HG23 VAL 110 HG23 VAL 110 -3.837 -13.504 -8.352 775 H SER 111 H SER 111 -0.954 -16.099 -8.637 776 HA SER 111 HA SER 111 -1.913 -16.366 -11.354 777 HB2 SER 111 HB2 SER 111 -0.134 -17.841 -10.584 778 HB3 SER 111 HB3 SER 111 -1.147 -18.424 -9.267 779 HG SER 111 HG SER 111 -1.832 -18.615 -12.015 780 H ALA 112 H ALA 112 -3.787 -17.623 -11.966 781 HA ALA 112 HA ALA 112 -5.739 -18.289 -9.920 782 HB1 ALA 112 HB1 ALA 112 -6.534 -16.117 -10.097 783 HB2 ALA 112 HB2 ALA 112 -7.460 -16.909 -11.372 784 HB3 ALA 112 HB3 ALA 112 -6.031 -15.958 -11.779 785 H ALA 113 H ALA 113 -7.405 -19.663 -10.719 786 HA ALA 113 HA ALA 113 -7.342 -20.431 -13.535 787 HB1 ALA 113 HB1 ALA 113 -7.066 -22.619 -11.502 788 HB2 ALA 113 HB2 ALA 113 -5.631 -21.805 -12.123 789 HB3 ALA 113 HB3 ALA 113 -6.712 -22.653 -13.228 790 H SER 114 H SER 114 -9.176 -21.585 -14.202 791 HA SER 114 HA SER 114 -11.492 -21.242 -12.436 792 HB2 SER 114 HB2 SER 114 -11.585 -20.328 -14.734 793 HB3 SER 114 HB3 SER 114 -11.367 -21.950 -15.382 794 HG SER 114 HG SER 114 -13.611 -20.999 -15.034 795 H ALA 115 H ALA 115 -10.045 -23.211 -11.410 796 HA ALA 115 HA ALA 115 -11.726 -25.551 -11.788 797 HB1 ALA 115 HB1 ALA 115 -10.130 -27.025 -12.533 798 HB2 ALA 115 HB2 ALA 115 -8.801 -26.132 -11.793 799 HB3 ALA 115 HB3 ALA 115 -9.516 -25.562 -13.302 800 H ALA 116 H ALA 116 -11.548 -27.035 -10.011 801 HA ALA 116 HA ALA 116 -9.808 -26.400 -7.810 802 HB1 ALA 116 HB1 ALA 116 -12.767 -26.228 -7.256 803 HB2 ALA 116 HB2 ALA 116 -11.827 -24.795 -7.671 804 HB3 ALA 116 HB3 ALA 116 -11.426 -25.723 -6.228 805 H ALA 117 H ALA 117 -9.721 -28.109 -6.300 806 HA ALA 117 HA ALA 117 -11.466 -30.413 -6.847 807 HB1 ALA 117 HB1 ALA 117 -8.510 -30.781 -6.384 808 HB2 ALA 117 HB2 ALA 117 -9.166 -30.560 -8.005 809 HB3 ALA 117 HB3 ALA 117 -9.675 -31.936 -7.029 810 H SER 118 H SER 118 -12.573 -29.931 -4.910 811 HA SER 118 HA SER 118 -11.363 -31.028 -2.534 812 HB2 SER 118 HB2 SER 118 -10.536 -28.719 -2.399 813 HB3 SER 118 HB3 SER 118 -12.180 -28.111 -2.585 814 HG SER 118 HG SER 118 -12.706 -29.227 -0.650 815 H ALA 119 H ALA 119 -12.894 -31.780 -1.122 816 HA ALA 119 HA ALA 119 -15.605 -31.866 -2.108 817 HB1 ALA 119 HB1 ALA 119 -15.973 -33.295 -0.055 818 HB2 ALA 119 HB2 ALA 119 -14.266 -33.067 0.326 819 HB3 ALA 119 HB3 ALA 119 -14.736 -33.897 -1.157 820 H PHE 120 H PHE 120 -17.458 -31.468 -0.556 821 HA PHE 120 HA PHE 120 -16.939 -29.032 1.045 822 HB2 PHE 120 HB2 PHE 120 -19.404 -29.815 -0.536 823 HB3 PHE 120 HB3 PHE 120 -19.295 -28.409 0.526 824 HD1 PHE 120 HD1 PHE 120 -18.286 -29.861 -2.683 825 HD2 PHE 120 HD2 PHE 120 -17.801 -26.521 -0.030 826 HE1 PHE 120 HE1 PHE 120 -17.254 -28.552 -4.520 827 HE2 PHE 120 HE2 PHE 120 -16.769 -25.211 -1.866 828 HZ PHE 120 HZ PHE 120 -16.496 -26.227 -4.112 829 H GLY 121 H GLY 121 -18.061 -28.806 3.009 830 HA2 GLY 121 HA2 GLY 121 -19.310 -29.478 4.860 831 HA3 GLY 121 HA3 GLY 121 -19.784 -30.930 3.982 832 H SER 122 H SER 122 -16.736 -29.482 5.127 833 HA SER 122 HA SER 122 -15.491 -32.016 5.622 834 HB2 SER 122 HB2 SER 122 -13.656 -30.728 6.513 835 HB3 SER 122 HB3 SER 122 -14.260 -29.896 5.084 836 HG SER 122 HG SER 122 -14.910 -28.298 6.303 837 H LEU 123 H LEU 123 -14.719 -32.730 7.735 838 HA LEU 123 HA LEU 123 -15.050 -33.401 9.902 839 HB2 LEU 123 HB2 LEU 123 -14.724 -30.891 10.261 840 HB3 LEU 123 HB3 LEU 123 -16.477 -30.777 10.361 841 HG LEU 123 HG LEU 123 -16.385 -32.544 12.184 842 HD11 LEU 123 HD11 LEU 123 -13.426 -31.974 11.876 843 HD12 LEU 123 HD12 LEU 123 -14.234 -33.541 11.831 844 HD13 LEU 123 HD13 LEU 123 -14.114 -32.656 13.350 845 HD21 LEU 123 HD21 LEU 123 -15.489 -30.899 13.899 846 HD22 LEU 123 HD22 LEU 123 -16.717 -30.249 12.814 847 HD23 LEU 123 HD23 LEU 123 -15.016 -29.867 12.548 848 H SER 124 H SER 124 -16.584 -34.414 11.209 849 HA SER 124 HA SER 124 -19.399 -34.234 10.343 850 HB2 SER 124 HB2 SER 124 -17.942 -36.278 9.471 851 HB3 SER 124 HB3 SER 124 -18.293 -36.910 11.074 852 HG SER 124 HG SER 124 -20.119 -37.461 10.180 853 H SER 125 H SER 125 -17.398 -36.030 12.703 854 HA SER 125 HA SER 125 -18.937 -34.816 14.866 855 HB2 SER 125 HB2 SER 125 -18.561 -37.793 14.509 856 HB3 SER 125 HB3 SER 125 -19.210 -37.030 15.958 857 HG SER 125 HG SER 125 -21.003 -37.384 14.839 858 H ALA 126 H ALA 126 -17.814 -34.575 16.766 859 HA ALA 126 HA ALA 126 -14.974 -34.583 16.579 860 HB1 ALA 126 HB1 ALA 126 -15.117 -33.184 18.351 861 HB2 ALA 126 HB2 ALA 126 -16.041 -34.352 19.298 862 HB3 ALA 126 HB3 ALA 126 -16.867 -33.288 18.156 863 H LEU 127 H LEU 127 -14.033 -35.438 19.020 864 HA LEU 127 HA LEU 127 -14.927 -38.074 19.661 865 HB2 LEU 127 HB2 LEU 127 -12.916 -39.296 18.945 866 HB3 LEU 127 HB3 LEU 127 -13.766 -38.609 17.565 867 HG LEU 127 HG LEU 127 -11.537 -37.041 18.870 868 HD11 LEU 127 HD11 LEU 127 -11.198 -39.235 16.801 869 HD12 LEU 127 HD12 LEU 127 -10.571 -39.253 18.450 870 HD13 LEU 127 HD13 LEU 127 -9.942 -38.091 17.279 871 HD21 LEU 127 HD21 LEU 127 -12.872 -37.157 16.157 872 HD22 LEU 127 HD22 LEU 127 -11.281 -36.416 16.344 873 HD23 LEU 127 HD23 LEU 127 -12.661 -35.768 17.222 874 H LEU 128 H LEU 128 -14.492 -35.688 21.079 875 HA LEU 128 HA LEU 128 -12.040 -35.713 22.540 876 HB2 LEU 128 HB2 LEU 128 -14.723 -34.403 22.840 877 HB3 LEU 128 HB3 LEU 128 -13.562 -34.322 24.167 878 HG LEU 128 HG LEU 128 -11.871 -33.477 22.417 879 HD11 LEU 128 HD11 LEU 128 -12.985 -34.072 20.375 880 HD12 LEU 128 HD12 LEU 128 -13.024 -32.311 20.472 881 HD13 LEU 128 HD13 LEU 128 -14.464 -33.249 20.868 882 HD21 LEU 128 HD21 LEU 128 -12.809 -31.157 22.510 883 HD22 LEU 128 HD22 LEU 128 -12.855 -31.977 24.071 884 HD23 LEU 128 HD23 LEU 128 -14.326 -31.832 23.109 885 H MET 129 H MET 129 -11.545 -36.596 24.500 886 HA MET 129 HA MET 129 -13.575 -38.293 25.812 887 HB2 MET 129 HB2 MET 129 -12.003 -39.660 24.403 888 HB3 MET 129 HB3 MET 129 -10.678 -39.083 25.411 889 HG2 MET 129 HG2 MET 129 -11.717 -40.058 27.398 890 HG3 MET 129 HG3 MET 129 -13.114 -40.564 26.446 891 HE1 MET 129 HE1 MET 129 -9.495 -40.937 27.357 892 HE2 MET 129 HE2 MET 129 -9.210 -40.607 25.650 893 HE3 MET 129 HE3 MET 129 -8.835 -42.198 26.308 894 HA PRO 130 HA PRO 130 -11.507 -35.432 28.865 895 HB2 PRO 130 HB2 PRO 130 -13.735 -34.715 30.241 896 HB3 PRO 130 HB3 PRO 130 -13.253 -33.923 28.727 897 HG2 PRO 130 HG2 PRO 130 -15.290 -36.059 29.177 898 HG3 PRO 130 HG3 PRO 130 -15.391 -34.598 28.177 899 HD2 PRO 130 HD2 PRO 130 -14.854 -37.048 27.118 900 HD3 PRO 130 HD3 PRO 130 -14.207 -35.545 26.424 901 H LYS 131 H LYS 131 -11.034 -35.777 31.057 902 HA LYS 131 HA LYS 131 -12.129 -38.262 32.241 903 HB2 LYS 131 HB2 LYS 131 -9.926 -38.615 33.290 904 HB3 LYS 131 HB3 LYS 131 -9.803 -38.579 31.533 905 HG2 LYS 131 HG2 LYS 131 -9.076 -36.214 31.639 906 HG3 LYS 131 HG3 LYS 131 -9.180 -36.265 33.400 907 HD2 LYS 131 HD2 LYS 131 -7.492 -38.065 33.450 908 HD3 LYS 131 HD3 LYS 131 -7.385 -38.012 31.689 909 HE2 LYS 131 HE2 LYS 131 -6.636 -35.667 31.797 910 HE3 LYS 131 HE3 LYS 131 -6.750 -35.708 33.557 911 HZ1 LYS 131 HZ1 LYS 131 -4.484 -36.099 32.746 912 HZ2 LYS 131 HZ2 LYS 131 -5.020 -37.486 31.925 913 HZ3 LYS 131 HZ3 LYS 131 -5.085 -37.421 33.624 914 H ASP 132 H ASP 132 -13.035 -35.464 32.558 915 HA ASP 132 HA ASP 132 -12.235 -34.653 35.223 916 HB2 ASP 132 HB2 ASP 132 -13.752 -32.789 34.895 917 HB3 ASP 132 HB3 ASP 132 -12.773 -33.002 33.448 918 H GLY 133 H GLY 133 -14.247 -33.927 36.635 919 HA2 GLY 133 HA2 GLY 133 -16.457 -35.797 36.672 920 HA3 GLY 133 HA3 GLY 133 -15.294 -36.044 37.968 921 H LEU 134 H LEU 134 -17.940 -35.373 38.467 922 HA LEU 134 HA LEU 134 -17.635 -32.702 39.684 923 HB2 LEU 134 HB2 LEU 134 -19.557 -33.507 37.656 924 HB3 LEU 134 HB3 LEU 134 -20.403 -33.059 39.127 925 HG LEU 134 HG LEU 134 -20.157 -31.123 37.634 926 HD11 LEU 134 HD11 LEU 134 -19.391 -29.544 39.226 927 HD12 LEU 134 HD12 LEU 134 -18.248 -30.687 39.931 928 HD13 LEU 134 HD13 LEU 134 -19.978 -30.903 40.182 929 HD21 LEU 134 HD21 LEU 134 -18.075 -30.274 36.879 930 HD22 LEU 134 HD22 LEU 134 -17.953 -32.016 36.631 931 HD23 LEU 134 HD23 LEU 134 -17.164 -31.265 38.016 932 H GLU 135 H GLU 135 -19.206 -32.359 41.487 933 HA GLU 135 HA GLU 135 -19.950 -32.968 43.566 934 HB2 GLU 135 HB2 GLU 135 -21.738 -33.945 42.055 935 HB3 GLU 135 HB3 GLU 135 -20.916 -35.497 42.220 936 HG2 GLU 135 HG2 GLU 135 -21.156 -35.364 44.676 937 HG3 GLU 135 HG3 GLU 135 -21.984 -33.817 44.511 938 H HIS 136 H HIS 136 -17.880 -33.179 44.471 939 HA HIS 136 HA HIS 136 -16.855 -35.943 44.739 940 HB2 HIS 136 HB2 HIS 136 -15.424 -33.299 45.105 941 HB3 HIS 136 HB3 HIS 136 -14.704 -34.887 45.377 942 HD2 HIS 136 HD2 HIS 136 -15.198 -32.442 42.484 943 HE1 HIS 136 HE1 HIS 136 -14.378 -36.183 40.707 944 HE2 HIS 136 HE2 HIS 136 -14.591 -33.690 40.271 945 H HIS 137 H HIS 137 -18.987 -34.322 46.352 946 HA HIS 137 HA HIS 137 -19.669 -34.129 48.532 947 HB2 HIS 137 HB2 HIS 137 -19.196 -36.611 48.365 948 HB3 HIS 137 HB3 HIS 137 -17.626 -36.289 49.097 949 HD2 HIS 137 HD2 HIS 137 -17.746 -36.457 51.845 950 HE1 HIS 137 HE1 HIS 137 -21.844 -35.572 52.336 951 HE2 HIS 137 HE2 HIS 137 -19.702 -36.193 53.552 952 H HIS 138 H HIS 138 -17.673 -32.324 47.675 953 HA HIS 138 HA HIS 138 -16.615 -31.488 50.246 954 HB2 HIS 138 HB2 HIS 138 -14.869 -33.030 49.245 955 HB3 HIS 138 HB3 HIS 138 -14.693 -31.858 47.940 956 HD2 HIS 138 HD2 HIS 138 -13.582 -32.319 51.631 957 HE1 HIS 138 HE1 HIS 138 -12.342 -28.467 50.433 958 HE2 HIS 138 HE2 HIS 138 -12.156 -30.224 52.258 959 H HIS 139 H HIS 139 -16.318 -29.291 50.361 960 HA HIS 139 HA HIS 139 -17.653 -27.652 48.483 961 HB2 HIS 139 HB2 HIS 139 -17.321 -27.137 50.924 962 HB3 HIS 139 HB3 HIS 139 -15.635 -26.773 50.562 963 HD2 HIS 139 HD2 HIS 139 -15.269 -24.124 49.871 964 HE1 HIS 139 HE1 HIS 139 -19.222 -23.253 48.677 965 HE2 HIS 139 HE2 HIS 139 -16.905 -22.275 49.025 966 H HIS 140 H HIS 140 -16.943 -26.456 46.792 967 HA HIS 140 HA HIS 140 -14.526 -27.153 45.486 968 HB2 HIS 140 HB2 HIS 140 -16.648 -26.279 44.403 969 HB3 HIS 140 HB3 HIS 140 -16.182 -24.675 44.970 970 HD2 HIS 140 HD2 HIS 140 -15.273 -27.155 42.125 971 HE1 HIS 140 HE1 HIS 140 -12.569 -23.923 41.867 972 HE2 HIS 140 HE2 HIS 140 -13.410 -26.011 40.694 973 H HIS 141 H HIS 141 -12.562 -26.188 45.399 974 HA HIS 141 HA HIS 141 -10.765 -24.934 46.075 975 HB2 HIS 141 HB2 HIS 141 -12.128 -23.175 44.889 976 HB3 HIS 141 HB3 HIS 141 -12.780 -22.708 46.459 977 HD2 HIS 141 HD2 HIS 141 -11.240 -20.767 47.669 978 HE1 HIS 141 HE1 HIS 141 -7.594 -21.558 45.693 979 HE2 HIS 141 HE2 HIS 141 -8.750 -20.041 47.368 Start of MODEL 17 1 H1 MET 1 HT1 MET 1 -2.498 6.249 -12.166 2 H2 MET 1 HT2 MET 1 -1.002 6.166 -12.967 3 H3 MET 1 HT3 MET 1 -2.444 5.865 -13.816 4 HA MET 1 HA MET 1 -3.027 8.053 -13.937 5 HB2 MET 1 HB2 MET 1 -2.801 8.257 -11.403 6 HB3 MET 1 HB3 MET 1 -1.114 8.690 -11.675 7 HG2 MET 1 HG2 MET 1 -2.401 10.738 -11.502 8 HG3 MET 1 HG3 MET 1 -1.900 10.545 -13.179 9 HE1 MET 1 HE1 MET 1 -4.391 10.408 -10.533 10 HE2 MET 1 HE2 MET 1 -5.019 8.854 -11.074 11 HE3 MET 1 HE3 MET 1 -5.994 10.307 -11.272 12 H SER 2 H SER 2 -1.286 6.678 -15.472 13 HA SER 2 HA SER 2 0.437 6.864 -16.979 14 HB2 SER 2 HB2 SER 2 -0.840 8.983 -17.464 15 HB3 SER 2 HB3 SER 2 0.258 9.828 -16.377 16 HG SER 2 HG SER 2 0.624 9.031 -18.938 17 H ASP 3 H ASP 3 2.717 8.200 -17.218 18 HA ASP 3 HA ASP 3 4.081 7.821 -14.617 19 HB2 ASP 3 HB2 ASP 3 4.611 6.293 -16.633 20 HB3 ASP 3 HB3 ASP 3 5.451 7.695 -17.291 21 H GLN 4 H GLN 4 2.835 10.327 -15.922 22 HA GLN 4 HA GLN 4 4.909 12.103 -16.660 23 HB2 GLN 4 HB2 GLN 4 2.159 12.580 -15.501 24 HB3 GLN 4 HB3 GLN 4 3.226 13.882 -16.027 25 HG2 GLN 4 HG2 GLN 4 3.270 13.026 -18.286 26 HG3 GLN 4 HG3 GLN 4 2.406 11.570 -17.802 27 HE21 GLN 4 HE21 GLN 4 1.591 13.688 -19.794 28 HE22 GLN 4 HE22 GLN 4 0.081 14.244 -19.255 29 H SER 5 H SER 5 3.427 11.325 -13.552 30 HA SER 5 HA SER 5 4.740 13.288 -11.990 31 HB2 SER 5 HB2 SER 5 3.684 10.561 -11.208 32 HB3 SER 5 HB3 SER 5 4.205 11.797 -10.067 33 HG SER 5 HG SER 5 2.164 12.348 -10.257 34 H GLN 6 H GLN 6 6.702 13.340 -11.026 35 HA GLN 6 HA GLN 6 8.826 11.851 -12.088 36 HB2 GLN 6 HB2 GLN 6 8.628 13.530 -9.584 37 HB3 GLN 6 HB3 GLN 6 10.140 12.825 -10.155 38 HG2 GLN 6 HG2 GLN 6 9.992 14.034 -12.244 39 HG3 GLN 6 HG3 GLN 6 8.374 14.607 -11.852 40 HE21 GLN 6 HE21 GLN 6 10.892 16.199 -12.363 41 HE22 GLN 6 HE22 GLN 6 11.094 17.159 -10.979 42 H GLU 7 H GLU 7 7.034 11.476 -9.043 43 HA GLU 7 HA GLU 7 8.275 8.816 -8.720 44 HB2 GLU 7 HB2 GLU 7 7.634 10.903 -6.635 45 HB3 GLU 7 HB3 GLU 7 8.128 9.249 -6.253 46 HG2 GLU 7 HG2 GLU 7 10.251 9.610 -7.474 47 HG3 GLU 7 HG3 GLU 7 9.752 11.257 -7.851 48 HA PRO 8 HA PRO 8 3.550 8.604 -8.839 49 HB2 PRO 8 HB2 PRO 8 4.077 6.160 -10.438 50 HB3 PRO 8 HB3 PRO 8 2.989 7.520 -10.780 51 HG2 PRO 8 HG2 PRO 8 5.242 7.160 -12.154 52 HG3 PRO 8 HG3 PRO 8 4.649 8.780 -11.744 53 HD2 PRO 8 HD2 PRO 8 6.847 7.194 -10.436 54 HD3 PRO 8 HD3 PRO 8 6.795 8.926 -10.830 55 H THR 9 H THR 9 2.838 7.802 -6.931 56 HA THR 9 HA THR 9 4.037 5.356 -5.841 57 HB THR 9 HB THR 9 2.138 7.335 -4.541 58 HG1 THR 9 HG1 THR 9 4.954 7.054 -4.342 59 HG21 THR 9 HG21 THR 9 2.620 6.243 -2.497 60 HG22 THR 9 HG22 THR 9 4.005 5.395 -3.180 61 HG23 THR 9 HG23 THR 9 2.370 4.917 -3.634 62 H MET 10 H MET 10 2.863 3.512 -5.444 63 HA MET 10 HA MET 10 0.749 2.802 -7.064 64 HB2 MET 10 HB2 MET 10 0.456 0.857 -5.593 65 HB3 MET 10 HB3 MET 10 2.160 1.175 -5.908 66 HG2 MET 10 HG2 MET 10 2.333 2.352 -3.732 67 HG3 MET 10 HG3 MET 10 0.633 2.002 -3.416 68 HE1 MET 10 HE1 MET 10 1.180 0.664 -1.091 69 HE2 MET 10 HE2 MET 10 2.715 1.444 -1.466 70 HE3 MET 10 HE3 MET 10 2.691 -0.250 -0.984 71 H GLU 11 H GLU 11 0.555 4.801 -4.291 72 HA GLU 11 HA GLU 11 -2.150 4.187 -3.514 73 HB2 GLU 11 HB2 GLU 11 -0.394 6.610 -3.045 74 HB3 GLU 11 HB3 GLU 11 -2.021 6.442 -2.384 75 HG2 GLU 11 HG2 GLU 11 -1.351 4.374 -1.231 76 HG3 GLU 11 HG3 GLU 11 0.271 4.516 -1.903 77 H GLU 12 H GLU 12 -0.587 6.636 -5.522 78 HA GLU 12 HA GLU 12 -2.944 7.994 -6.337 79 HB2 GLU 12 HB2 GLU 12 -0.178 7.826 -7.542 80 HB3 GLU 12 HB3 GLU 12 -1.451 8.864 -8.184 81 HG2 GLU 12 HG2 GLU 12 -1.647 9.989 -5.998 82 HG3 GLU 12 HG3 GLU 12 -0.380 8.949 -5.348 83 H ILE 13 H ILE 13 -1.091 5.335 -7.739 84 HA ILE 13 HA ILE 13 -2.441 5.164 -10.217 85 HB ILE 13 HB ILE 13 -0.962 3.072 -8.582 86 HG12 ILE 13 HG12 ILE 13 -0.113 4.577 -11.076 87 HG13 ILE 13 HG13 ILE 13 0.237 5.161 -9.451 88 HG21 ILE 13 HG21 ILE 13 -1.790 2.969 -11.503 89 HG22 ILE 13 HG22 ILE 13 -2.539 2.024 -10.216 90 HG23 ILE 13 HG23 ILE 13 -0.849 1.750 -10.643 91 HD11 ILE 13 HD11 ILE 13 1.261 2.777 -9.081 92 HD12 ILE 13 HD12 ILE 13 2.185 3.966 -9.997 93 HD13 ILE 13 HD13 ILE 13 1.290 2.704 -10.842 94 H LEU 14 H LEU 14 -2.982 3.470 -7.140 95 HA LEU 14 HA LEU 14 -5.194 1.923 -7.903 96 HB2 LEU 14 HB2 LEU 14 -3.748 1.959 -5.686 97 HB3 LEU 14 HB3 LEU 14 -4.981 3.081 -5.134 98 HG LEU 14 HG LEU 14 -5.541 0.813 -4.422 99 HD11 LEU 14 HD11 LEU 14 -7.357 2.436 -5.281 100 HD12 LEU 14 HD12 LEU 14 -7.795 0.739 -5.086 101 HD13 LEU 14 HD13 LEU 14 -7.443 1.378 -6.691 102 HD21 LEU 14 HD21 LEU 14 -5.769 -0.018 -7.317 103 HD22 LEU 14 HD22 LEU 14 -5.769 -1.041 -5.881 104 HD23 LEU 14 HD23 LEU 14 -4.282 -0.248 -6.399 105 H ALA 15 H ALA 15 -4.919 5.232 -6.676 106 HA ALA 15 HA ALA 15 -7.692 5.791 -6.386 107 HB1 ALA 15 HB1 ALA 15 -7.061 8.035 -6.129 108 HB2 ALA 15 HB2 ALA 15 -5.671 7.864 -7.202 109 HB3 ALA 15 HB3 ALA 15 -5.630 7.163 -5.583 110 H SER 16 H SER 16 -5.389 6.199 -8.981 111 HA SER 16 HA SER 16 -6.825 7.548 -10.889 112 HB2 SER 16 HB2 SER 16 -4.473 6.770 -11.217 113 HB3 SER 16 HB3 SER 16 -5.093 5.157 -11.550 114 HG SER 16 HG SER 16 -6.147 5.940 -13.332 115 H ILE 17 H ILE 17 -6.950 3.937 -10.401 116 HA ILE 17 HA ILE 17 -9.193 3.793 -12.245 117 HB ILE 17 HB ILE 17 -9.155 1.374 -11.724 118 HG12 ILE 17 HG12 ILE 17 -6.716 1.981 -10.023 119 HG13 ILE 17 HG13 ILE 17 -8.321 1.743 -9.331 120 HG21 ILE 17 HG21 ILE 17 -7.200 0.929 -12.955 121 HG22 ILE 17 HG22 ILE 17 -6.332 2.296 -12.257 122 HG23 ILE 17 HG23 ILE 17 -7.619 2.572 -13.431 123 HD11 ILE 17 HD11 ILE 17 -6.886 -0.341 -9.376 124 HD12 ILE 17 HD12 ILE 17 -6.966 -0.282 -11.137 125 HD13 ILE 17 HD13 ILE 17 -8.439 -0.510 -10.193 126 H ARG 18 H ARG 18 -8.883 4.586 -8.991 127 HA ARG 18 HA ARG 18 -11.533 3.463 -8.294 128 HB2 ARG 18 HB2 ARG 18 -9.684 2.972 -6.719 129 HB3 ARG 18 HB3 ARG 18 -9.453 4.701 -6.472 130 HG2 ARG 18 HG2 ARG 18 -11.683 4.928 -5.533 131 HG3 ARG 18 HG3 ARG 18 -12.059 3.249 -5.921 132 HD2 ARG 18 HD2 ARG 18 -9.808 4.077 -4.072 133 HD3 ARG 18 HD3 ARG 18 -11.421 3.646 -3.510 134 HE ARG 18 HE ARG 18 -10.495 1.563 -5.155 135 HH11 ARG 18 HH11 ARG 18 -9.710 3.020 -2.064 136 HH12 ARG 18 HH12 ARG 18 -9.069 1.551 -1.405 137 HH21 ARG 18 HH21 ARG 18 -9.667 -0.327 -4.251 138 HH22 ARG 18 HH22 ARG 18 -9.048 -0.328 -2.636 139 H ARG 19 H ARG 19 -13.226 4.724 -8.497 140 HA ARG 19 HA ARG 19 -14.514 6.595 -8.869 141 HB2 ARG 19 HB2 ARG 19 -12.998 7.260 -6.343 142 HB3 ARG 19 HB3 ARG 19 -14.366 8.210 -6.927 143 HG2 ARG 19 HG2 ARG 19 -15.707 6.057 -6.981 144 HG3 ARG 19 HG3 ARG 19 -14.365 5.286 -6.137 145 HD2 ARG 19 HD2 ARG 19 -15.842 7.731 -5.130 146 HD3 ARG 19 HD3 ARG 19 -16.155 6.086 -4.588 147 HE ARG 19 HE ARG 19 -13.839 7.731 -3.924 148 HH11 ARG 19 HH11 ARG 19 -15.245 4.517 -3.916 149 HH12 ARG 19 HH12 ARG 19 -14.186 3.937 -2.675 150 HH21 ARG 19 HH21 ARG 19 -12.492 6.933 -2.312 151 HH22 ARG 19 HH22 ARG 19 -12.640 5.292 -1.778 152 H ILE 20 H ILE 20 -13.146 7.012 -10.873 153 HA ILE 20 HA ILE 20 -11.145 9.008 -10.941 154 HB ILE 20 HB ILE 20 -13.136 8.099 -13.057 155 HG12 ILE 20 HG12 ILE 20 -10.177 7.506 -12.818 156 HG13 ILE 20 HG13 ILE 20 -11.396 6.476 -12.070 157 HG21 ILE 20 HG21 ILE 20 -11.657 9.181 -14.701 158 HG22 ILE 20 HG22 ILE 20 -10.594 9.740 -13.411 159 HG23 ILE 20 HG23 ILE 20 -12.227 10.387 -13.546 160 HD11 ILE 20 HD11 ILE 20 -10.929 5.499 -14.204 161 HD12 ILE 20 HD12 ILE 20 -11.015 7.062 -15.016 162 HD13 ILE 20 HD13 ILE 20 -12.480 6.318 -14.380 163 H ILE 21 H ILE 21 -14.668 9.162 -11.401 164 HA ILE 21 HA ILE 21 -14.567 12.059 -10.820 165 HB ILE 21 HB ILE 21 -16.503 12.364 -12.347 166 HG12 ILE 21 HG12 ILE 21 -15.881 9.556 -13.319 167 HG13 ILE 21 HG13 ILE 21 -17.205 9.910 -12.216 168 HG21 ILE 21 HG21 ILE 21 -14.194 11.054 -13.799 169 HG22 ILE 21 HG22 ILE 21 -14.032 12.618 -13.000 170 HG23 ILE 21 HG23 ILE 21 -15.177 12.419 -14.326 171 HD11 ILE 21 HD11 ILE 21 -18.254 11.375 -13.851 172 HD12 ILE 21 HD12 ILE 21 -17.914 9.825 -14.624 173 HD13 ILE 21 HD13 ILE 21 -16.870 11.212 -14.935 174 H SER 22 H SER 22 -15.361 9.312 -9.400 175 HA SER 22 HA SER 22 -16.827 8.647 -7.770 176 HB2 SER 22 HB2 SER 22 -15.904 10.864 -6.894 177 HB3 SER 22 HB3 SER 22 -17.436 11.571 -7.394 178 HG SER 22 HG SER 22 -17.887 10.916 -5.397 179 H GLU 23 H GLU 23 -17.925 9.258 -10.574 180 HA GLU 23 HA GLU 23 -20.592 10.197 -10.299 181 HB2 GLU 23 HB2 GLU 23 -19.275 10.011 -12.449 182 HB3 GLU 23 HB3 GLU 23 -19.580 8.277 -12.406 183 HG2 GLU 23 HG2 GLU 23 -21.864 10.238 -12.184 184 HG3 GLU 23 HG3 GLU 23 -21.205 9.809 -13.759 185 H ASP 24 H ASP 24 -22.025 9.272 -9.009 186 HA ASP 24 HA ASP 24 -22.119 6.335 -8.786 187 HB2 ASP 24 HB2 ASP 24 -22.612 8.602 -6.943 188 HB3 ASP 24 HB3 ASP 24 -23.771 7.284 -6.811 189 H ASP 25 H ASP 25 -24.715 5.993 -7.910 190 HA ASP 25 HA ASP 25 -26.205 6.370 -10.385 191 HB2 ASP 25 HB2 ASP 25 -26.924 4.880 -7.849 192 HB3 ASP 25 HB3 ASP 25 -27.833 4.835 -9.358 193 H ALA 26 H ALA 26 -25.675 8.732 -8.781 194 HA ALA 26 HA ALA 26 -27.967 9.507 -7.286 195 HB1 ALA 26 HB1 ALA 26 -26.148 10.819 -6.749 196 HB2 ALA 26 HB2 ALA 26 -26.941 11.874 -7.919 197 HB3 ALA 26 HB3 ALA 26 -25.568 10.883 -8.413 198 HA PRO 27 HA PRO 27 -30.900 10.694 -10.380 199 HB2 PRO 27 HB2 PRO 27 -31.684 13.242 -9.635 200 HB3 PRO 27 HB3 PRO 27 -32.268 11.748 -8.879 201 HG2 PRO 27 HG2 PRO 27 -30.125 13.611 -7.975 202 HG3 PRO 27 HG3 PRO 27 -31.386 12.796 -7.030 203 HD2 PRO 27 HD2 PRO 27 -28.856 11.877 -7.043 204 HD3 PRO 27 HD3 PRO 27 -30.239 10.759 -6.999 205 H ALA 28 H ALA 28 -28.203 12.843 -9.822 206 HA ALA 28 HA ALA 28 -28.527 14.648 -11.959 207 HB1 ALA 28 HB1 ALA 28 -26.047 14.929 -11.792 208 HB2 ALA 28 HB2 ALA 28 -26.008 13.573 -10.666 209 HB3 ALA 28 HB3 ALA 28 -26.868 15.051 -10.237 210 H GLU 29 H GLU 29 -27.997 14.579 -14.102 211 HA GLU 29 HA GLU 29 -26.479 12.414 -15.247 212 HB2 GLU 29 HB2 GLU 29 -28.800 11.440 -14.922 213 HB3 GLU 29 HB3 GLU 29 -29.392 12.662 -16.045 214 HG2 GLU 29 HG2 GLU 29 -27.833 11.828 -17.772 215 HG3 GLU 29 HG3 GLU 29 -27.251 10.601 -16.650 216 HA PRO 30 HA PRO 30 -26.642 16.491 -17.494 217 HB2 PRO 30 HB2 PRO 30 -24.076 17.266 -17.267 218 HB3 PRO 30 HB3 PRO 30 -25.236 17.502 -15.949 219 HG2 PRO 30 HG2 PRO 30 -23.142 15.407 -16.275 220 HG3 PRO 30 HG3 PRO 30 -23.617 16.312 -14.828 221 HD2 PRO 30 HD2 PRO 30 -24.476 13.744 -15.395 222 HD3 PRO 30 HD3 PRO 30 -25.350 14.880 -14.344 223 H ALA 31 H ALA 31 -26.946 14.489 -19.030 224 HA ALA 31 HA ALA 31 -24.987 14.760 -21.158 225 HB1 ALA 31 HB1 ALA 31 -24.222 12.591 -21.243 226 HB2 ALA 31 HB2 ALA 31 -25.658 11.937 -20.456 227 HB3 ALA 31 HB3 ALA 31 -24.423 12.756 -19.498 228 H ALA 32 H ALA 32 -25.820 14.205 -23.189 229 HA ALA 32 HA ALA 32 -28.442 13.000 -23.429 230 HB1 ALA 32 HB1 ALA 32 -28.923 15.300 -24.876 231 HB2 ALA 32 HB2 ALA 32 -28.086 15.911 -23.450 232 HB3 ALA 32 HB3 ALA 32 -29.555 14.956 -23.265 233 H GLU 33 H GLU 33 -28.944 12.369 -25.531 234 HA GLU 33 HA GLU 33 -28.519 11.594 -27.634 235 HB2 GLU 33 HB2 GLU 33 -27.261 14.306 -27.621 236 HB3 GLU 33 HB3 GLU 33 -26.841 13.236 -28.955 237 HG2 GLU 33 HG2 GLU 33 -28.760 14.512 -29.651 238 HG3 GLU 33 HG3 GLU 33 -29.321 12.874 -29.323 239 H ALA 34 H ALA 34 -25.279 13.043 -27.237 240 HA ALA 34 HA ALA 34 -24.084 10.462 -26.627 241 HB1 ALA 34 HB1 ALA 34 -24.243 10.251 -29.022 242 HB2 ALA 34 HB2 ALA 34 -22.562 10.599 -28.620 243 HB3 ALA 34 HB3 ALA 34 -23.600 11.876 -29.257 244 H ALA 35 H ALA 35 -21.821 10.614 -26.147 245 HA ALA 35 HA ALA 35 -20.437 13.105 -26.085 246 HB1 ALA 35 HB1 ALA 35 -20.449 12.749 -23.350 247 HB2 ALA 35 HB2 ALA 35 -22.123 12.399 -23.789 248 HB3 ALA 35 HB3 ALA 35 -21.402 13.949 -24.225 249 HA PRO 36 HA PRO 36 -17.700 9.821 -23.897 250 HB2 PRO 36 HB2 PRO 36 -18.709 7.401 -23.196 251 HB3 PRO 36 HB3 PRO 36 -18.821 8.819 -22.134 252 HG2 PRO 36 HG2 PRO 36 -20.880 7.659 -23.955 253 HG3 PRO 36 HG3 PRO 36 -21.052 8.246 -22.291 254 HD2 PRO 36 HD2 PRO 36 -21.771 9.747 -24.445 255 HD3 PRO 36 HD3 PRO 36 -21.159 10.471 -22.943 256 HA PRO 37 HA PRO 37 -16.851 7.618 -27.695 257 HB2 PRO 37 HB2 PRO 37 -14.886 5.866 -26.972 258 HB3 PRO 37 HB3 PRO 37 -14.609 7.611 -27.130 259 HG2 PRO 37 HG2 PRO 37 -15.105 5.992 -24.673 260 HG3 PRO 37 HG3 PRO 37 -13.921 7.283 -24.953 261 HD2 PRO 37 HD2 PRO 37 -16.248 7.734 -23.633 262 HD3 PRO 37 HD3 PRO 37 -15.490 8.973 -24.656 263 HA PRO 38 HA PRO 38 -19.388 3.947 -27.842 264 HB2 PRO 38 HB2 PRO 38 -17.377 2.766 -29.714 265 HB3 PRO 38 HB3 PRO 38 -19.129 2.963 -29.919 266 HG2 PRO 38 HG2 PRO 38 -17.466 4.549 -31.200 267 HG3 PRO 38 HG3 PRO 38 -18.944 5.203 -30.472 268 HD2 PRO 38 HD2 PRO 38 -16.114 5.376 -29.468 269 HD3 PRO 38 HD3 PRO 38 -17.391 6.615 -29.456 270 HA PRO 39 HA PRO 39 -17.271 1.208 -24.947 271 HB2 PRO 39 HB2 PRO 39 -19.076 -0.815 -24.731 272 HB3 PRO 39 HB3 PRO 39 -19.337 0.781 -24.000 273 HG2 PRO 39 HG2 PRO 39 -20.411 -0.328 -26.554 274 HG3 PRO 39 HG3 PRO 39 -21.240 0.606 -25.294 275 HD2 PRO 39 HD2 PRO 39 -20.356 1.750 -27.599 276 HD3 PRO 39 HD3 PRO 39 -20.417 2.636 -26.059 277 HA PRO 40 HA PRO 40 -15.231 -1.802 -27.577 278 HB2 PRO 40 HB2 PRO 40 -14.041 -3.431 -25.762 279 HB3 PRO 40 HB3 PRO 40 -13.493 -1.769 -26.046 280 HG2 PRO 40 HG2 PRO 40 -15.237 -2.836 -23.873 281 HG3 PRO 40 HG3 PRO 40 -13.888 -1.688 -23.772 282 HD2 PRO 40 HD2 PRO 40 -16.491 -0.881 -23.778 283 HD3 PRO 40 HD3 PRO 40 -15.182 0.106 -24.463 284 H GLU 41 H GLU 41 -15.339 -3.993 -28.300 285 HA GLU 41 HA GLU 41 -17.026 -5.901 -26.959 286 HB2 GLU 41 HB2 GLU 41 -18.470 -4.196 -28.461 287 HB3 GLU 41 HB3 GLU 41 -18.016 -5.341 -29.718 288 HG2 GLU 41 HG2 GLU 41 -18.905 -7.200 -28.353 289 HG3 GLU 41 HG3 GLU 41 -19.385 -6.050 -27.107 290 HA PRO 42 HA PRO 42 -15.187 -7.907 -31.035 291 HB2 PRO 42 HB2 PRO 42 -13.094 -5.888 -31.708 292 HB3 PRO 42 HB3 PRO 42 -14.116 -6.857 -32.787 293 HG2 PRO 42 HG2 PRO 42 -14.596 -4.288 -32.469 294 HG3 PRO 42 HG3 PRO 42 -15.937 -5.448 -32.540 295 HD2 PRO 42 HD2 PRO 42 -14.720 -4.125 -30.123 296 HD3 PRO 42 HD3 PRO 42 -16.434 -4.388 -30.512 297 H GLU 43 H GLU 43 -13.628 -9.451 -30.685 298 HA GLU 43 HA GLU 43 -11.390 -8.780 -28.876 299 HB2 GLU 43 HB2 GLU 43 -13.153 -11.242 -28.716 300 HB3 GLU 43 HB3 GLU 43 -11.703 -10.970 -27.755 301 HG2 GLU 43 HG2 GLU 43 -14.160 -9.187 -27.743 302 HG3 GLU 43 HG3 GLU 43 -13.775 -10.384 -26.509 303 HA PRO 44 HA PRO 44 -9.944 -11.065 -32.728 304 HB2 PRO 44 HB2 PRO 44 -7.939 -9.358 -33.427 305 HB3 PRO 44 HB3 PRO 44 -9.620 -9.127 -33.952 306 HG2 PRO 44 HG2 PRO 44 -8.139 -7.812 -31.720 307 HG3 PRO 44 HG3 PRO 44 -9.239 -7.101 -32.914 308 HD2 PRO 44 HD2 PRO 44 -10.037 -7.694 -30.380 309 HD3 PRO 44 HD3 PRO 44 -11.140 -7.780 -31.771 310 H GLU 45 H GLU 45 -8.176 -12.459 -32.793 311 HA GLU 45 HA GLU 45 -6.012 -12.079 -30.849 312 HB2 GLU 45 HB2 GLU 45 -7.822 -13.459 -29.774 313 HB3 GLU 45 HB3 GLU 45 -7.565 -14.673 -31.026 314 HG2 GLU 45 HG2 GLU 45 -6.261 -15.299 -29.079 315 HG3 GLU 45 HG3 GLU 45 -5.156 -14.788 -30.349 316 HA PRO 46 HA PRO 46 -4.560 -13.709 -34.996 317 HB2 PRO 46 HB2 PRO 46 -2.479 -11.984 -35.334 318 HB3 PRO 46 HB3 PRO 46 -4.143 -11.583 -35.814 319 HG2 PRO 46 HG2 PRO 46 -2.643 -10.794 -33.359 320 HG3 PRO 46 HG3 PRO 46 -3.694 -9.817 -34.400 321 HD2 PRO 46 HD2 PRO 46 -4.556 -10.857 -32.037 322 HD3 PRO 46 HD3 PRO 46 -5.641 -10.621 -33.427 323 H VAL 47 H VAL 47 -2.826 -15.118 -35.327 324 HA VAL 47 HA VAL 47 -0.652 -15.193 -33.374 325 HB VAL 47 HB VAL 47 -2.431 -16.587 -32.382 326 HG11 VAL 47 HG11 VAL 47 -3.481 -17.231 -34.580 327 HG12 VAL 47 HG12 VAL 47 -3.246 -18.582 -33.471 328 HG13 VAL 47 HG13 VAL 47 -2.143 -18.353 -34.828 329 HG21 VAL 47 HG21 VAL 47 -0.115 -18.221 -33.473 330 HG22 VAL 47 HG22 VAL 47 -1.088 -18.625 -32.059 331 HG23 VAL 47 HG23 VAL 47 -0.054 -17.196 -32.038 332 H SER 48 H SER 48 1.229 -15.746 -34.274 333 HA SER 48 HA SER 48 1.616 -17.603 -36.360 334 HB2 SER 48 HB2 SER 48 1.228 -14.753 -37.187 335 HB3 SER 48 HB3 SER 48 2.443 -15.716 -38.021 336 HG SER 48 HG SER 48 0.633 -16.163 -39.114 337 H PHE 49 H PHE 49 2.947 -14.383 -35.568 338 HA PHE 49 HA PHE 49 5.320 -15.583 -34.395 339 HB2 PHE 49 HB2 PHE 49 6.875 -14.342 -35.856 340 HB3 PHE 49 HB3 PHE 49 5.922 -15.510 -36.771 341 HD1 PHE 49 HD1 PHE 49 6.506 -11.936 -36.098 342 HD2 PHE 49 HD2 PHE 49 4.167 -14.775 -38.316 343 HE1 PHE 49 HE1 PHE 49 5.701 -10.116 -37.579 344 HE2 PHE 49 HE2 PHE 49 3.362 -12.956 -39.796 345 HZ PHE 49 HZ PHE 49 4.130 -10.626 -39.427 346 H ASP 50 H ASP 50 6.736 -13.904 -33.408 347 HA ASP 50 HA ASP 50 5.173 -11.505 -32.647 348 HB2 ASP 50 HB2 ASP 50 6.136 -11.625 -30.429 349 HB3 ASP 50 HB3 ASP 50 5.343 -13.151 -30.805 350 H ASP 51 H ASP 51 6.615 -9.795 -31.691 351 HA ASP 51 HA ASP 51 8.419 -8.871 -33.648 352 HB2 ASP 51 HB2 ASP 51 8.024 -8.049 -30.768 353 HB3 ASP 51 HB3 ASP 51 9.119 -7.210 -31.862 354 H GLU 52 H GLU 52 9.068 -10.290 -30.432 355 HA GLU 52 HA GLU 52 11.544 -11.455 -31.368 356 HB2 GLU 52 HB2 GLU 52 12.157 -9.081 -30.768 357 HB3 GLU 52 HB3 GLU 52 11.626 -9.420 -29.122 358 HG2 GLU 52 HG2 GLU 52 14.045 -9.722 -29.270 359 HG3 GLU 52 HG3 GLU 52 13.276 -11.280 -28.995 360 H VAL 53 H VAL 53 12.321 -13.041 -29.878 361 HA VAL 53 HA VAL 53 10.342 -13.705 -27.785 362 HB VAL 53 HB VAL 53 10.981 -16.088 -28.131 363 HG11 VAL 53 HG11 VAL 53 9.918 -14.473 -30.450 364 HG12 VAL 53 HG12 VAL 53 9.016 -15.417 -29.266 365 HG13 VAL 53 HG13 VAL 53 9.976 -16.236 -30.498 366 HG21 VAL 53 HG21 VAL 53 13.271 -15.539 -29.095 367 HG22 VAL 53 HG22 VAL 53 12.453 -15.096 -30.593 368 HG23 VAL 53 HG23 VAL 53 12.363 -16.753 -29.997 369 H LEU 54 H LEU 54 11.166 -14.875 -25.921 370 HA LEU 54 HA LEU 54 14.037 -14.521 -25.375 371 HB2 LEU 54 HB2 LEU 54 13.519 -13.629 -23.121 372 HB3 LEU 54 HB3 LEU 54 12.982 -12.561 -24.413 373 HG LEU 54 HG LEU 54 10.693 -13.930 -24.136 374 HD11 LEU 54 HD11 LEU 54 11.279 -15.517 -22.476 375 HD12 LEU 54 HD12 LEU 54 10.397 -14.284 -21.585 376 HD13 LEU 54 HD13 LEU 54 12.159 -14.326 -21.522 377 HD21 LEU 54 HD21 LEU 54 11.637 -11.750 -22.245 378 HD22 LEU 54 HD22 LEU 54 9.949 -12.196 -22.498 379 HD23 LEU 54 HD23 LEU 54 10.888 -11.512 -23.825 380 H GLU 55 H GLU 55 14.860 -15.870 -23.702 381 HA GLU 55 HA GLU 55 13.326 -18.363 -23.426 382 HB2 GLU 55 HB2 GLU 55 16.265 -17.790 -22.996 383 HB3 GLU 55 HB3 GLU 55 15.503 -19.370 -22.808 384 HG2 GLU 55 HG2 GLU 55 14.773 -19.293 -25.172 385 HG3 GLU 55 HG3 GLU 55 15.559 -17.726 -25.358 386 H LEU 56 H LEU 56 13.687 -15.649 -21.576 387 HA LEU 56 HA LEU 56 14.032 -17.057 -19.024 388 HB2 LEU 56 HB2 LEU 56 15.250 -14.928 -19.404 389 HB3 LEU 56 HB3 LEU 56 13.711 -14.098 -19.604 390 HG LEU 56 HG LEU 56 13.091 -14.802 -17.269 391 HD11 LEU 56 HD11 LEU 56 15.952 -15.809 -17.277 392 HD12 LEU 56 HD12 LEU 56 14.490 -16.738 -16.946 393 HD13 LEU 56 HD13 LEU 56 15.032 -15.512 -15.802 394 HD21 LEU 56 HD21 LEU 56 14.497 -13.139 -16.174 395 HD22 LEU 56 HD22 LEU 56 14.109 -12.581 -17.800 396 HD23 LEU 56 HD23 LEU 56 15.698 -13.265 -17.459 397 H THR 57 H THR 57 12.233 -18.059 -18.359 398 HA THR 57 HA THR 57 9.770 -16.472 -18.093 399 HB THR 57 HB THR 57 8.409 -18.404 -18.787 400 HG1 THR 57 HG1 THR 57 10.955 -19.524 -19.308 401 HG21 THR 57 HG21 THR 57 8.805 -18.243 -21.168 402 HG22 THR 57 HG22 THR 57 10.474 -17.737 -20.901 403 HG23 THR 57 HG23 THR 57 9.148 -16.668 -20.450 404 H ASP 58 H ASP 58 8.222 -17.569 -16.547 405 HA ASP 58 HA ASP 58 9.596 -18.245 -14.134 406 HB2 ASP 58 HB2 ASP 58 7.368 -18.481 -13.169 407 HB3 ASP 58 HB3 ASP 58 7.424 -17.033 -14.168 408 HA PRO 59 HA PRO 59 9.793 -22.624 -14.753 409 HB2 PRO 59 HB2 PRO 59 9.780 -23.630 -12.232 410 HB3 PRO 59 HB3 PRO 59 11.151 -22.706 -12.881 411 HG2 PRO 59 HG2 PRO 59 8.954 -21.811 -11.077 412 HG3 PRO 59 HG3 PRO 59 10.689 -21.451 -11.007 413 HD2 PRO 59 HD2 PRO 59 8.836 -19.709 -12.047 414 HD3 PRO 59 HD3 PRO 59 10.536 -19.753 -12.565 415 H ILE 60 H ILE 60 8.441 -24.271 -15.230 416 HA ILE 60 HA ILE 60 5.632 -24.023 -14.631 417 HB ILE 60 HB ILE 60 6.476 -24.782 -16.840 418 HG12 ILE 60 HG12 ILE 60 4.957 -26.854 -16.969 419 HG13 ILE 60 HG13 ILE 60 4.687 -26.625 -15.241 420 HG21 ILE 60 HG21 ILE 60 8.377 -26.150 -15.871 421 HG22 ILE 60 HG22 ILE 60 7.458 -26.951 -17.145 422 HG23 ILE 60 HG23 ILE 60 7.183 -27.381 -15.458 423 HD11 ILE 60 HD11 ILE 60 3.702 -24.480 -15.578 424 HD12 ILE 60 HD12 ILE 60 2.984 -25.523 -16.805 425 HD13 ILE 60 HD13 ILE 60 4.269 -24.399 -17.246 426 H ALA 61 H ALA 61 8.309 -25.957 -13.496 427 HA ALA 61 HA ALA 61 6.570 -27.120 -11.412 428 HB1 ALA 61 HB1 ALA 61 8.792 -28.753 -12.592 429 HB2 ALA 61 HB2 ALA 61 7.221 -28.703 -13.393 430 HB3 ALA 61 HB3 ALA 61 7.347 -29.290 -11.735 431 HA PRO 62 HA PRO 62 9.822 -25.758 -8.696 432 HB2 PRO 62 HB2 PRO 62 9.655 -27.516 -6.622 433 HB3 PRO 62 HB3 PRO 62 8.436 -26.260 -6.916 434 HG2 PRO 62 HG2 PRO 62 8.369 -29.161 -7.614 435 HG3 PRO 62 HG3 PRO 62 7.094 -28.137 -6.930 436 HD2 PRO 62 HD2 PRO 62 7.179 -28.776 -9.575 437 HD3 PRO 62 HD3 PRO 62 6.525 -27.231 -8.988 438 H GLU 63 H GLU 63 11.977 -26.131 -8.176 439 HA GLU 63 HA GLU 63 13.335 -28.191 -9.626 440 HB2 GLU 63 HB2 GLU 63 14.286 -26.127 -7.633 441 HB3 GLU 63 HB3 GLU 63 15.369 -27.266 -8.432 442 HG2 GLU 63 HG2 GLU 63 15.430 -25.280 -9.754 443 HG3 GLU 63 HG3 GLU 63 14.424 -26.419 -10.643 444 HA PRO 64 HA PRO 64 13.421 -31.415 -6.557 445 HB2 PRO 64 HB2 PRO 64 15.951 -32.462 -6.873 446 HB3 PRO 64 HB3 PRO 64 14.596 -32.797 -7.967 447 HG2 PRO 64 HG2 PRO 64 16.839 -30.855 -8.270 448 HG3 PRO 64 HG3 PRO 64 16.109 -31.934 -9.474 449 HD2 PRO 64 HD2 PRO 64 15.501 -29.301 -9.387 450 HD3 PRO 64 HD3 PRO 64 14.288 -30.525 -9.836 451 H GLU 65 H GLU 65 15.970 -29.018 -6.573 452 HA GLU 65 HA GLU 65 16.385 -29.422 -3.667 453 HB2 GLU 65 HB2 GLU 65 18.388 -29.959 -5.063 454 HB3 GLU 65 HB3 GLU 65 18.369 -28.305 -5.669 455 HG2 GLU 65 HG2 GLU 65 18.668 -27.446 -3.388 456 HG3 GLU 65 HG3 GLU 65 18.638 -29.089 -2.751 457 H LEU 66 H LEU 66 15.971 -27.716 -2.378 458 HA LEU 66 HA LEU 66 15.108 -25.688 -1.737 459 HB2 LEU 66 HB2 LEU 66 17.546 -25.211 -2.292 460 HB3 LEU 66 HB3 LEU 66 16.979 -24.565 -3.831 461 HG LEU 66 HG LEU 66 15.490 -22.992 -2.541 462 HD11 LEU 66 HD11 LEU 66 16.233 -22.626 -0.113 463 HD12 LEU 66 HD12 LEU 66 17.004 -24.210 -0.218 464 HD13 LEU 66 HD13 LEU 66 15.257 -24.065 -0.416 465 HD21 LEU 66 HD21 LEU 66 18.423 -22.755 -1.819 466 HD22 LEU 66 HD22 LEU 66 17.269 -21.439 -2.031 467 HD23 LEU 66 HD23 LEU 66 17.780 -22.398 -3.421 468 HA PRO 67 HA PRO 67 12.268 -25.620 -5.565 469 HB2 PRO 67 HB2 PRO 67 10.296 -25.667 -3.318 470 HB3 PRO 67 HB3 PRO 67 10.240 -26.506 -4.879 471 HG2 PRO 67 HG2 PRO 67 10.833 -27.844 -2.697 472 HG3 PRO 67 HG3 PRO 67 11.733 -28.144 -4.195 473 HD2 PRO 67 HD2 PRO 67 12.576 -26.572 -1.775 474 HD3 PRO 67 HD3 PRO 67 13.533 -27.680 -2.787 475 HA PRO 68 HA PRO 68 11.960 -21.119 -5.035 476 HB2 PRO 68 HB2 PRO 68 9.813 -21.265 -7.099 477 HB3 PRO 68 HB3 PRO 68 11.298 -20.295 -7.081 478 HG2 PRO 68 HG2 PRO 68 11.092 -22.393 -8.666 479 HG3 PRO 68 HG3 PRO 68 12.610 -22.047 -7.815 480 HD2 PRO 68 HD2 PRO 68 10.502 -24.089 -7.148 481 HD3 PRO 68 HD3 PRO 68 12.274 -24.243 -7.105 482 H LEU 69 H LEU 69 10.693 -19.715 -3.860 483 HA LEU 69 HA LEU 69 8.536 -20.737 -2.332 484 HB2 LEU 69 HB2 LEU 69 9.517 -17.907 -2.772 485 HB3 LEU 69 HB3 LEU 69 8.277 -18.345 -1.601 486 HG LEU 69 HG LEU 69 11.042 -19.593 -1.625 487 HD11 LEU 69 HD11 LEU 69 11.309 -17.212 -1.213 488 HD12 LEU 69 HD12 LEU 69 11.477 -18.065 0.323 489 HD13 LEU 69 HD13 LEU 69 9.975 -17.222 -0.061 490 HD21 LEU 69 HD21 LEU 69 8.752 -19.524 0.367 491 HD22 LEU 69 HD22 LEU 69 10.373 -20.079 0.781 492 HD23 LEU 69 HD23 LEU 69 9.429 -20.942 -0.431 493 H GLU 70 H GLU 70 6.336 -20.194 -2.362 494 HA GLU 70 HA GLU 70 5.327 -18.991 -4.866 495 HB2 GLU 70 HB2 GLU 70 4.251 -21.483 -3.514 496 HB3 GLU 70 HB3 GLU 70 3.510 -20.672 -4.896 497 HG2 GLU 70 HG2 GLU 70 5.570 -21.053 -6.215 498 HG3 GLU 70 HG3 GLU 70 6.292 -21.882 -4.838 499 H THR 71 H THR 71 5.291 -17.104 -3.365 500 HA THR 71 HA THR 71 2.684 -16.985 -1.994 501 HB THR 71 HB THR 71 5.258 -15.839 -0.862 502 HG1 THR 71 HG1 THR 71 4.976 -17.468 0.695 503 HG21 THR 71 HG21 THR 71 2.430 -15.989 0.233 504 HG22 THR 71 HG22 THR 71 3.266 -14.525 -0.285 505 HG23 THR 71 HG23 THR 71 3.836 -15.410 1.131 506 H VAL 72 H VAL 72 1.519 -15.264 -2.678 507 HA VAL 72 HA VAL 72 2.958 -12.947 -3.811 508 HB VAL 72 HB VAL 72 1.215 -12.774 -5.567 509 HG11 VAL 72 HG11 VAL 72 1.966 -14.803 -6.871 510 HG12 VAL 72 HG12 VAL 72 2.770 -15.370 -5.409 511 HG13 VAL 72 HG13 VAL 72 3.280 -13.862 -6.170 512 HG21 VAL 72 HG21 VAL 72 -0.288 -14.683 -5.973 513 HG22 VAL 72 HG22 VAL 72 -0.580 -14.013 -4.369 514 HG23 VAL 72 HG23 VAL 72 0.346 -15.504 -4.545 515 H GLY 73 H GLY 73 1.677 -10.972 -3.886 516 HA2 GLY 73 HA2 GLY 73 -0.621 -10.858 -2.057 517 HA3 GLY 73 HA3 GLY 73 0.789 -9.868 -1.688 518 H ASP 74 H ASP 74 -1.688 -8.696 -2.132 519 HA ASP 74 HA ASP 74 -1.072 -6.902 -4.296 520 HB2 ASP 74 HB2 ASP 74 -2.259 -8.966 -5.326 521 HB3 ASP 74 HB3 ASP 74 -3.711 -8.322 -4.556 522 H ILE 75 H ILE 75 -2.575 -5.097 -4.399 523 HA ILE 75 HA ILE 75 -3.580 -4.409 -1.768 524 HB ILE 75 HB ILE 75 -2.280 -2.781 -3.122 525 HG12 ILE 75 HG12 ILE 75 -5.113 -1.777 -2.776 526 HG13 ILE 75 HG13 ILE 75 -4.079 -2.144 -1.396 527 HG21 ILE 75 HG21 ILE 75 -3.349 -1.693 -5.060 528 HG22 ILE 75 HG22 ILE 75 -4.715 -2.800 -4.933 529 HG23 ILE 75 HG23 ILE 75 -3.117 -3.418 -5.354 530 HD11 ILE 75 HD11 ILE 75 -3.578 -0.093 -3.572 531 HD12 ILE 75 HD12 ILE 75 -2.348 -0.587 -2.407 532 HD13 ILE 75 HD13 ILE 75 -3.823 0.204 -1.850 533 H ASP 76 H ASP 76 -4.825 -5.142 -4.967 534 HA ASP 76 HA ASP 76 -7.582 -4.759 -4.063 535 HB2 ASP 76 HB2 ASP 76 -6.486 -5.336 -6.821 536 HB3 ASP 76 HB3 ASP 76 -8.178 -5.022 -6.436 537 H VAL 77 H VAL 77 -9.181 -6.412 -4.787 538 HA VAL 77 HA VAL 77 -8.324 -9.041 -3.904 539 HB VAL 77 HB VAL 77 -11.040 -8.039 -4.835 540 HG11 VAL 77 HG11 VAL 77 -11.881 -10.083 -3.642 541 HG12 VAL 77 HG12 VAL 77 -10.209 -10.623 -3.476 542 HG13 VAL 77 HG13 VAL 77 -10.926 -10.456 -5.078 543 HG21 VAL 77 HG21 VAL 77 -11.565 -8.052 -2.405 544 HG22 VAL 77 HG22 VAL 77 -10.265 -6.922 -2.790 545 HG23 VAL 77 HG23 VAL 77 -9.891 -8.485 -2.061 546 H TYR 78 H TYR 78 -7.759 -10.684 -5.195 547 HA TYR 78 HA TYR 78 -8.530 -10.613 -8.048 548 HB2 TYR 78 HB2 TYR 78 -6.171 -9.805 -7.694 549 HB3 TYR 78 HB3 TYR 78 -5.788 -11.386 -7.017 550 HD1 TYR 78 HD1 TYR 78 -6.920 -9.610 -10.080 551 HD2 TYR 78 HD2 TYR 78 -5.466 -13.300 -8.428 552 HE1 TYR 78 HE1 TYR 78 -6.559 -10.494 -12.370 553 HE2 TYR 78 HE2 TYR 78 -5.105 -14.183 -10.719 554 HH TYR 78 HH TYR 78 -5.094 -12.241 -13.454 555 H SER 79 H SER 79 -10.022 -12.240 -7.927 556 HA SER 79 HA SER 79 -8.970 -14.920 -7.357 557 HB2 SER 79 HB2 SER 79 -11.053 -15.473 -6.079 558 HB3 SER 79 HB3 SER 79 -10.017 -14.302 -5.271 559 HG SER 79 HG SER 79 -11.631 -12.972 -5.352 560 HA PRO 80 HA PRO 80 -11.835 -14.576 -11.128 561 HB2 PRO 80 HB2 PRO 80 -10.052 -15.114 -13.104 562 HB3 PRO 80 HB3 PRO 80 -10.320 -13.470 -12.487 563 HG2 PRO 80 HG2 PRO 80 -8.144 -15.402 -11.828 564 HG3 PRO 80 HG3 PRO 80 -8.044 -13.664 -12.164 565 HD2 PRO 80 HD2 PRO 80 -8.013 -14.665 -9.625 566 HD3 PRO 80 HD3 PRO 80 -8.700 -13.072 -10.018 567 HA PRO 81 HA PRO 81 -12.386 -19.028 -11.093 568 HB2 PRO 81 HB2 PRO 81 -13.094 -18.824 -13.990 569 HB3 PRO 81 HB3 PRO 81 -14.009 -19.551 -12.652 570 HG2 PRO 81 HG2 PRO 81 -14.756 -17.235 -13.658 571 HG3 PRO 81 HG3 PRO 81 -14.790 -17.504 -11.904 572 HD2 PRO 81 HD2 PRO 81 -12.777 -15.972 -13.532 573 HD3 PRO 81 HD3 PRO 81 -13.480 -15.574 -11.948 574 H GLU 82 H GLU 82 -11.081 -20.786 -11.442 575 HA GLU 82 HA GLU 82 -8.619 -20.413 -12.887 576 HB2 GLU 82 HB2 GLU 82 -9.768 -22.809 -11.435 577 HB3 GLU 82 HB3 GLU 82 -8.149 -22.752 -12.136 578 HG2 GLU 82 HG2 GLU 82 -7.601 -20.808 -10.714 579 HG3 GLU 82 HG3 GLU 82 -9.214 -20.873 -10.007 580 HA PRO 83 HA PRO 83 -9.951 -22.191 -16.753 581 HB2 PRO 83 HB2 PRO 83 -7.647 -23.249 -17.741 582 HB3 PRO 83 HB3 PRO 83 -7.940 -21.500 -17.664 583 HG2 PRO 83 HG2 PRO 83 -6.366 -23.234 -15.816 584 HG3 PRO 83 HG3 PRO 83 -5.970 -21.635 -16.471 585 HD2 PRO 83 HD2 PRO 83 -6.952 -21.965 -13.955 586 HD3 PRO 83 HD3 PRO 83 -7.303 -20.521 -14.931 587 H GLU 84 H GLU 84 -10.586 -24.157 -17.692 588 HA GLU 84 HA GLU 84 -10.231 -26.532 -15.978 589 HB2 GLU 84 HB2 GLU 84 -12.317 -25.896 -18.083 590 HB3 GLU 84 HB3 GLU 84 -12.234 -27.401 -17.170 591 HG2 GLU 84 HG2 GLU 84 -13.761 -26.188 -15.898 592 HG3 GLU 84 HG3 GLU 84 -12.260 -25.808 -15.069 593 H SER 85 H SER 85 -9.480 -28.451 -16.807 594 HA SER 85 HA SER 85 -8.826 -28.624 -19.658 595 HB2 SER 85 HB2 SER 85 -6.498 -29.189 -19.235 596 HB3 SER 85 HB3 SER 85 -6.850 -27.599 -18.563 597 HG SER 85 HG SER 85 -6.572 -28.366 -16.612 598 H GLU 86 H GLU 86 -8.134 -30.759 -20.302 599 HA GLU 86 HA GLU 86 -8.988 -32.920 -18.474 600 HB2 GLU 86 HB2 GLU 86 -10.773 -32.383 -20.145 601 HB3 GLU 86 HB3 GLU 86 -9.635 -32.784 -21.430 602 HG2 GLU 86 HG2 GLU 86 -11.000 -34.741 -20.991 603 HG3 GLU 86 HG3 GLU 86 -9.370 -35.061 -20.409 604 HA PRO 87 HA PRO 87 -4.641 -33.801 -19.893 605 HB2 PRO 87 HB2 PRO 87 -5.024 -35.904 -17.795 606 HB3 PRO 87 HB3 PRO 87 -3.639 -34.830 -18.076 607 HG2 PRO 87 HG2 PRO 87 -5.278 -34.357 -16.077 608 HG3 PRO 87 HG3 PRO 87 -4.674 -33.018 -17.070 609 HD2 PRO 87 HD2 PRO 87 -7.378 -34.333 -17.124 610 HD3 PRO 87 HD3 PRO 87 -6.959 -32.611 -17.284 611 H ALA 88 H ALA 88 -4.007 -35.243 -21.417 612 HA ALA 88 HA ALA 88 -5.232 -37.867 -21.661 613 HB1 ALA 88 HB1 ALA 88 -5.783 -37.348 -24.125 614 HB2 ALA 88 HB2 ALA 88 -5.721 -35.652 -23.645 615 HB3 ALA 88 HB3 ALA 88 -6.894 -36.738 -22.897 616 H TYR 89 H TYR 89 -4.197 -39.172 -23.330 617 HA TYR 89 HA TYR 89 -1.382 -38.928 -23.324 618 HB2 TYR 89 HB2 TYR 89 -3.224 -40.599 -25.045 619 HB3 TYR 89 HB3 TYR 89 -1.469 -40.766 -25.028 620 HD1 TYR 89 HD1 TYR 89 -4.580 -41.308 -23.158 621 HD2 TYR 89 HD2 TYR 89 -0.295 -41.579 -23.021 622 HE1 TYR 89 HE1 TYR 89 -4.734 -42.740 -21.139 623 HE2 TYR 89 HE2 TYR 89 -0.450 -43.010 -21.001 624 HH TYR 89 HH TYR 89 -2.851 -44.665 -20.103 625 H THR 90 H THR 90 -3.843 -38.066 -25.716 626 HA THR 90 HA THR 90 -1.948 -37.302 -27.746 627 HB THR 90 HB THR 90 -3.914 -36.438 -28.941 628 HG1 THR 90 HG1 THR 90 -5.188 -36.991 -26.476 629 HG21 THR 90 HG21 THR 90 -4.195 -39.139 -27.614 630 HG22 THR 90 HG22 THR 90 -3.590 -38.778 -29.231 631 HG23 THR 90 HG23 THR 90 -5.306 -38.586 -28.869 632 HA PRO 91 HA PRO 91 -0.992 -33.114 -26.679 633 HB2 PRO 91 HB2 PRO 91 -2.256 -32.123 -29.198 634 HB3 PRO 91 HB3 PRO 91 -0.616 -31.853 -28.577 635 HG2 PRO 91 HG2 PRO 91 -1.013 -33.520 -30.574 636 HG3 PRO 91 HG3 PRO 91 0.132 -33.926 -29.280 637 HD2 PRO 91 HD2 PRO 91 -2.662 -34.952 -29.712 638 HD3 PRO 91 HD3 PRO 91 -1.208 -35.837 -29.189 639 HA PRO 92 HA PRO 92 -4.668 -31.434 -24.709 640 HB2 PRO 92 HB2 PRO 92 -3.342 -28.766 -24.888 641 HB3 PRO 92 HB3 PRO 92 -3.995 -29.611 -23.470 642 HG2 PRO 92 HG2 PRO 92 -1.390 -29.449 -23.843 643 HG3 PRO 92 HG3 PRO 92 -2.124 -30.947 -23.242 644 HD2 PRO 92 HD2 PRO 92 -1.137 -30.314 -26.010 645 HD3 PRO 92 HD3 PRO 92 -0.976 -31.816 -25.072 646 HA PRO 93 HA PRO 93 -7.060 -29.730 -28.093 647 HB2 PRO 93 HB2 PRO 93 -9.198 -28.649 -26.796 648 HB3 PRO 93 HB3 PRO 93 -8.965 -30.400 -26.977 649 HG2 PRO 93 HG2 PRO 93 -8.362 -28.646 -24.639 650 HG3 PRO 93 HG3 PRO 93 -9.130 -30.242 -24.680 651 HD2 PRO 93 HD2 PRO 93 -6.513 -29.923 -24.029 652 HD3 PRO 93 HD3 PRO 93 -7.105 -31.365 -24.883 653 H ALA 94 H ALA 94 -7.742 -27.758 -29.083 654 HA ALA 94 HA ALA 94 -6.087 -25.510 -28.529 655 HB1 ALA 94 HB1 ALA 94 -8.486 -25.695 -30.368 656 HB2 ALA 94 HB2 ALA 94 -6.840 -26.137 -30.820 657 HB3 ALA 94 HB3 ALA 94 -7.224 -24.464 -30.415 658 H ALA 95 H ALA 95 -6.693 -23.443 -27.844 659 HA ALA 95 HA ALA 95 -9.365 -22.890 -26.940 660 HB1 ALA 95 HB1 ALA 95 -7.416 -22.894 -24.695 661 HB2 ALA 95 HB2 ALA 95 -8.041 -24.460 -25.240 662 HB3 ALA 95 HB3 ALA 95 -9.155 -23.200 -24.684 663 HA PRO 96 HA PRO 96 -7.772 -18.777 -27.485 664 HB2 PRO 96 HB2 PRO 96 -9.400 -17.266 -25.917 665 HB3 PRO 96 HB3 PRO 96 -9.954 -18.026 -27.423 666 HG2 PRO 96 HG2 PRO 96 -10.320 -18.928 -24.603 667 HG3 PRO 96 HG3 PRO 96 -11.488 -18.903 -25.936 668 HD2 PRO 96 HD2 PRO 96 -10.184 -21.175 -25.185 669 HD3 PRO 96 HD3 PRO 96 -10.681 -20.868 -26.864 670 H VAL 97 H VAL 97 -6.344 -17.300 -26.627 671 HA VAL 97 HA VAL 97 -5.103 -17.996 -24.101 672 HB VAL 97 HB VAL 97 -3.459 -16.231 -24.681 673 HG11 VAL 97 HG11 VAL 97 -3.056 -18.467 -25.509 674 HG12 VAL 97 HG12 VAL 97 -2.646 -17.329 -26.794 675 HG13 VAL 97 HG13 VAL 97 -4.166 -18.219 -26.856 676 HG21 VAL 97 HG21 VAL 97 -5.127 -15.891 -27.199 677 HG22 VAL 97 HG22 VAL 97 -3.619 -15.059 -26.818 678 HG23 VAL 97 HG23 VAL 97 -5.071 -14.728 -25.875 679 H PHE 98 H PHE 98 -7.174 -15.454 -25.349 680 HA PHE 98 HA PHE 98 -6.858 -13.579 -23.244 681 HB2 PHE 98 HB2 PHE 98 -7.872 -13.057 -25.454 682 HB3 PHE 98 HB3 PHE 98 -9.260 -14.062 -25.035 683 HD1 PHE 98 HD1 PHE 98 -7.351 -11.016 -24.050 684 HD2 PHE 98 HD2 PHE 98 -11.019 -13.219 -23.656 685 HE1 PHE 98 HE1 PHE 98 -8.389 -9.084 -22.893 686 HE2 PHE 98 HE2 PHE 98 -12.055 -11.286 -22.499 687 HZ PHE 98 HZ PHE 98 -10.739 -9.217 -22.117 688 H ASP 99 H ASP 99 -7.613 -13.589 -21.201 689 HA ASP 99 HA ASP 99 -10.056 -14.879 -20.435 690 HB2 ASP 99 HB2 ASP 99 -8.426 -16.804 -20.595 691 HB3 ASP 99 HB3 ASP 99 -7.499 -16.040 -19.309 692 H ARG 100 H ARG 100 -6.961 -13.498 -19.460 693 HA ARG 100 HA ARG 100 -7.506 -12.780 -16.822 694 HB2 ARG 100 HB2 ARG 100 -5.847 -11.374 -18.928 695 HB3 ARG 100 HB3 ARG 100 -5.900 -10.849 -17.244 696 HG2 ARG 100 HG2 ARG 100 -5.241 -13.203 -16.587 697 HG3 ARG 100 HG3 ARG 100 -4.966 -13.530 -18.298 698 HD2 ARG 100 HD2 ARG 100 -3.629 -11.298 -16.746 699 HD3 ARG 100 HD3 ARG 100 -2.884 -12.857 -17.084 700 HE ARG 100 HE ARG 100 -3.351 -10.694 -18.987 701 HH11 ARG 100 HH11 ARG 100 -2.518 -14.073 -18.541 702 HH12 ARG 100 HH12 ARG 100 -1.790 -14.214 -20.105 703 HH21 ARG 100 HH21 ARG 100 -2.401 -10.929 -21.012 704 HH22 ARG 100 HH22 ARG 100 -1.726 -12.451 -21.492 705 H ASP 101 H ASP 101 -7.660 -10.391 -19.507 706 HA ASP 101 HA ASP 101 -9.029 -8.600 -19.862 707 HB2 ASP 101 HB2 ASP 101 -10.644 -10.549 -20.069 708 HB3 ASP 101 HB3 ASP 101 -11.135 -10.212 -18.413 709 H GLU 102 H GLU 102 -7.369 -8.139 -17.819 710 HA GLU 102 HA GLU 102 -8.813 -7.275 -15.448 711 HB2 GLU 102 HB2 GLU 102 -5.909 -6.928 -16.244 712 HB3 GLU 102 HB3 GLU 102 -6.591 -6.516 -14.673 713 HG2 GLU 102 HG2 GLU 102 -6.591 -9.294 -15.897 714 HG3 GLU 102 HG3 GLU 102 -5.478 -8.741 -14.651 715 H VAL 103 H VAL 103 -8.254 -4.962 -14.652 716 HA VAL 103 HA VAL 103 -9.372 -3.107 -16.488 717 HB VAL 103 HB VAL 103 -8.859 -1.408 -14.747 718 HG11 VAL 103 HG11 VAL 103 -10.310 -2.347 -13.040 719 HG12 VAL 103 HG12 VAL 103 -9.962 -3.985 -13.595 720 HG13 VAL 103 HG13 VAL 103 -10.875 -2.881 -14.623 721 HG21 VAL 103 HG21 VAL 103 -7.639 -3.709 -13.190 722 HG22 VAL 103 HG22 VAL 103 -7.724 -2.016 -12.705 723 HG23 VAL 103 HG23 VAL 103 -6.677 -2.500 -14.038 724 H ALA 104 H ALA 104 -8.139 -0.842 -16.637 725 HA ALA 104 HA ALA 104 -5.537 -1.440 -17.908 726 HB1 ALA 104 HB1 ALA 104 -5.963 0.696 -19.173 727 HB2 ALA 104 HB2 ALA 104 -7.567 0.736 -18.442 728 HB3 ALA 104 HB3 ALA 104 -7.118 -0.596 -19.508 729 H GLU 105 H GLU 105 -4.165 -1.185 -16.169 730 HA GLU 105 HA GLU 105 -3.592 1.556 -15.392 731 HB2 GLU 105 HB2 GLU 105 -5.319 0.643 -13.739 732 HB3 GLU 105 HB3 GLU 105 -4.071 -0.473 -13.201 733 HG2 GLU 105 HG2 GLU 105 -4.031 1.502 -11.747 734 HG3 GLU 105 HG3 GLU 105 -2.582 1.482 -12.746 735 H GLN 106 H GLN 106 -1.497 1.764 -14.425 736 HA GLN 106 HA GLN 106 0.395 -0.189 -15.381 737 HB2 GLN 106 HB2 GLN 106 0.786 2.337 -13.759 738 HB3 GLN 106 HB3 GLN 106 2.087 1.366 -14.442 739 HG2 GLN 106 HG2 GLN 106 -0.126 2.684 -16.048 740 HG3 GLN 106 HG3 GLN 106 1.512 3.310 -15.885 741 HE21 GLN 106 HE21 GLN 106 -0.374 1.635 -18.020 742 HE22 GLN 106 HE22 GLN 106 0.816 0.697 -18.784 743 H LEU 107 H LEU 107 -1.467 -0.105 -12.608 744 HA LEU 107 HA LEU 107 0.389 -0.850 -10.591 745 HB2 LEU 107 HB2 LEU 107 -2.116 -0.064 -10.422 746 HB3 LEU 107 HB3 LEU 107 -2.477 -1.774 -10.629 747 HG LEU 107 HG LEU 107 -0.779 -2.166 -8.705 748 HD11 LEU 107 HD11 LEU 107 -1.490 0.709 -8.073 749 HD12 LEU 107 HD12 LEU 107 0.027 0.261 -8.858 750 HD13 LEU 107 HD13 LEU 107 -0.336 -0.334 -7.238 751 HD21 LEU 107 HD21 LEU 107 -2.548 -1.622 -6.992 752 HD22 LEU 107 HD22 LEU 107 -3.151 -2.535 -8.375 753 HD23 LEU 107 HD23 LEU 107 -3.452 -0.801 -8.264 754 H VAL 108 H VAL 108 1.752 -2.438 -11.472 755 HA VAL 108 HA VAL 108 2.433 -4.499 -12.252 756 HB VAL 108 HB VAL 108 1.763 -6.349 -10.757 757 HG11 VAL 108 HG11 VAL 108 2.663 -5.427 -8.753 758 HG12 VAL 108 HG12 VAL 108 2.066 -3.812 -9.143 759 HG13 VAL 108 HG13 VAL 108 3.390 -4.511 -10.073 760 HG21 VAL 108 HG21 VAL 108 -0.668 -5.614 -10.621 761 HG22 VAL 108 HG22 VAL 108 -0.146 -4.378 -9.478 762 HG23 VAL 108 HG23 VAL 108 0.060 -6.086 -9.084 763 H GLY 109 H GLY 109 1.080 -7.009 -12.413 764 HA2 GLY 109 HA2 GLY 109 -0.712 -8.094 -13.525 765 HA3 GLY 109 HA3 GLY 109 -1.199 -6.547 -14.205 766 H VAL 110 H VAL 110 -1.327 -7.713 -16.229 767 HA VAL 110 HA VAL 110 1.271 -8.354 -17.474 768 HB VAL 110 HB VAL 110 -1.550 -9.051 -18.364 769 HG11 VAL 110 HG11 VAL 110 -0.303 -10.622 -19.915 770 HG12 VAL 110 HG12 VAL 110 1.174 -9.760 -19.490 771 HG13 VAL 110 HG13 VAL 110 -0.135 -8.913 -20.312 772 HG21 VAL 110 HG21 VAL 110 0.642 -10.655 -17.018 773 HG22 VAL 110 HG22 VAL 110 -0.760 -11.391 -17.789 774 HG23 VAL 110 HG23 VAL 110 -0.975 -10.329 -16.398 775 H SER 111 H SER 111 2.074 -7.155 -19.064 776 HA SER 111 HA SER 111 0.360 -5.121 -20.361 777 HB2 SER 111 HB2 SER 111 1.684 -3.972 -18.659 778 HB3 SER 111 HB3 SER 111 3.161 -4.694 -19.290 779 HG SER 111 HG SER 111 1.639 -2.597 -20.245 780 H ALA 112 H ALA 112 0.201 -6.110 -22.313 781 HA ALA 112 HA ALA 112 2.616 -6.199 -23.954 782 HB1 ALA 112 HB1 ALA 112 2.654 -8.444 -24.389 783 HB2 ALA 112 HB2 ALA 112 0.914 -8.632 -24.151 784 HB3 ALA 112 HB3 ALA 112 1.989 -8.512 -22.757 785 H ALA 113 H ALA 113 2.174 -6.420 -26.223 786 HA ALA 113 HA ALA 113 -0.590 -6.114 -27.117 787 HB1 ALA 113 HB1 ALA 113 1.464 -4.072 -27.962 788 HB2 ALA 113 HB2 ALA 113 0.411 -3.806 -26.573 789 HB3 ALA 113 HB3 ALA 113 -0.286 -4.020 -28.181 790 H SER 114 H SER 114 -0.813 -6.427 -29.426 791 HA SER 114 HA SER 114 1.574 -7.404 -30.833 792 HB2 SER 114 HB2 SER 114 0.610 -9.393 -29.795 793 HB3 SER 114 HB3 SER 114 -0.969 -9.007 -30.475 794 HG SER 114 HG SER 114 -0.332 -9.949 -32.230 795 H ALA 115 H ALA 115 1.556 -7.080 -32.993 796 HA ALA 115 HA ALA 115 -0.760 -6.697 -34.581 797 HB1 ALA 115 HB1 ALA 115 -1.127 -4.533 -33.877 798 HB2 ALA 115 HB2 ALA 115 0.092 -4.216 -35.114 799 HB3 ALA 115 HB3 ALA 115 0.556 -4.288 -33.412 800 H ALA 116 H ALA 116 -0.046 -7.646 -36.378 801 HA ALA 116 HA ALA 116 2.201 -6.644 -37.793 802 HB1 ALA 116 HB1 ALA 116 2.693 -9.484 -37.066 803 HB2 ALA 116 HB2 ALA 116 3.035 -8.266 -35.835 804 HB3 ALA 116 HB3 ALA 116 3.842 -8.188 -37.401 805 H ALA 117 H ALA 117 -0.003 -9.337 -37.264 806 HA ALA 117 HA ALA 117 -0.812 -9.324 -40.048 807 HB1 ALA 117 HB1 ALA 117 -0.381 -11.912 -40.093 808 HB2 ALA 117 HB2 ALA 117 0.851 -11.529 -38.890 809 HB3 ALA 117 HB3 ALA 117 0.924 -10.795 -40.491 810 H SER 118 H SER 118 -2.687 -10.578 -40.465 811 HA SER 118 HA SER 118 -4.043 -11.880 -38.237 812 HB2 SER 118 HB2 SER 118 -4.728 -9.522 -37.996 813 HB3 SER 118 HB3 SER 118 -5.225 -9.490 -39.686 814 HG SER 118 HG SER 118 -6.963 -10.593 -39.194 815 H ALA 119 H ALA 119 -5.466 -13.450 -38.967 816 HA ALA 119 HA ALA 119 -5.815 -13.625 -41.896 817 HB1 ALA 119 HB1 ALA 119 -5.651 -16.139 -41.565 818 HB2 ALA 119 HB2 ALA 119 -5.028 -15.795 -39.952 819 HB3 ALA 119 HB3 ALA 119 -4.145 -15.240 -41.374 820 H PHE 120 H PHE 120 -7.699 -14.618 -42.634 821 HA PHE 120 HA PHE 120 -9.932 -14.559 -40.721 822 HB2 PHE 120 HB2 PHE 120 -9.874 -14.559 -43.746 823 HB3 PHE 120 HB3 PHE 120 -11.351 -14.564 -42.778 824 HD1 PHE 120 HD1 PHE 120 -8.473 -12.585 -43.899 825 HD2 PHE 120 HD2 PHE 120 -11.945 -12.625 -41.368 826 HE1 PHE 120 HE1 PHE 120 -8.320 -10.124 -43.648 827 HE2 PHE 120 HE2 PHE 120 -11.790 -10.163 -41.119 828 HZ PHE 120 HZ PHE 120 -9.976 -8.912 -42.257 829 H GLY 121 H GLY 121 -7.885 -16.871 -41.383 830 HA2 GLY 121 HA2 GLY 121 -8.337 -19.138 -40.725 831 HA3 GLY 121 HA3 GLY 121 -9.940 -18.986 -41.438 832 H SER 122 H SER 122 -7.388 -20.725 -41.848 833 HA SER 122 HA SER 122 -6.595 -20.290 -44.569 834 HB2 SER 122 HB2 SER 122 -6.296 -22.704 -42.767 835 HB3 SER 122 HB3 SER 122 -5.530 -22.526 -44.344 836 HG SER 122 HG SER 122 -4.224 -21.018 -43.554 837 H LEU 123 H LEU 123 -7.134 -21.506 -46.402 838 HA LEU 123 HA LEU 123 -9.824 -22.698 -46.308 839 HB2 LEU 123 HB2 LEU 123 -8.152 -21.378 -48.412 840 HB3 LEU 123 HB3 LEU 123 -9.297 -22.607 -48.937 841 HG LEU 123 HG LEU 123 -11.061 -21.336 -47.572 842 HD11 LEU 123 HD11 LEU 123 -8.804 -19.315 -47.602 843 HD12 LEU 123 HD12 LEU 123 -9.657 -19.950 -46.196 844 HD13 LEU 123 HD13 LEU 123 -10.487 -18.874 -47.318 845 HD21 LEU 123 HD21 LEU 123 -11.340 -19.613 -49.378 846 HD22 LEU 123 HD22 LEU 123 -11.038 -21.235 -50.004 847 HD23 LEU 123 HD23 LEU 123 -9.739 -20.043 -49.978 848 H SER 124 H SER 124 -9.812 -24.810 -45.919 849 HA SER 124 HA SER 124 -8.191 -26.558 -47.606 850 HB2 SER 124 HB2 SER 124 -7.364 -27.847 -45.718 851 HB3 SER 124 HB3 SER 124 -6.861 -26.170 -45.534 852 HG SER 124 HG SER 124 -7.957 -27.417 -43.699 853 H SER 125 H SER 125 -8.897 -28.817 -47.388 854 HA SER 125 HA SER 125 -11.545 -29.189 -46.251 855 HB2 SER 125 HB2 SER 125 -11.970 -28.343 -48.540 856 HB3 SER 125 HB3 SER 125 -10.997 -29.655 -49.196 857 HG SER 125 HG SER 125 -12.738 -30.812 -49.080 858 H ALA 126 H ALA 126 -12.239 -31.580 -46.743 859 HA ALA 126 HA ALA 126 -10.104 -33.249 -45.812 860 HB1 ALA 126 HB1 ALA 126 -12.042 -34.068 -44.915 861 HB2 ALA 126 HB2 ALA 126 -12.057 -35.029 -46.396 862 HB3 ALA 126 HB3 ALA 126 -13.018 -33.552 -46.291 863 H LEU 127 H LEU 127 -9.399 -35.228 -46.863 864 HA LEU 127 HA LEU 127 -9.943 -35.794 -49.577 865 HB2 LEU 127 HB2 LEU 127 -8.445 -33.594 -49.537 866 HB3 LEU 127 HB3 LEU 127 -7.138 -34.752 -49.301 867 HG LEU 127 HG LEU 127 -9.171 -35.079 -51.520 868 HD11 LEU 127 HD11 LEU 127 -8.051 -32.863 -51.738 869 HD12 LEU 127 HD12 LEU 127 -7.596 -33.973 -53.029 870 HD13 LEU 127 HD13 LEU 127 -6.487 -33.676 -51.693 871 HD21 LEU 127 HD21 LEU 127 -7.203 -36.337 -52.519 872 HD22 LEU 127 HD22 LEU 127 -7.883 -37.066 -51.062 873 HD23 LEU 127 HD23 LEU 127 -6.384 -36.140 -50.969 874 H LEU 128 H LEU 128 -10.156 -37.639 -47.955 875 HA LEU 128 HA LEU 128 -7.799 -38.939 -46.984 876 HB2 LEU 128 HB2 LEU 128 -10.697 -39.712 -47.256 877 HB3 LEU 128 HB3 LEU 128 -9.493 -40.916 -46.805 878 HG LEU 128 HG LEU 128 -8.751 -39.261 -44.982 879 HD11 LEU 128 HD11 LEU 128 -9.807 -37.241 -45.740 880 HD12 LEU 128 HD12 LEU 128 -10.647 -37.723 -44.267 881 HD13 LEU 128 HD13 LEU 128 -11.381 -38.030 -45.840 882 HD21 LEU 128 HD21 LEU 128 -10.650 -39.937 -43.486 883 HD22 LEU 128 HD22 LEU 128 -9.993 -41.278 -44.424 884 HD23 LEU 128 HD23 LEU 128 -11.510 -40.521 -44.910 885 H MET 129 H MET 129 -6.680 -40.665 -47.795 886 HA MET 129 HA MET 129 -7.170 -41.325 -50.637 887 HB2 MET 129 HB2 MET 129 -4.617 -41.459 -49.010 888 HB3 MET 129 HB3 MET 129 -4.771 -41.975 -50.688 889 HG2 MET 129 HG2 MET 129 -5.437 -39.699 -51.344 890 HG3 MET 129 HG3 MET 129 -5.323 -39.173 -49.663 891 HE1 MET 129 HE1 MET 129 -2.296 -37.442 -51.361 892 HE2 MET 129 HE2 MET 129 -3.731 -37.240 -50.357 893 HE3 MET 129 HE3 MET 129 -3.903 -37.764 -52.029 894 HA PRO 130 HA PRO 130 -8.072 -45.504 -49.387 895 HB2 PRO 130 HB2 PRO 130 -7.263 -46.964 -51.541 896 HB3 PRO 130 HB3 PRO 130 -8.710 -45.937 -51.563 897 HG2 PRO 130 HG2 PRO 130 -5.975 -45.373 -52.617 898 HG3 PRO 130 HG3 PRO 130 -7.555 -45.050 -53.353 899 HD2 PRO 130 HD2 PRO 130 -6.123 -43.109 -52.095 900 HD3 PRO 130 HD3 PRO 130 -7.901 -43.123 -52.105 901 H LYS 131 H LYS 131 -7.141 -47.317 -48.452 902 HA LYS 131 HA LYS 131 -4.418 -48.100 -48.854 903 HB2 LYS 131 HB2 LYS 131 -4.243 -45.967 -47.447 904 HB3 LYS 131 HB3 LYS 131 -5.001 -46.889 -46.147 905 HG2 LYS 131 HG2 LYS 131 -3.198 -48.587 -46.317 906 HG3 LYS 131 HG3 LYS 131 -2.428 -47.628 -47.580 907 HD2 LYS 131 HD2 LYS 131 -3.027 -46.509 -44.833 908 HD3 LYS 131 HD3 LYS 131 -1.503 -47.307 -45.218 909 HE2 LYS 131 HE2 LYS 131 -1.154 -45.677 -47.073 910 HE3 LYS 131 HE3 LYS 131 -2.635 -44.850 -46.591 911 HZ1 LYS 131 HZ1 LYS 131 -0.050 -44.991 -45.216 912 HZ2 LYS 131 HZ2 LYS 131 -1.459 -44.848 -44.278 913 HZ3 LYS 131 HZ3 LYS 131 -1.082 -43.665 -45.437 914 H ASP 132 H ASP 132 -7.147 -48.049 -46.601 915 HA ASP 132 HA ASP 132 -8.134 -49.685 -45.310 916 HB2 ASP 132 HB2 ASP 132 -8.386 -50.389 -47.844 917 HB3 ASP 132 HB3 ASP 132 -7.326 -51.710 -47.361 918 H GLY 133 H GLY 133 -7.744 -52.190 -44.618 919 HA2 GLY 133 HA2 GLY 133 -5.459 -52.190 -42.955 920 HA3 GLY 133 HA3 GLY 133 -6.512 -53.567 -43.250 921 H LEU 134 H LEU 134 -5.897 -53.179 -46.243 922 HA LEU 134 HA LEU 134 -4.466 -54.006 -47.823 923 HB2 LEU 134 HB2 LEU 134 -2.815 -52.535 -46.174 924 HB3 LEU 134 HB3 LEU 134 -2.054 -54.121 -46.101 925 HG LEU 134 HG LEU 134 -2.814 -52.820 -48.729 926 HD11 LEU 134 HD11 LEU 134 -1.266 -51.294 -47.667 927 HD12 LEU 134 HD12 LEU 134 -0.370 -52.217 -48.874 928 HD13 LEU 134 HD13 LEU 134 -0.225 -52.625 -47.165 929 HD21 LEU 134 HD21 LEU 134 -2.420 -55.165 -48.959 930 HD22 LEU 134 HD22 LEU 134 -1.027 -55.111 -47.881 931 HD23 LEU 134 HD23 LEU 134 -0.930 -54.384 -49.485 932 H GLU 135 H GLU 135 -4.533 -56.030 -48.440 933 HA GLU 135 HA GLU 135 -4.869 -58.214 -46.678 934 HB2 GLU 135 HB2 GLU 135 -5.662 -58.121 -49.058 935 HB3 GLU 135 HB3 GLU 135 -3.989 -58.334 -49.572 936 HG2 GLU 135 HG2 GLU 135 -3.875 -60.472 -48.344 937 HG3 GLU 135 HG3 GLU 135 -5.541 -60.260 -47.812 938 H HIS 136 H HIS 136 -2.043 -56.999 -48.441 939 HA HIS 136 HA HIS 136 0.196 -57.444 -48.267 940 HB2 HIS 136 HB2 HIS 136 -0.309 -56.773 -45.884 941 HB3 HIS 136 HB3 HIS 136 -0.463 -58.487 -45.502 942 HD2 HIS 136 HD2 HIS 136 1.949 -59.585 -44.745 943 HE1 HIS 136 HE1 HIS 136 4.505 -56.832 -46.671 944 HE2 HIS 136 HE2 HIS 136 4.428 -58.878 -45.169 945 H HIS 137 H HIS 137 -0.306 -59.096 -49.915 946 HA HIS 137 HA HIS 137 -0.705 -61.825 -49.334 947 HB2 HIS 137 HB2 HIS 137 0.555 -60.421 -51.698 948 HB3 HIS 137 HB3 HIS 137 0.284 -62.163 -51.648 949 HD2 HIS 137 HD2 HIS 137 -2.347 -62.939 -52.187 950 HE1 HIS 137 HE1 HIS 137 -4.036 -59.070 -52.275 951 HE2 HIS 137 HE2 HIS 137 -4.486 -61.534 -52.699 952 H HIS 138 H HIS 138 2.244 -59.906 -49.753 953 HA HIS 138 HA HIS 138 4.464 -60.367 -49.381 954 HB2 HIS 138 HB2 HIS 138 3.430 -60.494 -47.066 955 HB3 HIS 138 HB3 HIS 138 3.423 -62.248 -47.254 956 HD2 HIS 138 HD2 HIS 138 5.762 -63.363 -46.320 957 HE1 HIS 138 HE1 HIS 138 8.289 -60.022 -46.842 958 HE2 HIS 138 HE2 HIS 138 8.177 -62.418 -46.011 959 H HIS 139 H HIS 139 3.079 -62.043 -51.351 960 HA HIS 139 HA HIS 139 3.389 -63.929 -52.619 961 HB2 HIS 139 HB2 HIS 139 5.705 -62.756 -52.554 962 HB3 HIS 139 HB3 HIS 139 6.176 -64.055 -51.459 963 HD2 HIS 139 HD2 HIS 139 5.797 -63.459 -55.237 964 HE1 HIS 139 HE1 HIS 139 6.147 -67.635 -54.727 965 HE2 HIS 139 HE2 HIS 139 6.150 -65.753 -56.433 966 H HIS 140 H HIS 140 2.084 -64.476 -50.275 967 HA HIS 140 HA HIS 140 3.236 -66.545 -48.711 968 HB2 HIS 140 HB2 HIS 140 0.961 -66.915 -47.872 969 HB3 HIS 140 HB3 HIS 140 1.340 -65.197 -47.922 970 HD2 HIS 140 HD2 HIS 140 -0.274 -63.686 -49.676 971 HE1 HIS 140 HE1 HIS 140 -2.560 -66.912 -51.152 972 HE2 HIS 140 HE2 HIS 140 -2.335 -64.382 -51.118 973 H HIS 141 H HIS 141 1.806 -66.565 -51.856 974 HA HIS 141 HA HIS 141 2.336 -69.401 -52.144 975 HB2 HIS 141 HB2 HIS 141 0.021 -69.291 -51.161 976 HB3 HIS 141 HB3 HIS 141 -0.484 -68.387 -52.588 977 HD2 HIS 141 HD2 HIS 141 -1.338 -70.042 -54.626 978 HE1 HIS 141 HE1 HIS 141 0.628 -73.573 -53.406 979 HE2 HIS 141 HE2 HIS 141 -0.959 -72.578 -55.119 Start of MODEL 18 1 H1 MET 1 HT1 MET 1 0.367 9.604 -9.332 2 H2 MET 1 HT2 MET 1 1.902 9.171 -9.918 3 H3 MET 1 HT3 MET 1 0.567 8.160 -10.199 4 HA MET 1 HA MET 1 1.452 9.778 -12.039 5 HB2 MET 1 HB2 MET 1 -0.652 8.196 -11.877 6 HB3 MET 1 HB3 MET 1 -1.533 9.698 -11.608 7 HG2 MET 1 HG2 MET 1 -1.576 9.234 -13.981 8 HG3 MET 1 HG3 MET 1 -0.497 10.604 -13.718 9 HE1 MET 1 HE1 MET 1 -0.428 9.150 -16.366 10 HE2 MET 1 HE2 MET 1 1.296 8.913 -16.637 11 HE3 MET 1 HE3 MET 1 0.721 10.417 -15.922 12 H SER 2 H SER 2 2.356 11.686 -11.079 13 HA SER 2 HA SER 2 0.500 13.933 -11.040 14 HB2 SER 2 HB2 SER 2 0.558 13.231 -8.690 15 HB3 SER 2 HB3 SER 2 2.317 13.292 -8.704 16 HG SER 2 HG SER 2 0.439 15.336 -8.648 17 H ASP 3 H ASP 3 1.565 15.972 -11.256 18 HA ASP 3 HA ASP 3 3.729 15.989 -13.044 19 HB2 ASP 3 HB2 ASP 3 2.541 18.155 -11.302 20 HB3 ASP 3 HB3 ASP 3 3.824 18.465 -12.467 21 H GLN 4 H GLN 4 5.891 16.657 -12.796 22 HA GLN 4 HA GLN 4 7.966 16.527 -11.845 23 HB2 GLN 4 HB2 GLN 4 6.431 17.904 -9.627 24 HB3 GLN 4 HB3 GLN 4 8.190 17.798 -9.704 25 HG2 GLN 4 HG2 GLN 4 8.166 18.957 -11.882 26 HG3 GLN 4 HG3 GLN 4 6.408 19.062 -11.809 27 HE21 GLN 4 HE21 GLN 4 6.127 21.317 -11.533 28 HE22 GLN 4 HE22 GLN 4 6.785 22.195 -10.236 29 H SER 5 H SER 5 6.193 14.196 -11.443 30 HA SER 5 HA SER 5 7.645 13.017 -9.171 31 HB2 SER 5 HB2 SER 5 5.448 13.703 -8.316 32 HB3 SER 5 HB3 SER 5 4.659 12.789 -9.597 33 HG SER 5 HG SER 5 4.931 11.709 -7.493 34 H GLN 6 H GLN 6 8.603 11.199 -9.774 35 HA GLN 6 HA GLN 6 7.601 9.746 -12.137 36 HB2 GLN 6 HB2 GLN 6 10.312 9.701 -10.786 37 HB3 GLN 6 HB3 GLN 6 9.866 8.722 -12.181 38 HG2 GLN 6 HG2 GLN 6 9.395 10.776 -13.471 39 HG3 GLN 6 HG3 GLN 6 9.856 11.753 -12.078 40 HE21 GLN 6 HE21 GLN 6 11.828 12.677 -12.742 41 HE22 GLN 6 HE22 GLN 6 13.161 11.778 -13.290 42 H GLU 7 H GLU 7 7.909 7.330 -12.035 43 HA GLU 7 HA GLU 7 7.258 5.323 -11.095 44 HB2 GLU 7 HB2 GLU 7 8.731 6.510 -8.723 45 HB3 GLU 7 HB3 GLU 7 8.244 4.822 -8.861 46 HG2 GLU 7 HG2 GLU 7 9.602 4.600 -10.916 47 HG3 GLU 7 HG3 GLU 7 10.102 6.284 -10.760 48 HA PRO 8 HA PRO 8 3.561 7.602 -9.247 49 HB2 PRO 8 HB2 PRO 8 1.758 5.786 -10.394 50 HB3 PRO 8 HB3 PRO 8 2.216 7.360 -11.067 51 HG2 PRO 8 HG2 PRO 8 3.239 4.654 -11.740 52 HG3 PRO 8 HG3 PRO 8 2.906 6.036 -12.800 53 HD2 PRO 8 HD2 PRO 8 5.424 5.417 -12.114 54 HD3 PRO 8 HD3 PRO 8 4.910 7.115 -12.241 55 H THR 9 H THR 9 3.328 7.159 -7.193 56 HA THR 9 HA THR 9 3.809 4.725 -5.904 57 HB THR 9 HB THR 9 2.676 5.707 -3.944 58 HG1 THR 9 HG1 THR 9 1.859 7.589 -5.885 59 HG21 THR 9 HG21 THR 9 4.152 7.578 -3.660 60 HG22 THR 9 HG22 THR 9 4.269 7.827 -5.402 61 HG23 THR 9 HG23 THR 9 5.004 6.404 -4.663 62 H MET 10 H MET 10 2.316 3.362 -4.729 63 HA MET 10 HA MET 10 0.409 2.170 -6.381 64 HB2 MET 10 HB2 MET 10 -0.270 0.869 -4.405 65 HB3 MET 10 HB3 MET 10 1.483 0.965 -4.548 66 HG2 MET 10 HG2 MET 10 1.429 2.894 -2.915 67 HG3 MET 10 HG3 MET 10 -0.287 2.566 -2.679 68 HE1 MET 10 HE1 MET 10 3.207 1.559 -2.557 69 HE2 MET 10 HE2 MET 10 2.861 -0.093 -3.058 70 HE3 MET 10 HE3 MET 10 3.369 0.229 -1.401 71 H GLU 11 H GLU 11 -0.115 4.450 -3.680 72 HA GLU 11 HA GLU 11 -2.909 4.388 -3.679 73 HB2 GLU 11 HB2 GLU 11 -0.963 6.573 -2.934 74 HB3 GLU 11 HB3 GLU 11 -2.703 6.701 -2.670 75 HG2 GLU 11 HG2 GLU 11 -2.696 4.750 -1.238 76 HG3 GLU 11 HG3 GLU 11 -1.015 4.411 -1.626 77 H GLU 12 H GLU 12 -0.675 6.289 -5.629 78 HA GLU 12 HA GLU 12 -2.617 8.017 -6.807 79 HB2 GLU 12 HB2 GLU 12 0.117 7.113 -7.732 80 HB3 GLU 12 HB3 GLU 12 -0.861 8.285 -8.617 81 HG2 GLU 12 HG2 GLU 12 -0.889 9.796 -6.730 82 HG3 GLU 12 HG3 GLU 12 -0.128 8.594 -5.694 83 H ILE 13 H ILE 13 -1.098 5.026 -7.954 84 HA ILE 13 HA ILE 13 -2.512 4.778 -10.368 85 HB ILE 13 HB ILE 13 -1.288 2.635 -8.609 86 HG12 ILE 13 HG12 ILE 13 0.327 4.339 -9.352 87 HG13 ILE 13 HG13 ILE 13 0.637 2.807 -10.151 88 HG21 ILE 13 HG21 ILE 13 -2.827 1.548 -10.133 89 HG22 ILE 13 HG22 ILE 13 -1.186 1.283 -10.727 90 HG23 ILE 13 HG23 ILE 13 -2.218 2.492 -11.494 91 HD11 ILE 13 HD11 ILE 13 -0.719 3.714 -12.132 92 HD12 ILE 13 HD12 ILE 13 0.835 4.491 -11.847 93 HD13 ILE 13 HD13 ILE 13 -0.653 5.284 -11.334 94 H LEU 14 H LEU 14 -3.245 3.308 -7.173 95 HA LEU 14 HA LEU 14 -5.535 1.893 -7.927 96 HB2 LEU 14 HB2 LEU 14 -4.744 3.130 -5.291 97 HB3 LEU 14 HB3 LEU 14 -6.025 1.940 -5.511 98 HG LEU 14 HG LEU 14 -3.197 1.401 -6.410 99 HD11 LEU 14 HD11 LEU 14 -4.307 0.360 -3.805 100 HD12 LEU 14 HD12 LEU 14 -3.526 1.941 -3.859 101 HD13 LEU 14 HD13 LEU 14 -2.627 0.503 -4.319 102 HD21 LEU 14 HD21 LEU 14 -5.302 0.038 -7.159 103 HD22 LEU 14 HD22 LEU 14 -5.254 -0.624 -5.532 104 HD23 LEU 14 HD23 LEU 14 -3.881 -0.835 -6.617 105 H ALA 15 H ALA 15 -5.136 5.146 -6.558 106 HA ALA 15 HA ALA 15 -7.842 5.864 -6.440 107 HB1 ALA 15 HB1 ALA 15 -6.367 7.308 -5.318 108 HB2 ALA 15 HB2 ALA 15 -6.884 8.253 -6.714 109 HB3 ALA 15 HB3 ALA 15 -5.307 7.464 -6.719 110 H SER 16 H SER 16 -5.451 6.476 -9.069 111 HA SER 16 HA SER 16 -7.080 7.826 -10.813 112 HB2 SER 16 HB2 SER 16 -4.885 5.835 -11.412 113 HB3 SER 16 HB3 SER 16 -5.596 6.919 -12.605 114 HG SER 16 HG SER 16 -4.822 8.653 -11.473 115 H ILE 17 H ILE 17 -6.884 4.320 -10.277 116 HA ILE 17 HA ILE 17 -8.437 3.526 -12.503 117 HB ILE 17 HB ILE 17 -8.107 2.243 -9.762 118 HG12 ILE 17 HG12 ILE 17 -6.936 1.454 -12.448 119 HG13 ILE 17 HG13 ILE 17 -6.104 2.536 -11.335 120 HG21 ILE 17 HG21 ILE 17 -10.159 1.357 -10.696 121 HG22 ILE 17 HG22 ILE 17 -8.903 0.155 -10.992 122 HG23 ILE 17 HG23 ILE 17 -9.433 1.216 -12.298 123 HD11 ILE 17 HD11 ILE 17 -5.521 0.014 -11.218 124 HD12 ILE 17 HD12 ILE 17 -7.089 -0.172 -10.429 125 HD13 ILE 17 HD13 ILE 17 -5.847 0.847 -9.699 126 H ARG 18 H ARG 18 -9.367 4.351 -9.126 127 HA ARG 18 HA ARG 18 -11.979 5.222 -10.171 128 HB2 ARG 18 HB2 ARG 18 -12.000 2.809 -9.148 129 HB3 ARG 18 HB3 ARG 18 -11.893 3.659 -7.608 130 HG2 ARG 18 HG2 ARG 18 -13.974 4.450 -9.650 131 HG3 ARG 18 HG3 ARG 18 -14.262 3.105 -8.551 132 HD2 ARG 18 HD2 ARG 18 -13.614 4.727 -6.661 133 HD3 ARG 18 HD3 ARG 18 -13.792 6.005 -7.860 134 HE ARG 18 HE ARG 18 -16.106 4.398 -7.925 135 HH11 ARG 18 HH11 ARG 18 -14.508 6.660 -5.777 136 HH12 ARG 18 HH12 ARG 18 -15.984 7.162 -5.022 137 HH21 ARG 18 HH21 ARG 18 -17.998 5.076 -6.915 138 HH22 ARG 18 HH22 ARG 18 -17.941 6.271 -5.662 139 H ARG 19 H ARG 19 -11.902 7.322 -9.713 140 HA ARG 19 HA ARG 19 -12.003 8.262 -7.028 141 HB2 ARG 19 HB2 ARG 19 -9.565 7.876 -7.150 142 HB3 ARG 19 HB3 ARG 19 -9.469 8.914 -8.568 143 HG2 ARG 19 HG2 ARG 19 -8.818 10.261 -6.690 144 HG3 ARG 19 HG3 ARG 19 -10.448 10.774 -7.124 145 HD2 ARG 19 HD2 ARG 19 -11.382 9.346 -5.347 146 HD3 ARG 19 HD3 ARG 19 -9.763 8.799 -4.925 147 HE ARG 19 HE ARG 19 -10.958 11.363 -4.264 148 HH11 ARG 19 HH11 ARG 19 -7.967 9.565 -4.607 149 HH12 ARG 19 HH12 ARG 19 -7.079 10.623 -3.564 150 HH21 ARG 19 HH21 ARG 19 -9.765 12.709 -2.913 151 HH22 ARG 19 HH22 ARG 19 -8.088 12.389 -2.615 152 H ILE 20 H ILE 20 -12.839 10.330 -6.936 153 HA ILE 20 HA ILE 20 -13.050 11.824 -9.466 154 HB ILE 20 HB ILE 20 -15.360 12.376 -9.088 155 HG12 ILE 20 HG12 ILE 20 -15.386 12.376 -6.606 156 HG13 ILE 20 HG13 ILE 20 -16.714 11.441 -7.271 157 HG21 ILE 20 HG21 ILE 20 -16.398 10.156 -9.419 158 HG22 ILE 20 HG22 ILE 20 -14.905 9.391 -8.874 159 HG23 ILE 20 HG23 ILE 20 -14.916 10.345 -10.357 160 HD11 ILE 20 HD11 ILE 20 -14.454 10.569 -5.585 161 HD12 ILE 20 HD12 ILE 20 -14.792 9.490 -6.936 162 HD13 ILE 20 HD13 ILE 20 -16.059 9.863 -5.768 163 H ILE 21 H ILE 21 -13.103 14.047 -9.301 164 HA ILE 21 HA ILE 21 -13.233 15.446 -6.814 165 HB ILE 21 HB ILE 21 -10.993 14.426 -6.575 166 HG12 ILE 21 HG12 ILE 21 -10.656 17.382 -7.141 167 HG13 ILE 21 HG13 ILE 21 -11.595 16.799 -5.767 168 HG21 ILE 21 HG21 ILE 21 -9.190 14.941 -8.092 169 HG22 ILE 21 HG22 ILE 21 -10.204 16.061 -9.004 170 HG23 ILE 21 HG23 ILE 21 -10.530 14.329 -9.059 171 HD11 ILE 21 HD11 ILE 21 -8.672 16.211 -6.328 172 HD12 ILE 21 HD12 ILE 21 -9.599 15.502 -5.006 173 HD13 ILE 21 HD13 ILE 21 -9.306 17.240 -5.044 174 H SER 22 H SER 22 -13.355 17.685 -7.103 175 HA SER 22 HA SER 22 -13.567 18.550 -9.924 176 HB2 SER 22 HB2 SER 22 -15.045 20.322 -9.080 177 HB3 SER 22 HB3 SER 22 -15.635 18.734 -8.600 178 HG SER 22 HG SER 22 -14.648 19.070 -6.571 179 H GLU 23 H GLU 23 -12.379 20.201 -10.686 180 HA GLU 23 HA GLU 23 -10.847 21.891 -8.836 181 HB2 GLU 23 HB2 GLU 23 -9.604 20.318 -11.110 182 HB3 GLU 23 HB3 GLU 23 -8.781 21.548 -10.153 183 HG2 GLU 23 HG2 GLU 23 -9.184 20.215 -8.105 184 HG3 GLU 23 HG3 GLU 23 -9.975 18.976 -9.078 185 H ASP 24 H ASP 24 -10.028 23.830 -9.836 186 HA ASP 24 HA ASP 24 -11.837 25.014 -11.677 187 HB2 ASP 24 HB2 ASP 24 -9.168 25.897 -10.576 188 HB3 ASP 24 HB3 ASP 24 -10.093 26.862 -11.726 189 H ASP 25 H ASP 25 -11.540 25.580 -13.818 190 HA ASP 25 HA ASP 25 -10.034 23.755 -15.344 191 HB2 ASP 25 HB2 ASP 25 -12.143 24.811 -16.131 192 HB3 ASP 25 HB3 ASP 25 -11.286 26.344 -16.274 193 H ALA 26 H ALA 26 -9.512 27.176 -14.529 194 HA ALA 26 HA ALA 26 -7.071 27.305 -16.072 195 HB1 ALA 26 HB1 ALA 26 -6.932 29.575 -14.811 196 HB2 ALA 26 HB2 ALA 26 -8.584 29.208 -14.314 197 HB3 ALA 26 HB3 ALA 26 -8.188 29.352 -16.027 198 HA PRO 27 HA PRO 27 -4.753 25.678 -12.491 199 HB2 PRO 27 HB2 PRO 27 -2.245 25.771 -13.546 200 HB3 PRO 27 HB3 PRO 27 -3.420 24.509 -13.964 201 HG2 PRO 27 HG2 PRO 27 -2.683 26.976 -15.468 202 HG3 PRO 27 HG3 PRO 27 -2.946 25.328 -16.066 203 HD2 PRO 27 HD2 PRO 27 -4.843 27.264 -16.277 204 HD3 PRO 27 HD3 PRO 27 -5.254 25.546 -16.069 205 H ALA 28 H ALA 28 -4.366 28.764 -13.995 206 HA ALA 28 HA ALA 28 -2.413 29.775 -12.097 207 HB1 ALA 28 HB1 ALA 28 -2.611 30.487 -14.534 208 HB2 ALA 28 HB2 ALA 28 -2.464 31.784 -13.349 209 HB3 ALA 28 HB3 ALA 28 -4.037 31.402 -14.048 210 H GLU 29 H GLU 29 -5.715 29.222 -11.874 211 HA GLU 29 HA GLU 29 -5.931 31.079 -9.625 212 HB2 GLU 29 HB2 GLU 29 -8.201 31.831 -10.385 213 HB3 GLU 29 HB3 GLU 29 -6.895 32.408 -11.413 214 HG2 GLU 29 HG2 GLU 29 -7.351 30.597 -13.021 215 HG3 GLU 29 HG3 GLU 29 -8.648 29.996 -11.992 216 HA PRO 30 HA PRO 30 -7.834 26.789 -9.211 217 HB2 PRO 30 HB2 PRO 30 -6.169 25.698 -7.383 218 HB3 PRO 30 HB3 PRO 30 -5.818 25.663 -9.120 219 HG2 PRO 30 HG2 PRO 30 -4.755 27.485 -7.010 220 HG3 PRO 30 HG3 PRO 30 -3.901 26.678 -8.337 221 HD2 PRO 30 HD2 PRO 30 -4.690 29.297 -8.455 222 HD3 PRO 30 HD3 PRO 30 -4.542 28.265 -9.893 223 H ALA 31 H ALA 31 -9.247 26.164 -7.573 224 HA ALA 31 HA ALA 31 -9.095 27.299 -4.917 225 HB1 ALA 31 HB1 ALA 31 -10.185 29.187 -5.707 226 HB2 ALA 31 HB2 ALA 31 -11.557 28.164 -5.279 227 HB3 ALA 31 HB3 ALA 31 -11.043 28.294 -6.960 228 H ALA 32 H ALA 32 -10.679 26.362 -3.479 229 HA ALA 32 HA ALA 32 -12.193 24.084 -4.561 230 HB1 ALA 32 HB1 ALA 32 -10.515 23.762 -2.084 231 HB2 ALA 32 HB2 ALA 32 -9.863 23.421 -3.685 232 HB3 ALA 32 HB3 ALA 32 -11.251 22.514 -3.088 233 H GLU 33 H GLU 33 -14.047 23.612 -3.495 234 HA GLU 33 HA GLU 33 -14.659 24.952 -0.956 235 HB2 GLU 33 HB2 GLU 33 -15.439 26.450 -2.800 236 HB3 GLU 33 HB3 GLU 33 -16.453 25.138 -3.393 237 HG2 GLU 33 HG2 GLU 33 -17.802 26.626 -2.008 238 HG3 GLU 33 HG3 GLU 33 -17.617 25.079 -1.190 239 H ALA 34 H ALA 34 -16.052 23.786 0.329 240 HA ALA 34 HA ALA 34 -16.279 21.029 -0.022 241 HB1 ALA 34 HB1 ALA 34 -18.225 21.338 1.709 242 HB2 ALA 34 HB2 ALA 34 -17.676 23.014 1.739 243 HB3 ALA 34 HB3 ALA 34 -16.568 21.716 2.184 244 H ALA 35 H ALA 35 -17.604 19.736 -1.064 245 HA ALA 35 HA ALA 35 -20.313 20.325 -1.717 246 HB1 ALA 35 HB1 ALA 35 -19.206 20.073 -4.333 247 HB2 ALA 35 HB2 ALA 35 -18.326 21.363 -3.504 248 HB3 ALA 35 HB3 ALA 35 -20.085 21.442 -3.646 249 HA PRO 36 HA PRO 36 -19.262 15.831 -1.790 250 HB2 PRO 36 HB2 PRO 36 -21.763 14.892 -1.194 251 HB3 PRO 36 HB3 PRO 36 -20.614 15.451 0.037 252 HG2 PRO 36 HG2 PRO 36 -22.921 16.891 -1.190 253 HG3 PRO 36 HG3 PRO 36 -22.402 16.830 0.502 254 HD2 PRO 36 HD2 PRO 36 -21.833 18.949 -1.094 255 HD3 PRO 36 HD3 PRO 36 -20.730 18.416 0.193 256 HA PRO 37 HA PRO 37 -20.786 15.201 -5.983 257 HB2 PRO 37 HB2 PRO 37 -20.062 12.640 -6.439 258 HB3 PRO 37 HB3 PRO 37 -18.860 13.938 -6.283 259 HG2 PRO 37 HG2 PRO 37 -19.742 11.928 -4.261 260 HG3 PRO 37 HG3 PRO 37 -18.105 12.477 -4.662 261 HD2 PRO 37 HD2 PRO 37 -19.504 13.432 -2.509 262 HD3 PRO 37 HD3 PRO 37 -18.282 14.389 -3.374 263 HA PRO 38 HA PRO 38 -24.864 13.374 -5.883 264 HB2 PRO 38 HB2 PRO 38 -24.293 11.957 -8.441 265 HB3 PRO 38 HB3 PRO 38 -25.589 13.103 -8.052 266 HG2 PRO 38 HG2 PRO 38 -23.549 13.819 -9.584 267 HG3 PRO 38 HG3 PRO 38 -24.253 14.943 -8.407 268 HD2 PRO 38 HD2 PRO 38 -21.698 13.376 -8.221 269 HD3 PRO 38 HD3 PRO 38 -22.045 15.035 -7.684 270 HA PRO 39 HA PRO 39 -24.762 9.268 -4.165 271 HB2 PRO 39 HB2 PRO 39 -26.807 8.423 -6.196 272 HB3 PRO 39 HB3 PRO 39 -26.796 8.165 -4.439 273 HG2 PRO 39 HG2 PRO 39 -28.336 10.025 -5.466 274 HG3 PRO 39 HG3 PRO 39 -27.413 10.355 -3.985 275 HD2 PRO 39 HD2 PRO 39 -26.871 11.287 -6.787 276 HD3 PRO 39 HD3 PRO 39 -26.640 12.148 -5.248 277 HA PRO 40 HA PRO 40 -21.948 7.219 -7.050 278 HB2 PRO 40 HB2 PRO 40 -21.287 5.006 -5.624 279 HB3 PRO 40 HB3 PRO 40 -20.683 6.626 -5.215 280 HG2 PRO 40 HG2 PRO 40 -22.946 5.092 -4.012 281 HG3 PRO 40 HG3 PRO 40 -21.668 6.027 -3.212 282 HD2 PRO 40 HD2 PRO 40 -24.165 7.031 -3.600 283 HD3 PRO 40 HD3 PRO 40 -22.715 8.061 -3.609 284 H GLU 41 H GLU 41 -21.816 5.463 -8.471 285 HA GLU 41 HA GLU 41 -23.968 3.465 -8.438 286 HB2 GLU 41 HB2 GLU 41 -24.437 3.858 -10.834 287 HB3 GLU 41 HB3 GLU 41 -24.802 5.282 -9.870 288 HG2 GLU 41 HG2 GLU 41 -22.639 6.282 -10.504 289 HG3 GLU 41 HG3 GLU 41 -22.250 4.847 -11.453 290 HA PRO 42 HA PRO 42 -20.620 0.805 -9.648 291 HB2 PRO 42 HB2 PRO 42 -21.790 -1.053 -11.274 292 HB3 PRO 42 HB3 PRO 42 -22.029 -1.017 -9.516 293 HG2 PRO 42 HG2 PRO 42 -23.799 0.000 -11.689 294 HG3 PRO 42 HG3 PRO 42 -24.220 -0.883 -10.210 295 HD2 PRO 42 HD2 PRO 42 -24.521 1.814 -10.426 296 HD3 PRO 42 HD3 PRO 42 -24.138 1.019 -8.883 297 H GLU 43 H GLU 43 -19.003 0.834 -11.122 298 HA GLU 43 HA GLU 43 -19.476 1.125 -13.953 299 HB2 GLU 43 HB2 GLU 43 -19.707 3.473 -13.067 300 HB3 GLU 43 HB3 GLU 43 -18.028 3.374 -12.538 301 HG2 GLU 43 HG2 GLU 43 -17.316 2.924 -14.853 302 HG3 GLU 43 HG3 GLU 43 -18.993 3.005 -15.389 303 HA PRO 44 HA PRO 44 -15.582 -1.142 -12.697 304 HB2 PRO 44 HB2 PRO 44 -15.744 -3.048 -14.673 305 HB3 PRO 44 HB3 PRO 44 -16.502 -3.212 -13.079 306 HG2 PRO 44 HG2 PRO 44 -17.714 -2.380 -15.673 307 HG3 PRO 44 HG3 PRO 44 -18.361 -3.451 -14.415 308 HD2 PRO 44 HD2 PRO 44 -19.177 -0.880 -14.650 309 HD3 PRO 44 HD3 PRO 44 -19.048 -1.682 -13.068 310 H GLU 45 H GLU 45 -16.773 -0.058 -15.825 311 HA GLU 45 HA GLU 45 -15.722 0.648 -17.752 312 HB2 GLU 45 HB2 GLU 45 -15.445 2.496 -16.022 313 HB3 GLU 45 HB3 GLU 45 -13.790 1.924 -15.810 314 HG2 GLU 45 HG2 GLU 45 -13.364 2.256 -18.220 315 HG3 GLU 45 HG3 GLU 45 -15.016 2.832 -18.432 316 HA PRO 46 HA PRO 46 -12.111 -2.424 -17.317 317 HB2 PRO 46 HB2 PRO 46 -13.074 -4.470 -18.820 318 HB3 PRO 46 HB3 PRO 46 -13.425 -4.321 -17.085 319 HG2 PRO 46 HG2 PRO 46 -15.110 -3.554 -19.427 320 HG3 PRO 46 HG3 PRO 46 -15.571 -4.414 -17.944 321 HD2 PRO 46 HD2 PRO 46 -16.050 -1.757 -18.282 322 HD3 PRO 46 HD3 PRO 46 -15.692 -2.459 -16.690 323 H VAL 47 H VAL 47 -10.478 -2.375 -18.801 324 HA VAL 47 HA VAL 47 -10.992 -1.057 -21.333 325 HB VAL 47 HB VAL 47 -9.057 -0.411 -19.927 326 HG11 VAL 47 HG11 VAL 47 -7.885 -3.103 -20.668 327 HG12 VAL 47 HG12 VAL 47 -8.587 -2.742 -19.090 328 HG13 VAL 47 HG13 VAL 47 -7.158 -1.868 -19.641 329 HG21 VAL 47 HG21 VAL 47 -8.066 -1.666 -22.495 330 HG22 VAL 47 HG22 VAL 47 -7.501 -0.186 -21.719 331 HG23 VAL 47 HG23 VAL 47 -9.091 -0.231 -22.482 332 H SER 48 H SER 48 -9.823 -4.208 -20.203 333 HA SER 48 HA SER 48 -10.127 -5.256 -22.956 334 HB2 SER 48 HB2 SER 48 -8.327 -6.205 -20.721 335 HB3 SER 48 HB3 SER 48 -8.517 -7.017 -22.273 336 HG SER 48 HG SER 48 -6.754 -5.627 -22.361 337 H PHE 49 H PHE 49 -11.168 -5.544 -19.659 338 HA PHE 49 HA PHE 49 -12.654 -6.931 -18.597 339 HB2 PHE 49 HB2 PHE 49 -14.065 -6.063 -20.506 340 HB3 PHE 49 HB3 PHE 49 -13.675 -7.546 -21.381 341 HD1 PHE 49 HD1 PHE 49 -15.107 -6.290 -18.162 342 HD2 PHE 49 HD2 PHE 49 -14.902 -9.534 -20.974 343 HE1 PHE 49 HE1 PHE 49 -16.898 -7.476 -16.926 344 HE2 PHE 49 HE2 PHE 49 -16.694 -10.719 -19.734 345 HZ PHE 49 HZ PHE 49 -17.693 -9.689 -17.711 346 H ASP 50 H ASP 50 -10.351 -8.086 -18.576 347 HA ASP 50 HA ASP 50 -10.603 -10.804 -19.696 348 HB2 ASP 50 HB2 ASP 50 -8.519 -9.593 -20.226 349 HB3 ASP 50 HB3 ASP 50 -8.189 -9.420 -18.505 350 H ASP 51 H ASP 51 -11.732 -12.038 -18.314 351 HA ASP 51 HA ASP 51 -11.312 -11.787 -15.423 352 HB2 ASP 51 HB2 ASP 51 -13.224 -13.281 -15.212 353 HB3 ASP 51 HB3 ASP 51 -13.620 -11.956 -16.299 354 H GLU 52 H GLU 52 -11.312 -14.016 -14.239 355 HA GLU 52 HA GLU 52 -10.194 -16.301 -15.450 356 HB2 GLU 52 HB2 GLU 52 -8.218 -14.734 -15.669 357 HB3 GLU 52 HB3 GLU 52 -8.171 -14.648 -13.908 358 HG2 GLU 52 HG2 GLU 52 -7.861 -17.080 -13.779 359 HG3 GLU 52 HG3 GLU 52 -7.956 -17.197 -15.536 360 H VAL 53 H VAL 53 -11.673 -17.338 -14.151 361 HA VAL 53 HA VAL 53 -11.113 -17.225 -11.259 362 HB VAL 53 HB VAL 53 -13.248 -16.119 -11.788 363 HG11 VAL 53 HG11 VAL 53 -14.211 -18.811 -12.785 364 HG12 VAL 53 HG12 VAL 53 -13.694 -17.510 -13.858 365 HG13 VAL 53 HG13 VAL 53 -15.087 -17.280 -12.802 366 HG21 VAL 53 HG21 VAL 53 -13.658 -18.809 -10.443 367 HG22 VAL 53 HG22 VAL 53 -14.651 -17.369 -10.221 368 HG23 VAL 53 HG23 VAL 53 -12.981 -17.381 -9.657 369 H LEU 54 H LEU 54 -10.559 -19.113 -10.368 370 HA LEU 54 HA LEU 54 -10.330 -21.511 -11.903 371 HB2 LEU 54 HB2 LEU 54 -10.041 -20.954 -8.943 372 HB3 LEU 54 HB3 LEU 54 -9.741 -22.535 -9.664 373 HG LEU 54 HG LEU 54 -8.353 -20.011 -10.606 374 HD11 LEU 54 HD11 LEU 54 -6.469 -20.623 -9.228 375 HD12 LEU 54 HD12 LEU 54 -7.253 -22.121 -8.728 376 HD13 LEU 54 HD13 LEU 54 -7.886 -20.568 -8.181 377 HD21 LEU 54 HD21 LEU 54 -8.269 -21.774 -12.249 378 HD22 LEU 54 HD22 LEU 54 -7.909 -22.985 -11.017 379 HD23 LEU 54 HD23 LEU 54 -6.702 -21.770 -11.437 380 H GLU 55 H GLU 55 -12.566 -20.361 -9.445 381 HA GLU 55 HA GLU 55 -14.637 -21.079 -8.742 382 HB2 GLU 55 HB2 GLU 55 -14.962 -20.936 -11.300 383 HB3 GLU 55 HB3 GLU 55 -14.822 -22.694 -11.285 384 HG2 GLU 55 HG2 GLU 55 -16.710 -22.878 -9.756 385 HG3 GLU 55 HG3 GLU 55 -16.803 -21.123 -9.610 386 H LEU 56 H LEU 56 -12.316 -22.555 -7.946 387 HA LEU 56 HA LEU 56 -13.434 -25.276 -7.621 388 HB2 LEU 56 HB2 LEU 56 -10.537 -24.386 -7.641 389 HB3 LEU 56 HB3 LEU 56 -11.081 -26.016 -7.252 390 HG LEU 56 HG LEU 56 -11.727 -24.633 -9.873 391 HD11 LEU 56 HD11 LEU 56 -9.324 -24.881 -9.777 392 HD12 LEU 56 HD12 LEU 56 -9.952 -26.172 -10.801 393 HD13 LEU 56 HD13 LEU 56 -9.471 -26.520 -9.141 394 HD21 LEU 56 HD21 LEU 56 -13.253 -26.451 -9.378 395 HD22 LEU 56 HD22 LEU 56 -11.922 -27.499 -8.887 396 HD23 LEU 56 HD23 LEU 56 -12.105 -27.038 -10.580 397 H THR 57 H THR 57 -13.247 -26.252 -5.569 398 HA THR 57 HA THR 57 -13.775 -24.622 -3.357 399 HB THR 57 HB THR 57 -12.673 -27.449 -3.328 400 HG1 THR 57 HG1 THR 57 -14.658 -28.090 -3.751 401 HG21 THR 57 HG21 THR 57 -13.881 -27.613 -1.184 402 HG22 THR 57 HG22 THR 57 -14.380 -25.928 -1.330 403 HG23 THR 57 HG23 THR 57 -12.676 -26.328 -1.121 404 H ASP 58 H ASP 58 -12.532 -23.596 -1.913 405 HA ASP 58 HA ASP 58 -9.798 -23.125 -2.381 406 HB2 ASP 58 HB2 ASP 58 -11.347 -21.567 -1.189 407 HB3 ASP 58 HB3 ASP 58 -11.335 -22.668 0.188 408 HA PRO 59 HA PRO 59 -8.212 -26.800 -0.359 409 HB2 PRO 59 HB2 PRO 59 -5.584 -26.139 -0.075 410 HB3 PRO 59 HB3 PRO 59 -6.299 -26.573 -1.642 411 HG2 PRO 59 HG2 PRO 59 -5.725 -23.871 -0.512 412 HG3 PRO 59 HG3 PRO 59 -5.434 -24.493 -2.147 413 HD2 PRO 59 HD2 PRO 59 -7.580 -22.930 -1.554 414 HD3 PRO 59 HD3 PRO 59 -7.642 -24.194 -2.803 415 H ILE 60 H ILE 60 -7.340 -27.508 1.704 416 HA ILE 60 HA ILE 60 -7.685 -25.483 3.827 417 HB ILE 60 HB ILE 60 -9.303 -27.351 3.848 418 HG12 ILE 60 HG12 ILE 60 -7.395 -27.698 6.172 419 HG13 ILE 60 HG13 ILE 60 -8.354 -26.234 5.970 420 HG21 ILE 60 HG21 ILE 60 -7.888 -29.086 2.831 421 HG22 ILE 60 HG22 ILE 60 -8.520 -29.636 4.383 422 HG23 ILE 60 HG23 ILE 60 -6.847 -29.087 4.256 423 HD11 ILE 60 HD11 ILE 60 -9.420 -29.062 6.241 424 HD12 ILE 60 HD12 ILE 60 -10.418 -27.650 5.896 425 HD13 ILE 60 HD13 ILE 60 -9.559 -27.769 7.432 426 H ALA 61 H ALA 61 -6.157 -25.164 5.349 427 HA ALA 61 HA ALA 61 -3.674 -26.765 5.214 428 HB1 ALA 61 HB1 ALA 61 -2.586 -24.456 5.843 429 HB2 ALA 61 HB2 ALA 61 -4.034 -23.790 5.085 430 HB3 ALA 61 HB3 ALA 61 -2.948 -24.826 4.157 431 HA PRO 62 HA PRO 62 -3.938 -27.251 9.618 432 HB2 PRO 62 HB2 PRO 62 -1.179 -26.103 9.844 433 HB3 PRO 62 HB3 PRO 62 -1.825 -27.623 10.497 434 HG2 PRO 62 HG2 PRO 62 -0.254 -27.666 8.390 435 HG3 PRO 62 HG3 PRO 62 -1.688 -28.707 8.452 436 HD2 PRO 62 HD2 PRO 62 -1.291 -26.144 6.934 437 HD3 PRO 62 HD3 PRO 62 -2.136 -27.628 6.436 438 H GLU 63 H GLU 63 -4.874 -26.041 11.151 439 HA GLU 63 HA GLU 63 -3.993 -23.365 11.793 440 HB2 GLU 63 HB2 GLU 63 -5.462 -23.067 9.766 441 HB3 GLU 63 HB3 GLU 63 -6.797 -23.713 10.719 442 HG2 GLU 63 HG2 GLU 63 -6.870 -21.292 10.844 443 HG3 GLU 63 HG3 GLU 63 -6.390 -21.918 12.417 444 HA PRO 64 HA PRO 64 -5.563 -25.699 15.469 445 HB2 PRO 64 HB2 PRO 64 -4.400 -23.295 16.814 446 HB3 PRO 64 HB3 PRO 64 -4.218 -25.014 17.218 447 HG2 PRO 64 HG2 PRO 64 -2.242 -23.723 16.060 448 HG3 PRO 64 HG3 PRO 64 -2.653 -25.371 15.544 449 HD2 PRO 64 HD2 PRO 64 -3.299 -22.762 14.194 450 HD3 PRO 64 HD3 PRO 64 -2.772 -24.303 13.473 451 H GLU 65 H GLU 65 -7.461 -25.541 16.472 452 HA GLU 65 HA GLU 65 -9.545 -24.782 17.082 453 HB2 GLU 65 HB2 GLU 65 -8.015 -22.203 17.528 454 HB3 GLU 65 HB3 GLU 65 -9.633 -22.545 18.137 455 HG2 GLU 65 HG2 GLU 65 -8.745 -24.475 19.404 456 HG3 GLU 65 HG3 GLU 65 -7.123 -24.106 18.814 457 H LEU 66 H LEU 66 -8.859 -24.680 14.266 458 HA LEU 66 HA LEU 66 -9.709 -23.953 12.289 459 HB2 LEU 66 HB2 LEU 66 -11.867 -23.048 14.184 460 HB3 LEU 66 HB3 LEU 66 -11.997 -22.803 12.445 461 HG LEU 66 HG LEU 66 -11.463 -25.514 13.693 462 HD11 LEU 66 HD11 LEU 66 -13.661 -24.554 14.416 463 HD12 LEU 66 HD12 LEU 66 -13.839 -25.981 13.393 464 HD13 LEU 66 HD13 LEU 66 -14.100 -24.372 12.717 465 HD21 LEU 66 HD21 LEU 66 -12.245 -24.537 10.930 466 HD22 LEU 66 HD22 LEU 66 -12.423 -26.223 11.419 467 HD23 LEU 66 HD23 LEU 66 -10.823 -25.480 11.378 468 HA PRO 67 HA PRO 67 -8.155 -19.824 11.568 469 HB2 PRO 67 HB2 PRO 67 -10.070 -19.562 9.311 470 HB3 PRO 67 HB3 PRO 67 -8.299 -19.475 9.305 471 HG2 PRO 67 HG2 PRO 67 -9.580 -21.569 8.298 472 HG3 PRO 67 HG3 PRO 67 -8.055 -21.758 9.182 473 HD2 PRO 67 HD2 PRO 67 -10.857 -22.290 10.128 474 HD3 PRO 67 HD3 PRO 67 -9.369 -23.221 10.417 475 HA PRO 68 HA PRO 68 -10.972 -16.937 13.536 476 HB2 PRO 68 HB2 PRO 68 -9.953 -14.861 11.643 477 HB3 PRO 68 HB3 PRO 68 -10.022 -14.831 13.417 478 HG2 PRO 68 HG2 PRO 68 -7.721 -15.191 12.177 479 HG3 PRO 68 HG3 PRO 68 -8.112 -16.117 13.641 480 HD2 PRO 68 HD2 PRO 68 -8.170 -17.013 10.773 481 HD3 PRO 68 HD3 PRO 68 -7.633 -17.898 12.219 482 H LEU 69 H LEU 69 -13.003 -15.907 13.155 483 HA LEU 69 HA LEU 69 -14.482 -16.849 10.952 484 HB2 LEU 69 HB2 LEU 69 -15.030 -14.635 12.938 485 HB3 LEU 69 HB3 LEU 69 -16.202 -15.158 11.732 486 HG LEU 69 HG LEU 69 -14.913 -17.073 13.696 487 HD11 LEU 69 HD11 LEU 69 -16.190 -15.315 14.901 488 HD12 LEU 69 HD12 LEU 69 -16.979 -16.889 15.015 489 HD13 LEU 69 HD13 LEU 69 -17.598 -15.671 13.899 490 HD21 LEU 69 HD21 LEU 69 -17.010 -18.389 13.111 491 HD22 LEU 69 HD22 LEU 69 -15.868 -18.196 11.782 492 HD23 LEU 69 HD23 LEU 69 -17.319 -17.196 11.849 493 H GLU 70 H GLU 70 -13.076 -13.633 11.614 494 HA GLU 70 HA GLU 70 -14.055 -12.297 9.375 495 HB2 GLU 70 HB2 GLU 70 -12.170 -10.731 9.707 496 HB3 GLU 70 HB3 GLU 70 -12.975 -11.125 11.227 497 HG2 GLU 70 HG2 GLU 70 -11.213 -12.806 11.707 498 HG3 GLU 70 HG3 GLU 70 -10.399 -12.371 10.206 499 H THR 71 H THR 71 -12.587 -11.408 7.614 500 HA THR 71 HA THR 71 -10.924 -13.557 6.445 501 HB THR 71 HB THR 71 -11.820 -12.962 4.227 502 HG1 THR 71 HG1 THR 71 -13.581 -11.316 5.718 503 HG21 THR 71 HG21 THR 71 -14.009 -13.591 6.229 504 HG22 THR 71 HG22 THR 71 -12.893 -14.770 5.541 505 HG23 THR 71 HG23 THR 71 -14.048 -13.940 4.499 506 H VAL 72 H VAL 72 -9.562 -12.648 4.589 507 HA VAL 72 HA VAL 72 -8.406 -10.077 5.479 508 HB VAL 72 HB VAL 72 -6.340 -10.823 4.326 509 HG11 VAL 72 HG11 VAL 72 -5.854 -12.743 5.912 510 HG12 VAL 72 HG12 VAL 72 -7.550 -12.670 6.395 511 HG13 VAL 72 HG13 VAL 72 -6.492 -11.287 6.675 512 HG21 VAL 72 HG21 VAL 72 -7.707 -13.512 4.022 513 HG22 VAL 72 HG22 VAL 72 -6.131 -13.025 3.398 514 HG23 VAL 72 HG23 VAL 72 -7.601 -12.347 2.701 515 H GLY 73 H GLY 73 -7.872 -8.483 4.001 516 HA2 GLY 73 HA2 GLY 73 -9.446 -8.517 1.530 517 HA3 GLY 73 HA3 GLY 73 -8.762 -7.093 2.309 518 H ASP 74 H ASP 74 -8.263 -6.958 -0.175 519 HA ASP 74 HA ASP 74 -5.429 -7.385 -0.444 520 HB2 ASP 74 HB2 ASP 74 -6.726 -9.566 -1.122 521 HB3 ASP 74 HB3 ASP 74 -7.060 -8.664 -2.604 522 H ILE 75 H ILE 75 -4.651 -6.510 -2.563 523 HA ILE 75 HA ILE 75 -5.974 -4.016 -3.094 524 HB ILE 75 HB ILE 75 -3.497 -4.233 -3.003 525 HG12 ILE 75 HG12 ILE 75 -4.359 -3.348 -5.764 526 HG13 ILE 75 HG13 ILE 75 -4.792 -2.436 -4.320 527 HG21 ILE 75 HG21 ILE 75 -3.783 -5.638 -5.678 528 HG22 ILE 75 HG22 ILE 75 -3.369 -6.450 -4.166 529 HG23 ILE 75 HG23 ILE 75 -2.277 -5.246 -4.849 530 HD11 ILE 75 HD11 ILE 75 -2.793 -1.409 -5.007 531 HD12 ILE 75 HD12 ILE 75 -2.055 -2.940 -5.479 532 HD13 ILE 75 HD13 ILE 75 -2.240 -2.539 -3.771 533 H ASP 76 H ASP 76 -5.638 -7.111 -4.705 534 HA ASP 76 HA ASP 76 -7.881 -6.519 -6.406 535 HB2 ASP 76 HB2 ASP 76 -5.782 -5.551 -7.553 536 HB3 ASP 76 HB3 ASP 76 -5.341 -7.231 -7.844 537 H VAL 77 H VAL 77 -8.750 -8.330 -7.432 538 HA VAL 77 HA VAL 77 -9.353 -10.540 -7.613 539 HB VAL 77 HB VAL 77 -6.394 -11.098 -7.205 540 HG11 VAL 77 HG11 VAL 77 -7.669 -13.128 -6.994 541 HG12 VAL 77 HG12 VAL 77 -6.991 -13.120 -8.622 542 HG13 VAL 77 HG13 VAL 77 -8.686 -12.702 -8.370 543 HG21 VAL 77 HG21 VAL 77 -7.989 -10.538 -9.730 544 HG22 VAL 77 HG22 VAL 77 -6.338 -11.159 -9.715 545 HG23 VAL 77 HG23 VAL 77 -6.682 -9.553 -9.075 546 H TYR 78 H TYR 78 -10.604 -10.846 -5.847 547 HA TYR 78 HA TYR 78 -9.590 -11.110 -3.180 548 HB2 TYR 78 HB2 TYR 78 -11.882 -10.289 -3.717 549 HB3 TYR 78 HB3 TYR 78 -12.295 -11.897 -4.305 550 HD1 TYR 78 HD1 TYR 78 -11.070 -10.062 -1.288 551 HD2 TYR 78 HD2 TYR 78 -13.035 -13.573 -2.794 552 HE1 TYR 78 HE1 TYR 78 -11.620 -10.748 1.030 553 HE2 TYR 78 HE2 TYR 78 -13.582 -14.260 -0.475 554 HH TYR 78 HH TYR 78 -12.222 -13.472 2.045 555 H SER 79 H SER 79 -8.919 -12.896 -2.130 556 HA SER 79 HA SER 79 -8.315 -15.284 -3.516 557 HB2 SER 79 HB2 SER 79 -8.422 -14.659 -0.559 558 HB3 SER 79 HB3 SER 79 -7.831 -16.184 -1.211 559 HG SER 79 HG SER 79 -6.242 -15.045 -2.317 560 HA PRO 80 HA PRO 80 -12.038 -17.682 -3.478 561 HB2 PRO 80 HB2 PRO 80 -10.458 -19.881 -2.191 562 HB3 PRO 80 HB3 PRO 80 -11.505 -19.937 -3.622 563 HG2 PRO 80 HG2 PRO 80 -8.900 -19.935 -3.923 564 HG3 PRO 80 HG3 PRO 80 -9.912 -18.933 -4.981 565 HD2 PRO 80 HD2 PRO 80 -8.234 -18.088 -2.633 566 HD3 PRO 80 HD3 PRO 80 -8.472 -17.275 -4.197 567 HA PRO 81 HA PRO 81 -13.482 -17.125 0.772 568 HB2 PRO 81 HB2 PRO 81 -16.003 -18.127 0.576 569 HB3 PRO 81 HB3 PRO 81 -15.542 -16.555 -0.107 570 HG2 PRO 81 HG2 PRO 81 -15.834 -19.195 -1.466 571 HG3 PRO 81 HG3 PRO 81 -16.373 -17.591 -1.995 572 HD2 PRO 81 HD2 PRO 81 -14.100 -18.746 -2.951 573 HD3 PRO 81 HD3 PRO 81 -14.270 -16.987 -2.765 574 H GLU 82 H GLU 82 -13.897 -18.325 2.672 575 HA GLU 82 HA GLU 82 -13.447 -21.240 2.423 576 HB2 GLU 82 HB2 GLU 82 -11.607 -19.982 3.518 577 HB3 GLU 82 HB3 GLU 82 -12.747 -19.408 4.733 578 HG2 GLU 82 HG2 GLU 82 -13.196 -21.712 5.443 579 HG3 GLU 82 HG3 GLU 82 -12.125 -22.327 4.184 580 HA PRO 83 HA PRO 83 -17.712 -20.993 4.161 581 HB2 PRO 83 HB2 PRO 83 -18.386 -23.614 3.782 582 HB3 PRO 83 HB3 PRO 83 -18.463 -22.398 2.492 583 HG2 PRO 83 HG2 PRO 83 -16.340 -24.416 3.059 584 HG3 PRO 83 HG3 PRO 83 -17.065 -23.948 1.511 585 HD2 PRO 83 HD2 PRO 83 -14.652 -22.998 2.296 586 HD3 PRO 83 HD3 PRO 83 -15.780 -22.018 1.331 587 H GLU 84 H GLU 84 -18.528 -21.490 6.166 588 HA GLU 84 HA GLU 84 -16.697 -22.750 8.053 589 HB2 GLU 84 HB2 GLU 84 -18.339 -20.546 8.220 590 HB3 GLU 84 HB3 GLU 84 -19.332 -21.767 9.009 591 HG2 GLU 84 HG2 GLU 84 -17.405 -22.312 10.508 592 HG3 GLU 84 HG3 GLU 84 -16.488 -21.014 9.755 593 H SER 85 H SER 85 -18.460 -23.783 9.945 594 HA SER 85 HA SER 85 -19.333 -26.245 8.632 595 HB2 SER 85 HB2 SER 85 -17.963 -26.498 10.627 596 HB3 SER 85 HB3 SER 85 -19.070 -25.488 11.553 597 HG SER 85 HG SER 85 -19.381 -27.805 11.779 598 H GLU 86 H GLU 86 -21.425 -27.218 9.388 599 HA GLU 86 HA GLU 86 -23.474 -25.153 9.895 600 HB2 GLU 86 HB2 GLU 86 -25.006 -26.394 8.357 601 HB3 GLU 86 HB3 GLU 86 -23.630 -25.660 7.543 602 HG2 GLU 86 HG2 GLU 86 -23.624 -28.557 8.437 603 HG3 GLU 86 HG3 GLU 86 -24.216 -28.062 6.860 604 HA PRO 87 HA PRO 87 -23.708 -28.780 12.972 605 HB2 PRO 87 HB2 PRO 87 -24.098 -26.485 14.835 606 HB3 PRO 87 HB3 PRO 87 -23.115 -27.949 15.036 607 HG2 PRO 87 HG2 PRO 87 -21.964 -25.626 14.558 608 HG3 PRO 87 HG3 PRO 87 -21.367 -27.106 13.780 609 HD2 PRO 87 HD2 PRO 87 -23.080 -24.923 12.609 610 HD3 PRO 87 HD3 PRO 87 -21.709 -25.795 11.886 611 H ALA 88 H ALA 88 -25.627 -29.664 13.609 612 HA ALA 88 HA ALA 88 -28.080 -28.612 12.678 613 HB1 ALA 88 HB1 ALA 88 -27.670 -31.021 13.013 614 HB2 ALA 88 HB2 ALA 88 -29.109 -30.483 13.877 615 HB3 ALA 88 HB3 ALA 88 -27.606 -30.762 14.756 616 H TYR 89 H TYR 89 -26.559 -28.631 15.872 617 HA TYR 89 HA TYR 89 -28.713 -27.678 17.396 618 HB2 TYR 89 HB2 TYR 89 -26.641 -28.625 18.355 619 HB3 TYR 89 HB3 TYR 89 -25.747 -27.209 17.810 620 HD1 TYR 89 HD1 TYR 89 -28.534 -28.317 20.026 621 HD2 TYR 89 HD2 TYR 89 -25.737 -25.195 19.089 622 HE1 TYR 89 HE1 TYR 89 -29.172 -27.123 22.102 623 HE2 TYR 89 HE2 TYR 89 -26.374 -24.001 21.167 624 HH TYR 89 HH TYR 89 -28.973 -24.326 22.747 625 H THR 90 H THR 90 -26.086 -25.891 15.781 626 HA THR 90 HA THR 90 -27.833 -23.529 15.686 627 HB THR 90 HB THR 90 -26.485 -23.156 17.658 628 HG1 THR 90 HG1 THR 90 -26.614 -21.242 16.827 629 HG21 THR 90 HG21 THR 90 -24.566 -24.692 16.706 630 HG22 THR 90 HG22 THR 90 -24.166 -23.353 17.784 631 HG23 THR 90 HG23 THR 90 -23.951 -23.176 16.045 632 HA PRO 91 HA PRO 91 -25.810 -24.010 11.584 633 HB2 PRO 91 HB2 PRO 91 -27.799 -23.018 10.048 634 HB3 PRO 91 HB3 PRO 91 -27.865 -24.661 10.717 635 HG2 PRO 91 HG2 PRO 91 -29.190 -22.170 11.688 636 HG3 PRO 91 HG3 PRO 91 -29.846 -23.810 11.535 637 HD2 PRO 91 HD2 PRO 91 -28.947 -22.772 13.912 638 HD3 PRO 91 HD3 PRO 91 -28.934 -24.508 13.538 639 HA PRO 92 HA PRO 92 -24.375 -19.740 11.379 640 HB2 PRO 92 HB2 PRO 92 -23.192 -19.677 8.930 641 HB3 PRO 92 HB3 PRO 92 -22.481 -20.546 10.308 642 HG2 PRO 92 HG2 PRO 92 -24.098 -21.609 8.033 643 HG3 PRO 92 HG3 PRO 92 -22.612 -22.254 8.754 644 HD2 PRO 92 HD2 PRO 92 -25.060 -23.259 9.370 645 HD3 PRO 92 HD3 PRO 92 -23.733 -23.206 10.553 646 HA PRO 93 HA PRO 93 -27.526 -17.316 9.332 647 HB2 PRO 93 HB2 PRO 93 -25.370 -15.450 8.429 648 HB3 PRO 93 HB3 PRO 93 -26.859 -15.103 9.330 649 HG2 PRO 93 HG2 PRO 93 -24.537 -15.097 10.568 650 HG3 PRO 93 HG3 PRO 93 -25.963 -15.817 11.342 651 HD2 PRO 93 HD2 PRO 93 -23.655 -17.198 9.994 652 HD3 PRO 93 HD3 PRO 93 -24.515 -17.642 11.487 653 H ALA 94 H ALA 94 -28.488 -17.258 7.335 654 HA ALA 94 HA ALA 94 -26.841 -18.066 5.012 655 HB1 ALA 94 HB1 ALA 94 -29.789 -18.524 5.538 656 HB2 ALA 94 HB2 ALA 94 -28.517 -19.741 5.645 657 HB3 ALA 94 HB3 ALA 94 -28.919 -19.023 4.086 658 H ALA 95 H ALA 95 -26.873 -16.896 3.197 659 HA ALA 95 HA ALA 95 -28.907 -14.974 2.576 660 HB1 ALA 95 HB1 ALA 95 -26.392 -13.491 2.795 661 HB2 ALA 95 HB2 ALA 95 -26.974 -14.077 4.354 662 HB3 ALA 95 HB3 ALA 95 -28.009 -13.056 3.352 663 HA PRO 96 HA PRO 96 -27.329 -15.716 -1.530 664 HB2 PRO 96 HB2 PRO 96 -27.574 -12.791 -2.085 665 HB3 PRO 96 HB3 PRO 96 -28.283 -14.168 -2.955 666 HG2 PRO 96 HG2 PRO 96 -29.792 -12.645 -1.425 667 HG3 PRO 96 HG3 PRO 96 -30.009 -14.405 -1.435 668 HD2 PRO 96 HD2 PRO 96 -28.627 -12.693 0.618 669 HD3 PRO 96 HD3 PRO 96 -29.712 -14.084 0.858 670 H VAL 97 H VAL 97 -25.340 -15.740 -2.562 671 HA VAL 97 HA VAL 97 -23.058 -14.832 -1.210 672 HB VAL 97 HB VAL 97 -23.063 -16.711 -2.815 673 HG11 VAL 97 HG11 VAL 97 -23.204 -16.383 -5.180 674 HG12 VAL 97 HG12 VAL 97 -23.146 -14.629 -5.010 675 HG13 VAL 97 HG13 VAL 97 -24.574 -15.519 -4.482 676 HG21 VAL 97 HG21 VAL 97 -20.930 -15.621 -2.271 677 HG22 VAL 97 HG22 VAL 97 -21.185 -14.449 -3.562 678 HG23 VAL 97 HG23 VAL 97 -20.934 -16.149 -3.952 679 H PHE 98 H PHE 98 -22.125 -12.901 -1.071 680 HA PHE 98 HA PHE 98 -22.492 -10.940 -3.237 681 HB2 PHE 98 HB2 PHE 98 -24.187 -10.476 -1.478 682 HB3 PHE 98 HB3 PHE 98 -22.892 -10.335 -0.292 683 HD1 PHE 98 HD1 PHE 98 -24.256 -8.870 -3.437 684 HD2 PHE 98 HD2 PHE 98 -21.627 -8.315 -0.082 685 HE1 PHE 98 HE1 PHE 98 -23.947 -6.492 -4.069 686 HE2 PHE 98 HE2 PHE 98 -21.320 -5.939 -0.718 687 HZ PHE 98 HZ PHE 98 -22.480 -5.027 -2.710 688 H ASP 99 H ASP 99 -20.541 -10.325 -3.887 689 HA ASP 99 HA ASP 99 -18.272 -10.447 -2.004 690 HB2 ASP 99 HB2 ASP 99 -18.288 -10.243 -5.025 691 HB3 ASP 99 HB3 ASP 99 -16.856 -10.396 -4.010 692 H ARG 100 H ARG 100 -19.929 -8.350 -4.307 693 HA ARG 100 HA ARG 100 -19.661 -5.960 -2.953 694 HB2 ARG 100 HB2 ARG 100 -17.165 -6.709 -4.289 695 HB3 ARG 100 HB3 ARG 100 -17.792 -5.201 -4.943 696 HG2 ARG 100 HG2 ARG 100 -17.819 -4.179 -2.757 697 HG3 ARG 100 HG3 ARG 100 -17.465 -5.715 -1.971 698 HD2 ARG 100 HD2 ARG 100 -15.262 -5.792 -2.973 699 HD3 ARG 100 HD3 ARG 100 -15.612 -4.375 -3.957 700 HE ARG 100 HE ARG 100 -15.977 -3.572 -1.326 701 HH11 ARG 100 HH11 ARG 100 -13.330 -4.859 -3.230 702 HH12 ARG 100 HH12 ARG 100 -12.115 -4.053 -2.295 703 HH21 ARG 100 HH21 ARG 100 -14.363 -2.545 -0.140 704 HH22 ARG 100 HH22 ARG 100 -12.697 -2.755 -0.560 705 H ASP 101 H ASP 101 -18.855 -6.696 -6.358 706 HA ASP 101 HA ASP 101 -19.880 -6.133 -8.328 707 HB2 ASP 101 HB2 ASP 101 -21.563 -7.730 -7.225 708 HB3 ASP 101 HB3 ASP 101 -22.490 -6.287 -6.817 709 H GLU 102 H GLU 102 -18.972 -3.978 -6.740 710 HA GLU 102 HA GLU 102 -20.983 -1.886 -7.336 711 HB2 GLU 102 HB2 GLU 102 -18.848 -1.980 -5.194 712 HB3 GLU 102 HB3 GLU 102 -19.721 -0.511 -5.618 713 HG2 GLU 102 HG2 GLU 102 -21.000 -3.095 -4.676 714 HG3 GLU 102 HG3 GLU 102 -20.758 -1.663 -3.683 715 H VAL 103 H VAL 103 -17.467 -1.629 -6.709 716 HA VAL 103 HA VAL 103 -17.067 -0.717 -9.477 717 HB VAL 103 HB VAL 103 -15.755 1.233 -8.692 718 HG11 VAL 103 HG11 VAL 103 -17.673 2.614 -8.068 719 HG12 VAL 103 HG12 VAL 103 -18.585 1.179 -7.600 720 HG13 VAL 103 HG13 VAL 103 -18.161 1.442 -9.292 721 HG21 VAL 103 HG21 VAL 103 -15.124 0.476 -6.459 722 HG22 VAL 103 HG22 VAL 103 -16.817 0.394 -5.969 723 HG23 VAL 103 HG23 VAL 103 -16.073 1.956 -6.305 724 H ALA 104 H ALA 104 -14.805 -0.617 -10.109 725 HA ALA 104 HA ALA 104 -13.259 -2.772 -8.871 726 HB1 ALA 104 HB1 ALA 104 -11.908 -2.711 -10.870 727 HB2 ALA 104 HB2 ALA 104 -12.638 -1.185 -11.372 728 HB3 ALA 104 HB3 ALA 104 -13.601 -2.662 -11.358 729 H GLU 105 H GLU 105 -11.435 -2.447 -7.705 730 HA GLU 105 HA GLU 105 -9.945 -1.305 -6.368 731 HB2 GLU 105 HB2 GLU 105 -9.036 -1.174 -8.828 732 HB3 GLU 105 HB3 GLU 105 -9.451 0.534 -8.696 733 HG2 GLU 105 HG2 GLU 105 -7.152 0.325 -8.009 734 HG3 GLU 105 HG3 GLU 105 -8.109 0.591 -6.549 735 H GLN 106 H GLN 106 -11.285 -0.332 -4.856 736 HA GLN 106 HA GLN 106 -12.448 2.291 -5.429 737 HB2 GLN 106 HB2 GLN 106 -13.637 0.495 -4.078 738 HB3 GLN 106 HB3 GLN 106 -12.482 0.828 -2.786 739 HG2 GLN 106 HG2 GLN 106 -13.179 3.173 -2.726 740 HG3 GLN 106 HG3 GLN 106 -14.279 2.901 -4.076 741 HE21 GLN 106 HE21 GLN 106 -16.295 3.200 -3.023 742 HE22 GLN 106 HE22 GLN 106 -16.813 2.253 -1.713 743 H LEU 107 H LEU 107 -10.220 0.910 -3.017 744 HA LEU 107 HA LEU 107 -8.346 1.751 -1.995 745 HB2 LEU 107 HB2 LEU 107 -7.819 2.711 -4.307 746 HB3 LEU 107 HB3 LEU 107 -8.554 4.215 -3.736 747 HG LEU 107 HG LEU 107 -6.951 4.065 -1.742 748 HD11 LEU 107 HD11 LEU 107 -5.895 1.853 -3.503 749 HD12 LEU 107 HD12 LEU 107 -6.188 1.840 -1.764 750 HD13 LEU 107 HD13 LEU 107 -4.818 2.736 -2.416 751 HD21 LEU 107 HD21 LEU 107 -6.457 5.728 -3.341 752 HD22 LEU 107 HD22 LEU 107 -6.072 4.549 -4.589 753 HD23 LEU 107 HD23 LEU 107 -4.960 4.803 -3.244 754 H VAL 108 H VAL 108 -10.484 1.948 -0.495 755 HA VAL 108 HA VAL 108 -10.082 4.444 0.946 756 HB VAL 108 HB VAL 108 -11.913 4.990 -0.615 757 HG11 VAL 108 HG11 VAL 108 -13.523 2.844 0.777 758 HG12 VAL 108 HG12 VAL 108 -12.726 2.593 -0.774 759 HG13 VAL 108 HG13 VAL 108 -13.994 3.812 -0.620 760 HG21 VAL 108 HG21 VAL 108 -11.902 6.005 1.640 761 HG22 VAL 108 HG22 VAL 108 -12.849 4.649 2.253 762 HG23 VAL 108 HG23 VAL 108 -13.551 5.750 1.067 763 H GLY 109 H GLY 109 -10.507 4.277 3.138 764 HA2 GLY 109 HA2 GLY 109 -11.818 1.919 4.225 765 HA3 GLY 109 HA3 GLY 109 -10.088 2.019 4.539 766 H VAL 110 H VAL 110 -12.097 2.036 6.530 767 HA VAL 110 HA VAL 110 -11.527 4.644 7.772 768 HB VAL 110 HB VAL 110 -13.838 4.782 8.661 769 HG11 VAL 110 HG11 VAL 110 -14.853 5.590 6.614 770 HG12 VAL 110 HG12 VAL 110 -13.774 4.594 5.637 771 HG13 VAL 110 HG13 VAL 110 -13.129 5.951 6.558 772 HG21 VAL 110 HG21 VAL 110 -14.499 2.594 6.663 773 HG22 VAL 110 HG22 VAL 110 -15.597 3.359 7.814 774 HG23 VAL 110 HG23 VAL 110 -14.311 2.298 8.392 775 H SER 111 H SER 111 -11.418 4.625 10.029 776 HA SER 111 HA SER 111 -11.819 2.104 11.451 777 HB2 SER 111 HB2 SER 111 -9.523 1.907 10.624 778 HB3 SER 111 HB3 SER 111 -9.124 3.479 11.309 779 HG SER 111 HG SER 111 -9.362 1.029 12.510 780 H ALA 112 H ALA 112 -12.315 2.383 13.565 781 HA ALA 112 HA ALA 112 -11.852 4.984 14.844 782 HB1 ALA 112 HB1 ALA 112 -14.075 5.449 15.283 783 HB2 ALA 112 HB2 ALA 112 -14.569 3.762 15.126 784 HB3 ALA 112 HB3 ALA 112 -14.212 4.715 13.685 785 H ALA 113 H ALA 113 -13.342 1.777 15.236 786 HA ALA 113 HA ALA 113 -13.319 0.260 16.955 787 HB1 ALA 113 HB1 ALA 113 -11.101 0.215 18.259 788 HB2 ALA 113 HB2 ALA 113 -10.590 1.518 17.184 789 HB3 ALA 113 HB3 ALA 113 -11.022 -0.056 16.517 790 H SER 114 H SER 114 -14.390 3.019 17.463 791 HA SER 114 HA SER 114 -13.789 3.797 20.134 792 HB2 SER 114 HB2 SER 114 -15.816 5.158 19.970 793 HB3 SER 114 HB3 SER 114 -14.862 5.302 18.497 794 HG SER 114 HG SER 114 -17.100 3.599 18.919 795 H ALA 115 H ALA 115 -16.157 1.626 18.700 796 HA ALA 115 HA ALA 115 -16.594 0.333 21.269 797 HB1 ALA 115 HB1 ALA 115 -18.731 0.980 21.639 798 HB2 ALA 115 HB2 ALA 115 -19.152 0.892 19.928 799 HB3 ALA 115 HB3 ALA 115 -18.355 2.330 20.567 800 H ALA 116 H ALA 116 -17.503 -1.735 21.067 801 HA ALA 116 HA ALA 116 -17.810 -2.743 18.313 802 HB1 ALA 116 HB1 ALA 116 -16.372 -4.333 20.427 803 HB2 ALA 116 HB2 ALA 116 -15.515 -3.201 19.376 804 HB3 ALA 116 HB3 ALA 116 -16.378 -4.575 18.679 805 H ALA 117 H ALA 117 -18.380 -3.281 21.772 806 HA ALA 117 HA ALA 117 -19.972 -4.497 22.901 807 HB1 ALA 117 HB1 ALA 117 -21.772 -3.846 20.566 808 HB2 ALA 117 HB2 ALA 117 -21.268 -2.624 21.733 809 HB3 ALA 117 HB3 ALA 117 -22.207 -4.019 22.267 810 H SER 118 H SER 118 -18.825 -6.509 22.552 811 HA SER 118 HA SER 118 -20.249 -8.349 20.732 812 HB2 SER 118 HB2 SER 118 -17.319 -8.343 21.505 813 HB3 SER 118 HB3 SER 118 -18.113 -9.619 20.584 814 HG SER 118 HG SER 118 -17.553 -6.954 19.876 815 H ALA 119 H ALA 119 -21.302 -9.868 21.792 816 HA ALA 119 HA ALA 119 -21.247 -10.082 24.583 817 HB1 ALA 119 HB1 ALA 119 -23.250 -10.745 23.517 818 HB2 ALA 119 HB2 ALA 119 -22.558 -12.245 24.140 819 HB3 ALA 119 HB3 ALA 119 -22.402 -11.843 22.428 820 H PHE 120 H PHE 120 -19.648 -11.980 22.063 821 HA PHE 120 HA PHE 120 -17.822 -13.064 24.064 822 HB2 PHE 120 HB2 PHE 120 -18.127 -15.389 23.311 823 HB3 PHE 120 HB3 PHE 120 -19.611 -14.739 24.004 824 HD1 PHE 120 HD1 PHE 120 -17.931 -15.818 20.910 825 HD2 PHE 120 HD2 PHE 120 -21.546 -14.222 22.592 826 HE1 PHE 120 HE1 PHE 120 -19.137 -16.334 18.805 827 HE2 PHE 120 HE2 PHE 120 -22.753 -14.737 20.488 828 HZ PHE 120 HZ PHE 120 -21.549 -15.792 18.594 829 H GLY 121 H GLY 121 -15.983 -14.204 23.085 830 HA2 GLY 121 HA2 GLY 121 -14.170 -14.207 21.654 831 HA3 GLY 121 HA3 GLY 121 -15.364 -14.258 20.360 832 H SER 122 H SER 122 -13.743 -12.013 22.603 833 HA SER 122 HA SER 122 -13.350 -10.098 20.462 834 HB2 SER 122 HB2 SER 122 -15.598 -9.495 21.217 835 HB3 SER 122 HB3 SER 122 -15.028 -9.387 22.880 836 HG SER 122 HG SER 122 -14.536 -7.410 22.389 837 H LEU 123 H LEU 123 -11.689 -8.662 20.883 838 HA LEU 123 HA LEU 123 -10.164 -9.173 23.365 839 HB2 LEU 123 HB2 LEU 123 -8.995 -9.782 21.278 840 HB3 LEU 123 HB3 LEU 123 -9.220 -8.148 20.666 841 HG LEU 123 HG LEU 123 -7.874 -7.285 22.597 842 HD11 LEU 123 HD11 LEU 123 -7.538 -10.247 23.147 843 HD12 LEU 123 HD12 LEU 123 -8.156 -9.012 24.244 844 HD13 LEU 123 HD13 LEU 123 -6.452 -9.018 23.795 845 HD21 LEU 123 HD21 LEU 123 -6.757 -7.630 20.482 846 HD22 LEU 123 HD22 LEU 123 -6.603 -9.358 20.790 847 HD23 LEU 123 HD23 LEU 123 -5.683 -8.206 21.754 848 H SER 124 H SER 124 -10.220 -7.606 24.831 849 HA SER 124 HA SER 124 -9.858 -4.848 24.174 850 HB2 SER 124 HB2 SER 124 -12.003 -4.014 25.006 851 HB3 SER 124 HB3 SER 124 -12.245 -5.063 23.612 852 HG SER 124 HG SER 124 -13.145 -5.331 26.134 853 H SER 125 H SER 125 -10.655 -7.333 26.509 854 HA SER 125 HA SER 125 -9.601 -5.646 28.682 855 HB2 SER 125 HB2 SER 125 -11.481 -7.983 28.643 856 HB3 SER 125 HB3 SER 125 -10.710 -7.440 30.132 857 HG SER 125 HG SER 125 -12.446 -6.187 30.105 858 H ALA 126 H ALA 126 -9.011 -8.506 26.815 859 HA ALA 126 HA ALA 126 -7.430 -10.000 28.592 860 HB1 ALA 126 HB1 ALA 126 -7.150 -11.356 26.812 861 HB2 ALA 126 HB2 ALA 126 -6.458 -10.056 25.831 862 HB3 ALA 126 HB3 ALA 126 -8.212 -10.248 25.942 863 H LEU 127 H LEU 127 -6.573 -7.427 26.305 864 HA LEU 127 HA LEU 127 -3.922 -7.253 27.581 865 HB2 LEU 127 HB2 LEU 127 -4.728 -6.571 24.742 866 HB3 LEU 127 HB3 LEU 127 -3.132 -6.288 25.431 867 HG LEU 127 HG LEU 127 -4.436 -9.026 25.311 868 HD11 LEU 127 HD11 LEU 127 -3.001 -9.466 23.384 869 HD12 LEU 127 HD12 LEU 127 -2.328 -7.838 23.480 870 HD13 LEU 127 HD13 LEU 127 -4.020 -8.068 23.040 871 HD21 LEU 127 HD21 LEU 127 -1.622 -8.049 25.903 872 HD22 LEU 127 HD22 LEU 127 -2.025 -9.742 25.621 873 HD23 LEU 127 HD23 LEU 127 -2.707 -8.892 27.007 874 H LEU 128 H LEU 128 -3.127 -5.158 28.072 875 HA LEU 128 HA LEU 128 -5.223 -3.121 28.320 876 HB2 LEU 128 HB2 LEU 128 -2.660 -3.735 29.729 877 HB3 LEU 128 HB3 LEU 128 -3.125 -2.042 29.632 878 HG LEU 128 HG LEU 128 -5.422 -2.775 30.517 879 HD11 LEU 128 HD11 LEU 128 -5.430 -4.906 31.779 880 HD12 LEU 128 HD12 LEU 128 -3.807 -5.259 31.184 881 HD13 LEU 128 HD13 LEU 128 -5.162 -5.183 30.058 882 HD21 LEU 128 HD21 LEU 128 -4.633 -2.778 32.845 883 HD22 LEU 128 HD22 LEU 128 -3.697 -1.626 31.893 884 HD23 LEU 128 HD23 LEU 128 -3.005 -3.194 32.309 885 H MET 129 H MET 129 -5.201 -2.657 26.028 886 HA MET 129 HA MET 129 -3.126 -0.690 25.339 887 HB2 MET 129 HB2 MET 129 -2.576 -2.898 24.260 888 HB3 MET 129 HB3 MET 129 -4.106 -2.790 23.387 889 HG2 MET 129 HG2 MET 129 -3.398 -0.677 22.362 890 HG3 MET 129 HG3 MET 129 -1.891 -0.721 23.275 891 HE1 MET 129 HE1 MET 129 -3.233 -3.269 19.745 892 HE2 MET 129 HE2 MET 129 -4.136 -2.079 20.682 893 HE3 MET 129 HE3 MET 129 -3.878 -3.694 21.337 894 HA PRO 130 HA PRO 130 -7.466 0.983 24.780 895 HB2 PRO 130 HB2 PRO 130 -5.909 3.510 25.116 896 HB3 PRO 130 HB3 PRO 130 -7.450 3.028 25.852 897 HG2 PRO 130 HG2 PRO 130 -5.246 3.031 27.290 898 HG3 PRO 130 HG3 PRO 130 -6.419 1.710 27.455 899 HD2 PRO 130 HD2 PRO 130 -3.799 1.725 25.973 900 HD3 PRO 130 HD3 PRO 130 -4.506 0.451 26.998 901 H LYS 131 H LYS 131 -8.340 1.634 22.880 902 HA LYS 131 HA LYS 131 -8.501 2.118 20.641 903 HB2 LYS 131 HB2 LYS 131 -6.347 4.077 21.465 904 HB3 LYS 131 HB3 LYS 131 -7.176 4.113 19.907 905 HG2 LYS 131 HG2 LYS 131 -9.343 4.358 21.063 906 HG3 LYS 131 HG3 LYS 131 -8.514 4.328 22.622 907 HD2 LYS 131 HD2 LYS 131 -7.244 6.347 21.989 908 HD3 LYS 131 HD3 LYS 131 -8.075 6.381 20.432 909 HE2 LYS 131 HE2 LYS 131 -10.239 6.637 21.586 910 HE3 LYS 131 HE3 LYS 131 -9.414 6.598 23.145 911 HZ1 LYS 131 HZ1 LYS 131 -8.872 8.589 21.012 912 HZ2 LYS 131 HZ2 LYS 131 -8.230 8.582 22.585 913 HZ3 LYS 131 HZ3 LYS 131 -9.889 8.864 22.343 914 H ASP 132 H ASP 132 -7.093 2.474 18.562 915 HA ASP 132 HA ASP 132 -5.032 0.358 18.553 916 HB2 ASP 132 HB2 ASP 132 -5.514 0.105 16.174 917 HB3 ASP 132 HB3 ASP 132 -6.986 -0.064 17.121 918 H GLY 133 H GLY 133 -4.849 3.443 19.047 919 HA2 GLY 133 HA2 GLY 133 -3.194 5.025 18.723 920 HA3 GLY 133 HA3 GLY 133 -2.283 3.798 17.847 921 H LEU 134 H LEU 134 -5.194 5.820 17.452 922 HA LEU 134 HA LEU 134 -5.176 5.736 14.605 923 HB2 LEU 134 HB2 LEU 134 -6.516 7.631 16.550 924 HB3 LEU 134 HB3 LEU 134 -6.811 7.623 14.813 925 HG LEU 134 HG LEU 134 -7.182 5.175 16.564 926 HD11 LEU 134 HD11 LEU 134 -8.692 7.098 17.194 927 HD12 LEU 134 HD12 LEU 134 -9.549 5.675 16.600 928 HD13 LEU 134 HD13 LEU 134 -9.319 7.071 15.545 929 HD21 LEU 134 HD21 LEU 134 -8.639 4.510 14.592 930 HD22 LEU 134 HD22 LEU 134 -6.918 4.612 14.225 931 HD23 LEU 134 HD23 LEU 134 -8.003 5.912 13.734 932 H GLU 135 H GLU 135 -4.494 7.234 13.113 933 HA GLU 135 HA GLU 135 -2.395 9.083 14.027 934 HB2 GLU 135 HB2 GLU 135 -1.868 7.405 12.246 935 HB3 GLU 135 HB3 GLU 135 -3.070 8.178 11.213 936 HG2 GLU 135 HG2 GLU 135 -1.820 10.296 11.322 937 HG3 GLU 135 HG3 GLU 135 -0.628 9.546 12.382 938 H HIS 136 H HIS 136 -2.685 11.225 13.999 939 HA HIS 136 HA HIS 136 -5.202 12.405 13.499 940 HB2 HIS 136 HB2 HIS 136 -2.447 13.619 13.796 941 HB3 HIS 136 HB3 HIS 136 -3.929 14.570 13.689 942 HD2 HIS 136 HD2 HIS 136 -1.888 12.752 16.367 943 HE1 HIS 136 HE1 HIS 136 -5.708 13.395 18.048 944 HE2 HIS 136 HE2 HIS 136 -3.317 12.696 18.551 945 H HIS 137 H HIS 137 -2.255 12.189 11.551 946 HA HIS 137 HA HIS 137 -1.818 12.659 9.353 947 HB2 HIS 137 HB2 HIS 137 -3.631 10.913 9.149 948 HB3 HIS 137 HB3 HIS 137 -4.787 12.229 8.949 949 HD2 HIS 137 HD2 HIS 137 -5.090 12.917 6.298 950 HE1 HIS 137 HE1 HIS 137 -1.348 11.570 4.883 951 HE2 HIS 137 HE2 HIS 137 -3.558 12.619 4.205 952 H HIS 138 H HIS 138 -1.539 14.898 10.376 953 HA HIS 138 HA HIS 138 -3.475 16.936 9.906 954 HB2 HIS 138 HB2 HIS 138 -0.491 17.030 10.387 955 HB3 HIS 138 HB3 HIS 138 -1.488 18.474 10.226 956 HD2 HIS 138 HD2 HIS 138 -2.983 19.123 12.504 957 HE1 HIS 138 HE1 HIS 138 -1.968 15.716 14.779 958 HE2 HIS 138 HE2 HIS 138 -3.137 17.969 14.842 959 H HIS 139 H HIS 139 -3.607 18.463 8.276 960 HA HIS 139 HA HIS 139 -3.060 17.624 5.646 961 HB2 HIS 139 HB2 HIS 139 -4.843 19.241 6.261 962 HB3 HIS 139 HB3 HIS 139 -3.608 20.434 6.648 963 HD2 HIS 139 HD2 HIS 139 -2.858 21.965 4.465 964 HE1 HIS 139 HE1 HIS 139 -4.368 19.451 1.429 965 HE2 HIS 139 HE2 HIS 139 -3.250 21.682 1.900 966 H HIS 140 H HIS 140 -1.422 20.000 7.731 967 HA HIS 140 HA HIS 140 0.551 20.799 5.869 968 HB2 HIS 140 HB2 HIS 140 -0.049 21.998 8.002 969 HB3 HIS 140 HB3 HIS 140 0.810 20.742 8.887 970 HD2 HIS 140 HD2 HIS 140 3.483 21.346 9.218 971 HE1 HIS 140 HE1 HIS 140 3.896 24.058 6.010 972 HE2 HIS 140 HE2 HIS 140 5.096 22.975 7.968 973 H HIS 141 H HIS 141 2.515 19.983 5.348 974 HA HIS 141 HA HIS 141 3.091 17.241 6.138 975 HB2 HIS 141 HB2 HIS 141 3.276 18.127 3.758 976 HB3 HIS 141 HB3 HIS 141 4.711 19.000 4.290 977 HD2 HIS 141 HD2 HIS 141 3.684 15.399 3.278 978 HE1 HIS 141 HE1 HIS 141 7.657 15.202 4.691 979 HE2 HIS 141 HE2 HIS 141 5.814 13.910 3.513 Start of MODEL 19 1 H1 MET 1 HT1 MET 1 -4.545 8.569 -11.527 2 H2 MET 1 HT2 MET 1 -4.981 9.683 -10.320 3 H3 MET 1 HT3 MET 1 -4.344 8.166 -9.892 4 HA MET 1 HA MET 1 -2.688 9.891 -9.631 5 HB2 MET 1 HB2 MET 1 -0.921 8.823 -10.990 6 HB3 MET 1 HB3 MET 1 -1.971 7.616 -10.258 7 HG2 MET 1 HG2 MET 1 -3.226 7.412 -12.378 8 HG3 MET 1 HG3 MET 1 -2.176 8.623 -13.116 9 HE1 MET 1 HE1 MET 1 -2.530 5.582 -14.389 10 HE2 MET 1 HE2 MET 1 -0.879 5.646 -15.002 11 HE3 MET 1 HE3 MET 1 -1.854 7.115 -14.960 12 H SER 2 H SER 2 -1.014 11.121 -11.044 13 HA SER 2 HA SER 2 -2.415 12.538 -13.234 14 HB2 SER 2 HB2 SER 2 -0.734 13.767 -11.039 15 HB3 SER 2 HB3 SER 2 -1.383 14.635 -12.427 16 HG SER 2 HG SER 2 -2.687 13.544 -10.204 17 H ASP 3 H ASP 3 -1.112 13.436 -14.853 18 HA ASP 3 HA ASP 3 1.485 12.097 -15.179 19 HB2 ASP 3 HB2 ASP 3 1.267 12.671 -17.547 20 HB3 ASP 3 HB3 ASP 3 -0.165 11.822 -16.984 21 H GLN 4 H GLN 4 0.902 14.589 -13.526 22 HA GLN 4 HA GLN 4 2.960 16.330 -14.745 23 HB2 GLN 4 HB2 GLN 4 0.440 17.131 -13.279 24 HB3 GLN 4 HB3 GLN 4 1.783 18.237 -13.572 25 HG2 GLN 4 HG2 GLN 4 1.562 17.983 -15.966 26 HG3 GLN 4 HG3 GLN 4 0.375 16.696 -15.766 27 HE21 GLN 4 HE21 GLN 4 0.063 19.373 -17.128 28 HE22 GLN 4 HE22 GLN 4 -1.249 20.117 -16.349 29 H SER 5 H SER 5 1.643 14.802 -11.898 30 HA SER 5 HA SER 5 3.442 16.088 -10.034 31 HB2 SER 5 HB2 SER 5 1.248 15.390 -9.257 32 HB3 SER 5 HB3 SER 5 1.573 13.727 -9.742 33 HG SER 5 HG SER 5 2.945 15.255 -7.776 34 H GLN 6 H GLN 6 5.224 15.188 -9.044 35 HA GLN 6 HA GLN 6 6.521 13.010 -10.511 36 HB2 GLN 6 HB2 GLN 6 7.550 14.962 -8.434 37 HB3 GLN 6 HB3 GLN 6 8.532 13.701 -9.181 38 HG2 GLN 6 HG2 GLN 6 8.055 14.658 -11.411 39 HG3 GLN 6 HG3 GLN 6 7.098 15.930 -10.653 40 HE21 GLN 6 HE21 GLN 6 8.402 17.778 -10.964 41 HE22 GLN 6 HE22 GLN 6 10.018 17.890 -10.460 42 H GLU 7 H GLU 7 4.286 12.411 -8.775 43 HA GLU 7 HA GLU 7 5.633 10.627 -6.841 44 HB2 GLU 7 HB2 GLU 7 3.070 12.177 -6.371 45 HB3 GLU 7 HB3 GLU 7 3.738 10.966 -5.278 46 HG2 GLU 7 HG2 GLU 7 5.794 12.317 -5.038 47 HG3 GLU 7 HG3 GLU 7 5.122 13.530 -6.124 48 HA PRO 8 HA PRO 8 2.691 8.195 -9.514 49 HB2 PRO 8 HB2 PRO 8 4.401 6.504 -10.712 50 HB3 PRO 8 HB3 PRO 8 4.202 8.174 -11.284 51 HG2 PRO 8 HG2 PRO 8 6.378 6.981 -9.642 52 HG3 PRO 8 HG3 PRO 8 6.469 8.192 -10.930 53 HD2 PRO 8 HD2 PRO 8 6.496 8.756 -8.191 54 HD3 PRO 8 HD3 PRO 8 6.123 9.927 -9.474 55 H THR 9 H THR 9 3.635 7.850 -6.686 56 HA THR 9 HA THR 9 4.316 5.167 -6.164 57 HB THR 9 HB THR 9 3.605 5.626 -3.847 58 HG1 THR 9 HG1 THR 9 1.971 6.938 -3.767 59 HG21 THR 9 HG21 THR 9 5.815 6.366 -4.488 60 HG22 THR 9 HG22 THR 9 5.090 7.622 -3.483 61 HG23 THR 9 HG23 THR 9 5.158 7.824 -5.235 62 H MET 10 H MET 10 2.922 3.719 -4.819 63 HA MET 10 HA MET 10 0.832 2.707 -6.357 64 HB2 MET 10 HB2 MET 10 1.565 2.246 -3.466 65 HB3 MET 10 HB3 MET 10 0.316 1.324 -4.306 66 HG2 MET 10 HG2 MET 10 1.930 0.549 -5.954 67 HG3 MET 10 HG3 MET 10 3.186 1.570 -5.254 68 HE1 MET 10 HE1 MET 10 1.339 -2.286 -3.732 69 HE2 MET 10 HE2 MET 10 0.802 -1.203 -5.013 70 HE3 MET 10 HE3 MET 10 0.436 -0.818 -3.334 71 H GLU 11 H GLU 11 0.680 4.888 -3.559 72 HA GLU 11 HA GLU 11 -2.002 4.749 -2.882 73 HB2 GLU 11 HB2 GLU 11 -0.261 6.204 -1.787 74 HB3 GLU 11 HB3 GLU 11 -0.431 7.331 -3.131 75 HG2 GLU 11 HG2 GLU 11 -2.858 6.448 -1.573 76 HG3 GLU 11 HG3 GLU 11 -1.830 7.739 -0.962 77 H GLU 12 H GLU 12 -0.672 7.142 -5.177 78 HA GLU 12 HA GLU 12 -3.108 8.008 -6.204 79 HB2 GLU 12 HB2 GLU 12 -0.343 7.932 -7.405 80 HB3 GLU 12 HB3 GLU 12 -1.709 8.696 -8.221 81 HG2 GLU 12 HG2 GLU 12 -0.730 10.481 -7.041 82 HG3 GLU 12 HG3 GLU 12 -2.043 9.985 -5.982 83 H ILE 13 H ILE 13 -1.020 5.324 -7.323 84 HA ILE 13 HA ILE 13 -2.348 4.737 -9.696 85 HB ILE 13 HB ILE 13 -0.835 2.946 -7.762 86 HG12 ILE 13 HG12 ILE 13 0.026 4.123 -10.423 87 HG13 ILE 13 HG13 ILE 13 0.297 4.951 -8.892 88 HG21 ILE 13 HG21 ILE 13 -1.464 2.386 -10.680 89 HG22 ILE 13 HG22 ILE 13 -2.370 1.664 -9.351 90 HG23 ILE 13 HG23 ILE 13 -0.655 1.314 -9.541 91 HD11 ILE 13 HD11 ILE 13 2.202 3.449 -9.830 92 HD12 ILE 13 HD12 ILE 13 1.213 2.100 -9.274 93 HD13 ILE 13 HD13 ILE 13 1.795 3.302 -8.122 94 H LEU 14 H LEU 14 -3.008 3.430 -6.392 95 HA LEU 14 HA LEU 14 -5.126 1.731 -7.175 96 HB2 LEU 14 HB2 LEU 14 -4.210 2.962 -4.592 97 HB3 LEU 14 HB3 LEU 14 -5.783 2.180 -4.645 98 HG LEU 14 HG LEU 14 -4.518 0.180 -5.736 99 HD11 LEU 14 HD11 LEU 14 -2.208 1.628 -4.419 100 HD12 LEU 14 HD12 LEU 14 -2.414 1.402 -6.156 101 HD13 LEU 14 HD13 LEU 14 -2.149 0.008 -5.109 102 HD21 LEU 14 HD21 LEU 14 -4.031 0.925 -2.837 103 HD22 LEU 14 HD22 LEU 14 -3.872 -0.698 -3.505 104 HD23 LEU 14 HD23 LEU 14 -5.448 0.089 -3.467 105 H ALA 15 H ALA 15 -4.939 5.095 -6.274 106 HA ALA 15 HA ALA 15 -7.715 5.695 -6.114 107 HB1 ALA 15 HB1 ALA 15 -7.071 7.923 -5.973 108 HB2 ALA 15 HB2 ALA 15 -5.695 7.697 -7.054 109 HB3 ALA 15 HB3 ALA 15 -5.624 7.095 -5.398 110 H SER 16 H SER 16 -5.392 5.705 -8.759 111 HA SER 16 HA SER 16 -6.919 6.994 -10.717 112 HB2 SER 16 HB2 SER 16 -4.531 6.557 -10.976 113 HB3 SER 16 HB3 SER 16 -4.841 4.828 -11.061 114 HG SER 16 HG SER 16 -5.477 6.869 -12.895 115 H ILE 17 H ILE 17 -6.601 3.462 -10.143 116 HA ILE 17 HA ILE 17 -9.216 2.712 -10.556 117 HB ILE 17 HB ILE 17 -9.021 3.691 -12.862 118 HG12 ILE 17 HG12 ILE 17 -9.269 0.699 -13.130 119 HG13 ILE 17 HG13 ILE 17 -10.465 1.634 -12.235 120 HG21 ILE 17 HG21 ILE 17 -7.565 2.821 -14.506 121 HG22 ILE 17 HG22 ILE 17 -7.153 1.419 -13.520 122 HG23 ILE 17 HG23 ILE 17 -6.555 3.018 -13.076 123 HD11 ILE 17 HD11 ILE 17 -11.141 1.331 -14.591 124 HD12 ILE 17 HD12 ILE 17 -9.649 2.108 -15.118 125 HD13 ILE 17 HD13 ILE 17 -10.857 3.032 -14.227 126 H ARG 18 H ARG 18 -7.082 1.894 -8.986 127 HA ARG 18 HA ARG 18 -5.836 0.052 -8.302 128 HB2 ARG 18 HB2 ARG 18 -8.357 -1.091 -9.495 129 HB3 ARG 18 HB3 ARG 18 -7.147 -2.139 -8.758 130 HG2 ARG 18 HG2 ARG 18 -8.253 0.265 -7.296 131 HG3 ARG 18 HG3 ARG 18 -9.073 -1.295 -7.250 132 HD2 ARG 18 HD2 ARG 18 -6.181 -0.845 -6.461 133 HD3 ARG 18 HD3 ARG 18 -7.517 -0.980 -5.328 134 HE ARG 18 HE ARG 18 -6.270 -3.144 -6.808 135 HH11 ARG 18 HH11 ARG 18 -9.114 -2.113 -5.036 136 HH12 ARG 18 HH12 ARG 18 -9.615 -3.730 -4.675 137 HH21 ARG 18 HH21 ARG 18 -6.964 -5.230 -6.314 138 HH22 ARG 18 HH22 ARG 18 -8.409 -5.480 -5.394 139 H ARG 19 H ARG 19 -5.315 1.040 -11.122 140 HA ARG 19 HA ARG 19 -4.139 -1.453 -12.215 141 HB2 ARG 19 HB2 ARG 19 -6.008 -0.521 -13.583 142 HB3 ARG 19 HB3 ARG 19 -5.077 0.963 -13.781 143 HG2 ARG 19 HG2 ARG 19 -3.270 -0.296 -14.876 144 HG3 ARG 19 HG3 ARG 19 -4.167 -1.800 -14.649 145 HD2 ARG 19 HD2 ARG 19 -6.015 -0.904 -16.020 146 HD3 ARG 19 HD3 ARG 19 -5.111 0.588 -16.259 147 HE ARG 19 HE ARG 19 -3.493 -1.569 -17.078 148 HH11 ARG 19 HH11 ARG 19 -6.431 0.068 -18.064 149 HH12 ARG 19 HH12 ARG 19 -6.227 -0.327 -19.738 150 HH21 ARG 19 HH21 ARG 19 -3.267 -2.060 -19.263 151 HH22 ARG 19 HH22 ARG 19 -4.450 -1.521 -20.409 152 H ILE 20 H ILE 20 -2.018 -1.494 -12.375 153 HA ILE 20 HA ILE 20 -0.298 0.491 -11.439 154 HB ILE 20 HB ILE 20 0.259 -1.917 -11.650 155 HG12 ILE 20 HG12 ILE 20 2.243 -0.311 -13.276 156 HG13 ILE 20 HG13 ILE 20 2.008 -0.022 -11.554 157 HG21 ILE 20 HG21 ILE 20 -0.774 -2.140 -13.961 158 HG22 ILE 20 HG22 ILE 20 0.794 -2.922 -13.762 159 HG23 ILE 20 HG23 ILE 20 0.681 -1.375 -14.600 160 HD11 ILE 20 HD11 ILE 20 2.439 -2.497 -11.186 161 HD12 ILE 20 HD12 ILE 20 3.831 -1.577 -11.753 162 HD13 ILE 20 HD13 ILE 20 2.926 -2.587 -12.879 163 H ILE 21 H ILE 21 1.431 1.608 -12.732 164 HA ILE 21 HA ILE 21 0.410 3.490 -14.488 165 HB ILE 21 HB ILE 21 3.273 2.474 -14.340 166 HG12 ILE 21 HG12 ILE 21 2.041 4.891 -12.982 167 HG13 ILE 21 HG13 ILE 21 2.156 3.322 -12.190 168 HG21 ILE 21 HG21 ILE 21 3.030 3.795 -16.344 169 HG22 ILE 21 HG22 ILE 21 3.759 4.851 -15.135 170 HG23 ILE 21 HG23 ILE 21 2.041 4.992 -15.507 171 HD11 ILE 21 HD11 ILE 21 4.416 5.100 -13.133 172 HD12 ILE 21 HD12 ILE 21 4.663 3.400 -12.730 173 HD13 ILE 21 HD13 ILE 21 4.096 4.526 -11.495 174 H SER 22 H SER 22 0.515 3.766 -16.750 175 HA SER 22 HA SER 22 1.301 1.561 -18.461 176 HB2 SER 22 HB2 SER 22 -0.903 1.246 -19.455 177 HB3 SER 22 HB3 SER 22 -0.980 0.919 -17.725 178 HG SER 22 HG SER 22 -1.786 3.038 -17.447 179 H GLU 23 H GLU 23 1.043 2.127 -20.778 180 HA GLU 23 HA GLU 23 1.464 3.545 -22.528 181 HB2 GLU 23 HB2 GLU 23 -0.558 5.083 -20.909 182 HB3 GLU 23 HB3 GLU 23 0.166 5.811 -22.343 183 HG2 GLU 23 HG2 GLU 23 -1.862 4.725 -23.051 184 HG3 GLU 23 HG3 GLU 23 -0.521 3.740 -23.626 185 H ASP 24 H ASP 24 3.673 3.612 -21.847 186 HA ASP 24 HA ASP 24 4.806 5.510 -20.119 187 HB2 ASP 24 HB2 ASP 24 6.016 3.535 -21.010 188 HB3 ASP 24 HB3 ASP 24 6.054 4.299 -22.600 189 H ASP 25 H ASP 25 4.231 5.620 -23.628 190 HA ASP 25 HA ASP 25 5.174 8.347 -23.821 191 HB2 ASP 25 HB2 ASP 25 4.617 8.151 -26.189 192 HB3 ASP 25 HB3 ASP 25 5.511 6.727 -25.671 193 H ALA 26 H ALA 26 3.430 8.590 -21.959 194 HA ALA 26 HA ALA 26 0.701 8.900 -22.722 195 HB1 ALA 26 HB1 ALA 26 2.324 9.779 -20.345 196 HB2 ALA 26 HB2 ALA 26 1.035 8.577 -20.421 197 HB3 ALA 26 HB3 ALA 26 0.647 10.293 -20.540 198 HA PRO 27 HA PRO 27 0.747 12.857 -24.787 199 HB2 PRO 27 HB2 PRO 27 -1.671 13.596 -23.204 200 HB3 PRO 27 HB3 PRO 27 -1.439 13.564 -24.963 201 HG2 PRO 27 HG2 PRO 27 -2.879 11.704 -23.773 202 HG3 PRO 27 HG3 PRO 27 -1.775 11.283 -25.098 203 HD2 PRO 27 HD2 PRO 27 -1.392 10.903 -22.136 204 HD3 PRO 27 HD3 PRO 27 -0.989 9.803 -23.476 205 H ALA 28 H ALA 28 1.494 14.931 -24.462 206 HA ALA 28 HA ALA 28 1.602 15.994 -21.721 207 HB1 ALA 28 HB1 ALA 28 4.028 16.715 -22.365 208 HB2 ALA 28 HB2 ALA 28 3.930 15.382 -23.516 209 HB3 ALA 28 HB3 ALA 28 3.746 15.072 -21.790 210 H GLU 29 H GLU 29 1.647 18.240 -21.589 211 HA GLU 29 HA GLU 29 1.857 19.831 -24.005 212 HB2 GLU 29 HB2 GLU 29 -0.353 20.936 -23.649 213 HB3 GLU 29 HB3 GLU 29 -0.500 19.247 -24.121 214 HG2 GLU 29 HG2 GLU 29 -0.566 20.132 -21.223 215 HG3 GLU 29 HG3 GLU 29 -2.017 20.030 -22.208 216 HA PRO 30 HA PRO 30 3.170 21.684 -19.854 217 HB2 PRO 30 HB2 PRO 30 5.844 21.880 -20.305 218 HB3 PRO 30 HB3 PRO 30 5.093 20.428 -19.620 219 HG2 PRO 30 HG2 PRO 30 5.941 20.975 -22.429 220 HG3 PRO 30 HG3 PRO 30 6.163 19.513 -21.447 221 HD2 PRO 30 HD2 PRO 30 4.187 19.722 -23.307 222 HD3 PRO 30 HD3 PRO 30 3.997 18.769 -21.818 223 H ALA 31 H ALA 31 3.696 23.882 -19.508 224 HA ALA 31 HA ALA 31 4.531 25.553 -21.740 225 HB1 ALA 31 HB1 ALA 31 2.584 26.742 -22.053 226 HB2 ALA 31 HB2 ALA 31 1.989 26.403 -20.427 227 HB3 ALA 31 HB3 ALA 31 1.904 25.159 -21.675 228 H ALA 32 H ALA 32 4.970 27.753 -21.093 229 HA ALA 32 HA ALA 32 5.018 28.318 -18.223 230 HB1 ALA 32 HB1 ALA 32 7.563 28.638 -19.795 231 HB2 ALA 32 HB2 ALA 32 7.183 27.113 -18.991 232 HB3 ALA 32 HB3 ALA 32 7.341 28.595 -18.046 233 H GLU 33 H GLU 33 5.224 30.532 -17.739 234 HA GLU 33 HA GLU 33 5.140 32.380 -20.047 235 HB2 GLU 33 HB2 GLU 33 3.328 32.442 -17.621 236 HB3 GLU 33 HB3 GLU 33 3.392 33.682 -18.872 237 HG2 GLU 33 HG2 GLU 33 2.752 32.007 -20.570 238 HG3 GLU 33 HG3 GLU 33 2.681 30.767 -19.317 239 H ALA 34 H ALA 34 5.886 34.483 -19.665 240 HA ALA 34 HA ALA 34 8.107 34.720 -17.937 241 HB1 ALA 34 HB1 ALA 34 6.536 36.974 -19.201 242 HB2 ALA 34 HB2 ALA 34 7.773 36.037 -20.039 243 HB3 ALA 34 HB3 ALA 34 8.209 37.030 -18.650 244 H ALA 35 H ALA 35 4.763 35.808 -17.645 245 HA ALA 35 HA ALA 35 3.544 36.565 -15.849 246 HB1 ALA 35 HB1 ALA 35 4.838 35.901 -13.549 247 HB2 ALA 35 HB2 ALA 35 5.613 34.791 -14.687 248 HB3 ALA 35 HB3 ALA 35 3.859 34.765 -14.478 249 HA PRO 36 HA PRO 36 6.608 40.152 -15.438 250 HB2 PRO 36 HB2 PRO 36 5.164 42.036 -16.770 251 HB3 PRO 36 HB3 PRO 36 6.270 40.917 -17.594 252 HG2 PRO 36 HG2 PRO 36 3.304 40.766 -17.306 253 HG3 PRO 36 HG3 PRO 36 4.313 40.476 -18.734 254 HD2 PRO 36 HD2 PRO 36 3.331 38.438 -17.229 255 HD3 PRO 36 HD3 PRO 36 4.902 38.334 -18.055 256 HA PRO 37 HA PRO 37 4.594 41.972 -11.909 257 HB2 PRO 37 HB2 PRO 37 5.283 44.690 -12.947 258 HB3 PRO 37 HB3 PRO 37 5.636 43.961 -11.366 259 HG2 PRO 37 HG2 PRO 37 7.549 44.224 -13.159 260 HG3 PRO 37 HG3 PRO 37 7.431 42.746 -12.184 261 HD2 PRO 37 HD2 PRO 37 6.617 43.183 -15.045 262 HD3 PRO 37 HD3 PRO 37 7.416 41.775 -14.305 263 HA PRO 38 HA PRO 38 0.522 43.137 -13.393 264 HB2 PRO 38 HB2 PRO 38 -0.649 44.080 -11.120 265 HB3 PRO 38 HB3 PRO 38 -0.337 42.356 -11.397 266 HG2 PRO 38 HG2 PRO 38 1.239 44.329 -9.806 267 HG3 PRO 38 HG3 PRO 38 0.787 42.660 -9.404 268 HD2 PRO 38 HD2 PRO 38 3.258 43.291 -10.333 269 HD3 PRO 38 HD3 PRO 38 2.474 41.740 -10.708 270 HA PRO 39 HA PRO 39 0.641 47.509 -14.313 271 HB2 PRO 39 HB2 PRO 39 -1.979 48.107 -14.766 272 HB3 PRO 39 HB3 PRO 39 -1.004 47.145 -15.895 273 HG2 PRO 39 HG2 PRO 39 -2.958 46.231 -13.832 274 HG3 PRO 39 HG3 PRO 39 -2.744 45.680 -15.502 275 HD2 PRO 39 HD2 PRO 39 -1.745 44.291 -13.396 276 HD3 PRO 39 HD3 PRO 39 -0.928 44.332 -14.975 277 HA PRO 40 HA PRO 40 -0.203 49.811 -10.589 278 HB2 PRO 40 HB2 PRO 40 -0.760 52.335 -11.483 279 HB3 PRO 40 HB3 PRO 40 0.873 51.640 -11.488 280 HG2 PRO 40 HG2 PRO 40 -1.089 51.869 -13.725 281 HG3 PRO 40 HG3 PRO 40 0.657 52.180 -13.720 282 HD2 PRO 40 HD2 PRO 40 -0.375 49.869 -14.691 283 HD3 PRO 40 HD3 PRO 40 1.203 49.922 -13.870 284 H GLU 41 H GLU 41 -1.853 50.704 -9.276 285 HA GLU 41 HA GLU 41 -4.587 50.616 -10.410 286 HB2 GLU 41 HB2 GLU 41 -3.637 49.555 -7.734 287 HB3 GLU 41 HB3 GLU 41 -5.325 49.665 -8.226 288 HG2 GLU 41 HG2 GLU 41 -4.876 48.179 -10.138 289 HG3 GLU 41 HG3 GLU 41 -3.180 48.080 -9.670 290 HA PRO 42 HA PRO 42 -5.142 54.615 -8.545 291 HB2 PRO 42 HB2 PRO 42 -7.758 54.602 -7.765 292 HB3 PRO 42 HB3 PRO 42 -7.257 54.702 -9.467 293 HG2 PRO 42 HG2 PRO 42 -8.170 52.329 -7.900 294 HG3 PRO 42 HG3 PRO 42 -8.610 52.832 -9.544 295 HD2 PRO 42 HD2 PRO 42 -6.778 50.887 -9.090 296 HD3 PRO 42 HD3 PRO 42 -6.650 51.993 -10.475 297 H GLU 43 H GLU 43 -5.534 55.760 -6.528 298 HA GLU 43 HA GLU 43 -5.399 54.002 -4.149 299 HB2 GLU 43 HB2 GLU 43 -3.995 55.815 -3.104 300 HB3 GLU 43 HB3 GLU 43 -3.228 54.984 -4.453 301 HG2 GLU 43 HG2 GLU 43 -3.855 56.839 -5.961 302 HG3 GLU 43 HG3 GLU 43 -4.635 57.674 -4.621 303 HA PRO 44 HA PRO 44 -9.137 56.847 -3.800 304 HB2 PRO 44 HB2 PRO 44 -10.845 54.916 -2.848 305 HB3 PRO 44 HB3 PRO 44 -10.628 55.278 -4.573 306 HG2 PRO 44 HG2 PRO 44 -9.418 53.101 -2.928 307 HG3 PRO 44 HG3 PRO 44 -10.100 53.035 -4.565 308 HD2 PRO 44 HD2 PRO 44 -7.432 53.133 -4.155 309 HD3 PRO 44 HD3 PRO 44 -8.191 53.938 -5.547 310 H GLU 45 H GLU 45 -7.397 54.712 -1.709 311 HA GLU 45 HA GLU 45 -8.309 56.244 0.651 312 HB2 GLU 45 HB2 GLU 45 -7.654 53.283 0.543 313 HB3 GLU 45 HB3 GLU 45 -8.033 54.188 2.006 314 HG2 GLU 45 HG2 GLU 45 -9.889 53.866 -0.374 315 HG3 GLU 45 HG3 GLU 45 -10.013 52.966 1.133 316 HA PRO 46 HA PRO 46 -3.656 56.573 0.084 317 HB2 PRO 46 HB2 PRO 46 -3.471 59.235 0.687 318 HB3 PRO 46 HB3 PRO 46 -3.794 58.623 -0.949 319 HG2 PRO 46 HG2 PRO 46 -5.706 59.677 1.083 320 HG3 PRO 46 HG3 PRO 46 -5.629 59.988 -0.661 321 HD2 PRO 46 HD2 PRO 46 -7.399 58.229 0.395 322 HD3 PRO 46 HD3 PRO 46 -6.666 57.979 -1.206 323 H VAL 47 H VAL 47 -5.889 57.227 2.629 324 HA VAL 47 HA VAL 47 -3.708 57.049 4.623 325 HB VAL 47 HB VAL 47 -5.076 58.453 6.138 326 HG11 VAL 47 HG11 VAL 47 -3.343 59.544 4.852 327 HG12 VAL 47 HG12 VAL 47 -4.758 60.599 4.860 328 HG13 VAL 47 HG13 VAL 47 -4.386 59.631 3.433 329 HG21 VAL 47 HG21 VAL 47 -6.795 59.041 3.709 330 HG22 VAL 47 HG22 VAL 47 -7.042 59.603 5.363 331 HG23 VAL 47 HG23 VAL 47 -7.274 57.901 4.965 332 H SER 48 H SER 48 -4.365 56.141 6.701 333 HA SER 48 HA SER 48 -6.755 54.449 6.684 334 HB2 SER 48 HB2 SER 48 -5.504 52.425 7.187 335 HB3 SER 48 HB3 SER 48 -4.943 53.090 5.654 336 HG SER 48 HG SER 48 -3.551 52.603 7.868 337 H PHE 49 H PHE 49 -6.996 53.308 8.833 338 HA PHE 49 HA PHE 49 -5.566 54.333 11.092 339 HB2 PHE 49 HB2 PHE 49 -7.531 55.398 12.180 340 HB3 PHE 49 HB3 PHE 49 -7.030 56.266 10.729 341 HD1 PHE 49 HD1 PHE 49 -9.616 54.116 12.233 342 HD2 PHE 49 HD2 PHE 49 -8.393 56.220 8.694 343 HE1 PHE 49 HE1 PHE 49 -11.894 53.851 11.288 344 HE2 PHE 49 HE2 PHE 49 -10.670 55.957 7.751 345 HZ PHE 49 HZ PHE 49 -12.421 54.772 9.046 346 H ASP 50 H ASP 50 -5.721 52.900 12.729 347 HA ASP 50 HA ASP 50 -7.717 50.736 12.422 348 HB2 ASP 50 HB2 ASP 50 -4.912 50.505 13.529 349 HB3 ASP 50 HB3 ASP 50 -6.072 49.209 13.291 350 H ASP 51 H ASP 51 -8.822 50.061 14.189 351 HA ASP 51 HA ASP 51 -8.544 51.710 16.616 352 HB2 ASP 51 HB2 ASP 51 -10.833 49.960 15.688 353 HB3 ASP 51 HB3 ASP 51 -10.831 50.963 17.135 354 H GLU 52 H GLU 52 -7.959 50.862 18.517 355 HA GLU 52 HA GLU 52 -8.363 48.177 19.317 356 HB2 GLU 52 HB2 GLU 52 -6.543 47.821 17.620 357 HB3 GLU 52 HB3 GLU 52 -5.491 48.840 18.605 358 HG2 GLU 52 HG2 GLU 52 -5.750 47.305 20.505 359 HG3 GLU 52 HG3 GLU 52 -6.848 46.300 19.561 360 H VAL 53 H VAL 53 -9.200 49.840 20.865 361 HA VAL 53 HA VAL 53 -7.314 51.280 22.491 362 HB VAL 53 HB VAL 53 -9.283 51.842 23.889 363 HG11 VAL 53 HG11 VAL 53 -8.742 53.161 21.867 364 HG12 VAL 53 HG12 VAL 53 -10.480 53.109 22.159 365 HG13 VAL 53 HG13 VAL 53 -9.765 52.095 20.905 366 HG21 VAL 53 HG21 VAL 53 -11.516 51.072 23.208 367 HG22 VAL 53 HG22 VAL 53 -10.500 49.689 23.617 368 HG23 VAL 53 HG23 VAL 53 -10.806 50.090 21.926 369 H LEU 54 H LEU 54 -9.013 48.216 22.702 370 HA LEU 54 HA LEU 54 -7.392 47.536 25.065 371 HB2 LEU 54 HB2 LEU 54 -10.365 47.092 24.742 372 HB3 LEU 54 HB3 LEU 54 -9.388 46.282 25.965 373 HG LEU 54 HG LEU 54 -9.497 49.298 25.675 374 HD11 LEU 54 HD11 LEU 54 -11.740 48.552 26.211 375 HD12 LEU 54 HD12 LEU 54 -11.008 49.178 27.690 376 HD13 LEU 54 HD13 LEU 54 -11.127 47.436 27.432 377 HD21 LEU 54 HD21 LEU 54 -8.496 47.393 27.816 378 HD22 LEU 54 HD22 LEU 54 -8.716 49.121 28.093 379 HD23 LEU 54 HD23 LEU 54 -7.548 48.562 26.895 380 H GLU 55 H GLU 55 -6.513 45.549 25.036 381 HA GLU 55 HA GLU 55 -6.424 44.076 22.628 382 HB2 GLU 55 HB2 GLU 55 -5.104 42.432 23.916 383 HB3 GLU 55 HB3 GLU 55 -4.553 44.083 24.179 384 HG2 GLU 55 HG2 GLU 55 -5.857 44.171 26.285 385 HG3 GLU 55 HG3 GLU 55 -6.372 42.515 26.027 386 H LEU 56 H LEU 56 -8.624 43.897 25.300 387 HA LEU 56 HA LEU 56 -10.391 42.504 25.790 388 HB2 LEU 56 HB2 LEU 56 -10.214 42.603 22.806 389 HB3 LEU 56 HB3 LEU 56 -11.289 41.397 23.503 390 HG LEU 56 HG LEU 56 -12.273 43.306 24.910 391 HD11 LEU 56 HD11 LEU 56 -11.946 45.565 24.068 392 HD12 LEU 56 HD12 LEU 56 -10.902 44.969 22.779 393 HD13 LEU 56 HD13 LEU 56 -10.373 44.874 24.458 394 HD21 LEU 56 HD21 LEU 56 -12.566 43.443 21.891 395 HD22 LEU 56 HD22 LEU 56 -13.738 44.032 23.069 396 HD23 LEU 56 HD23 LEU 56 -13.409 42.304 22.942 397 H THR 57 H THR 57 -7.794 41.326 26.093 398 HA THR 57 HA THR 57 -7.799 38.649 25.045 399 HB THR 57 HB THR 57 -5.913 38.272 26.592 400 HG1 THR 57 HG1 THR 57 -6.325 40.949 27.400 401 HG21 THR 57 HG21 THR 57 -5.236 39.219 24.536 402 HG22 THR 57 HG22 THR 57 -4.485 40.254 25.751 403 HG23 THR 57 HG23 THR 57 -5.947 40.786 24.923 404 H ASP 58 H ASP 58 -8.010 36.704 26.281 405 HA ASP 58 HA ASP 58 -10.131 36.887 28.288 406 HB2 ASP 58 HB2 ASP 58 -8.953 34.502 26.840 407 HB3 ASP 58 HB3 ASP 58 -10.304 34.434 27.968 408 HA PRO 59 HA PRO 59 -7.363 36.035 31.672 409 HB2 PRO 59 HB2 PRO 59 -8.944 34.620 33.394 410 HB3 PRO 59 HB3 PRO 59 -9.113 36.369 33.138 411 HG2 PRO 59 HG2 PRO 59 -10.697 34.123 31.976 412 HG3 PRO 59 HG3 PRO 59 -11.251 35.681 32.619 413 HD2 PRO 59 HD2 PRO 59 -11.000 35.229 29.950 414 HD3 PRO 59 HD3 PRO 59 -10.719 36.831 30.671 415 H ILE 60 H ILE 60 -8.904 33.444 29.970 416 HA ILE 60 HA ILE 60 -6.951 31.484 31.016 417 HB ILE 60 HB ILE 60 -9.626 30.979 29.663 418 HG12 ILE 60 HG12 ILE 60 -8.807 30.423 32.531 419 HG13 ILE 60 HG13 ILE 60 -9.631 31.905 32.053 420 HG21 ILE 60 HG21 ILE 60 -7.878 29.230 29.235 421 HG22 ILE 60 HG22 ILE 60 -9.221 28.624 30.204 422 HG23 ILE 60 HG23 ILE 60 -7.690 29.035 30.978 423 HD11 ILE 60 HD11 ILE 60 -10.745 29.181 31.368 424 HD12 ILE 60 HD12 ILE 60 -11.587 30.731 31.386 425 HD13 ILE 60 HD13 ILE 60 -11.108 29.971 32.904 426 H ALA 61 H ALA 61 -5.519 30.599 29.655 427 HA ALA 61 HA ALA 61 -5.757 31.214 26.767 428 HB1 ALA 61 HB1 ALA 61 -3.976 32.567 27.479 429 HB2 ALA 61 HB2 ALA 61 -3.170 31.121 26.870 430 HB3 ALA 61 HB3 ALA 61 -3.378 31.351 28.607 431 HA PRO 62 HA PRO 62 -5.742 26.565 27.203 432 HB2 PRO 62 HB2 PRO 62 -6.855 26.854 24.449 433 HB3 PRO 62 HB3 PRO 62 -7.424 25.850 25.796 434 HG2 PRO 62 HG2 PRO 62 -8.742 28.029 25.104 435 HG3 PRO 62 HG3 PRO 62 -8.521 27.613 26.815 436 HD2 PRO 62 HD2 PRO 62 -7.052 29.662 25.172 437 HD3 PRO 62 HD3 PRO 62 -7.651 29.780 26.846 438 H GLU 63 H GLU 63 -4.305 25.073 26.322 439 HA GLU 63 HA GLU 63 -2.008 26.083 24.987 440 HB2 GLU 63 HB2 GLU 63 -2.928 23.260 25.569 441 HB3 GLU 63 HB3 GLU 63 -1.360 23.651 24.857 442 HG2 GLU 63 HG2 GLU 63 -0.806 25.041 26.814 443 HG3 GLU 63 HG3 GLU 63 -2.377 24.675 27.525 444 HA PRO 64 HA PRO 64 -3.356 25.624 20.755 445 HB2 PRO 64 HB2 PRO 64 -1.007 25.356 19.425 446 HB3 PRO 64 HB3 PRO 64 -1.510 26.891 20.166 447 HG2 PRO 64 HG2 PRO 64 0.378 24.823 21.198 448 HG3 PRO 64 HG3 PRO 64 0.536 26.587 21.192 449 HD2 PRO 64 HD2 PRO 64 -0.250 25.204 23.404 450 HD3 PRO 64 HD3 PRO 64 -0.807 26.855 23.062 451 H GLU 65 H GLU 65 -3.556 24.116 19.010 452 HA GLU 65 HA GLU 65 -2.620 21.371 19.595 453 HB2 GLU 65 HB2 GLU 65 -5.347 22.194 18.557 454 HB3 GLU 65 HB3 GLU 65 -4.772 20.532 18.688 455 HG2 GLU 65 HG2 GLU 65 -4.474 20.839 21.128 456 HG3 GLU 65 HG3 GLU 65 -5.092 22.485 20.986 457 H LEU 66 H LEU 66 -1.975 20.164 17.835 458 HA LEU 66 HA LEU 66 -2.461 20.905 15.135 459 HB2 LEU 66 HB2 LEU 66 -0.562 22.524 16.255 460 HB3 LEU 66 HB3 LEU 66 0.448 21.229 15.629 461 HG LEU 66 HG LEU 66 -1.626 22.676 13.954 462 HD11 LEU 66 HD11 LEU 66 1.375 23.100 13.974 463 HD12 LEU 66 HD12 LEU 66 0.241 24.160 14.810 464 HD13 LEU 66 HD13 LEU 66 0.174 24.007 13.054 465 HD21 LEU 66 HD21 LEU 66 -0.428 21.656 12.079 466 HD22 LEU 66 HD22 LEU 66 -0.907 20.391 13.210 467 HD23 LEU 66 HD23 LEU 66 0.761 20.959 13.180 468 HA PRO 67 HA PRO 67 0.894 17.310 15.311 469 HB2 PRO 67 HB2 PRO 67 0.534 16.542 18.180 470 HB3 PRO 67 HB3 PRO 67 1.994 16.482 17.173 471 HG2 PRO 67 HG2 PRO 67 1.729 18.373 18.979 472 HG3 PRO 67 HG3 PRO 67 2.381 18.761 17.375 473 HD2 PRO 67 HD2 PRO 67 -0.380 19.267 18.457 474 HD3 PRO 67 HD3 PRO 67 0.645 20.320 17.456 475 HA PRO 68 HA PRO 68 -2.873 14.780 15.144 476 HB2 PRO 68 HB2 PRO 68 -2.195 13.052 13.217 477 HB3 PRO 68 HB3 PRO 68 -2.426 14.773 12.857 478 HG2 PRO 68 HG2 PRO 68 0.091 13.232 13.184 479 HG3 PRO 68 HG3 PRO 68 -0.296 14.536 12.051 480 HD2 PRO 68 HD2 PRO 68 1.116 14.841 14.460 481 HD3 PRO 68 HD3 PRO 68 0.368 16.155 13.527 482 H LEU 69 H LEU 69 -3.101 12.136 14.752 483 HA LEU 69 HA LEU 69 -2.338 10.959 17.244 484 HB2 LEU 69 HB2 LEU 69 -3.613 9.873 14.733 485 HB3 LEU 69 HB3 LEU 69 -3.206 8.831 16.094 486 HG LEU 69 HG LEU 69 -4.531 10.487 17.551 487 HD11 LEU 69 HD11 LEU 69 -6.363 11.650 16.153 488 HD12 LEU 69 HD12 LEU 69 -5.292 11.408 14.772 489 HD13 LEU 69 HD13 LEU 69 -4.761 12.386 16.140 490 HD21 LEU 69 HD21 LEU 69 -5.341 8.228 16.854 491 HD22 LEU 69 HD22 LEU 69 -6.049 8.957 15.413 492 HD23 LEU 69 HD23 LEU 69 -6.654 9.398 17.009 493 H GLU 70 H GLU 70 -1.175 10.717 13.939 494 HA GLU 70 HA GLU 70 0.761 9.895 13.008 495 HB2 GLU 70 HB2 GLU 70 1.692 10.156 15.874 496 HB3 GLU 70 HB3 GLU 70 2.742 9.560 14.593 497 HG2 GLU 70 HG2 GLU 70 1.310 12.233 14.551 498 HG3 GLU 70 HG3 GLU 70 3.003 12.005 14.976 499 H THR 71 H THR 71 -0.192 8.002 12.333 500 HA THR 71 HA THR 71 0.333 5.607 14.000 501 HB THR 71 HB THR 71 -1.836 6.002 11.910 502 HG1 THR 71 HG1 THR 71 -2.999 6.658 13.514 503 HG21 THR 71 HG21 THR 71 -1.297 3.714 13.834 504 HG22 THR 71 HG22 THR 71 -1.043 3.665 12.088 505 HG23 THR 71 HG23 THR 71 -2.674 3.833 12.738 506 H VAL 72 H VAL 72 1.653 4.108 13.154 507 HA VAL 72 HA VAL 72 3.098 4.624 10.760 508 HB VAL 72 HB VAL 72 4.150 2.415 11.176 509 HG11 VAL 72 HG11 VAL 72 5.022 2.994 13.479 510 HG12 VAL 72 HG12 VAL 72 3.821 4.285 13.535 511 HG13 VAL 72 HG13 VAL 72 5.092 4.315 12.312 512 HG21 VAL 72 HG21 VAL 72 2.312 2.254 13.587 513 HG22 VAL 72 HG22 VAL 72 3.489 1.052 13.059 514 HG23 VAL 72 HG23 VAL 72 2.040 1.347 12.099 515 H GLY 73 H GLY 73 3.383 2.854 9.091 516 HA2 GLY 73 HA2 GLY 73 2.329 1.011 7.884 517 HA3 GLY 73 HA3 GLY 73 0.768 1.705 8.315 518 H ASP 74 H ASP 74 2.350 1.155 5.690 519 HA ASP 74 HA ASP 74 1.663 3.720 4.423 520 HB2 ASP 74 HB2 ASP 74 4.238 3.132 4.921 521 HB3 ASP 74 HB3 ASP 74 4.050 2.248 3.406 522 H ILE 75 H ILE 75 2.498 2.864 1.803 523 HA ILE 75 HA ILE 75 0.672 0.591 1.309 524 HB ILE 75 HB ILE 75 -0.375 2.733 0.638 525 HG12 ILE 75 HG12 ILE 75 0.441 1.205 -1.846 526 HG13 ILE 75 HG13 ILE 75 -0.662 0.527 -0.650 527 HG21 ILE 75 HG21 ILE 75 0.570 4.121 -1.094 528 HG22 ILE 75 HG22 ILE 75 1.887 2.978 -1.367 529 HG23 ILE 75 HG23 ILE 75 1.814 3.896 0.138 530 HD11 ILE 75 HD11 ILE 75 -2.109 1.534 -2.219 531 HD12 ILE 75 HD12 ILE 75 -1.060 2.937 -2.418 532 HD13 ILE 75 HD13 ILE 75 -1.999 2.741 -0.938 533 H ASP 76 H ASP 76 3.495 2.421 0.242 534 HA ASP 76 HA ASP 76 4.290 0.436 -1.716 535 HB2 ASP 76 HB2 ASP 76 4.734 2.839 -2.078 536 HB3 ASP 76 HB3 ASP 76 5.772 2.853 -0.655 537 H VAL 77 H VAL 77 5.146 -1.427 -1.072 538 HA VAL 77 HA VAL 77 6.229 -1.918 1.500 539 HB VAL 77 HB VAL 77 6.564 -3.492 -1.082 540 HG11 VAL 77 HG11 VAL 77 8.253 -4.122 0.602 541 HG12 VAL 77 HG12 VAL 77 7.058 -5.404 0.412 542 HG13 VAL 77 HG13 VAL 77 6.984 -4.330 1.809 543 HG21 VAL 77 HG21 VAL 77 4.224 -3.302 -0.510 544 HG22 VAL 77 HG22 VAL 77 4.557 -3.647 1.188 545 HG23 VAL 77 HG23 VAL 77 4.755 -4.913 -0.025 546 H TYR 78 H TYR 78 8.217 -1.614 2.294 547 HA TYR 78 HA TYR 78 10.488 -1.215 0.473 548 HB2 TYR 78 HB2 TYR 78 9.454 1.021 1.094 549 HB3 TYR 78 HB3 TYR 78 9.930 0.688 2.757 550 HD1 TYR 78 HD1 TYR 78 11.365 0.709 -0.713 551 HD2 TYR 78 HD2 TYR 78 12.068 1.376 3.473 552 HE1 TYR 78 HE1 TYR 78 13.652 1.518 -1.223 553 HE2 TYR 78 HE2 TYR 78 14.355 2.177 2.961 554 HH TYR 78 HH TYR 78 16.049 1.761 0.985 555 H SER 79 H SER 79 12.563 -1.353 1.575 556 HA SER 79 HA SER 79 12.433 -2.951 4.067 557 HB2 SER 79 HB2 SER 79 14.411 -4.197 3.203 558 HB3 SER 79 HB3 SER 79 12.979 -4.412 2.204 559 HG SER 79 HG SER 79 15.379 -3.193 1.645 560 HA PRO 80 HA PRO 80 15.218 0.768 4.694 561 HB2 PRO 80 HB2 PRO 80 14.171 1.636 7.044 562 HB3 PRO 80 HB3 PRO 80 13.471 2.080 5.473 563 HG2 PRO 80 HG2 PRO 80 12.594 -0.013 7.409 564 HG3 PRO 80 HG3 PRO 80 11.622 1.150 6.488 565 HD2 PRO 80 HD2 PRO 80 11.923 -1.457 5.722 566 HD3 PRO 80 HD3 PRO 80 11.658 -0.137 4.565 567 HA PRO 81 HA PRO 81 17.890 -1.604 7.406 568 HB2 PRO 81 HB2 PRO 81 19.480 0.363 8.489 569 HB3 PRO 81 HB3 PRO 81 19.686 -0.284 6.850 570 HG2 PRO 81 HG2 PRO 81 18.342 2.223 7.737 571 HG3 PRO 81 HG3 PRO 81 19.405 1.942 6.346 572 HD2 PRO 81 HD2 PRO 81 16.711 2.092 6.076 573 HD3 PRO 81 HD3 PRO 81 17.701 1.023 5.054 574 H GLU 82 H GLU 82 16.273 1.244 8.697 575 HA GLU 82 HA GLU 82 15.486 -0.169 11.083 576 HB2 GLU 82 HB2 GLU 82 16.475 1.488 12.664 577 HB3 GLU 82 HB3 GLU 82 17.691 0.523 11.829 578 HG2 GLU 82 HG2 GLU 82 18.121 2.339 10.261 579 HG3 GLU 82 HG3 GLU 82 16.826 3.299 10.962 580 HA PRO 83 HA PRO 83 12.118 2.701 10.534 581 HB2 PRO 83 HB2 PRO 83 10.867 2.601 12.938 582 HB3 PRO 83 HB3 PRO 83 10.841 1.247 11.789 583 HG2 PRO 83 HG2 PRO 83 12.517 1.630 14.224 584 HG3 PRO 83 HG3 PRO 83 11.703 0.171 13.632 585 HD2 PRO 83 HD2 PRO 83 14.378 0.646 13.267 586 HD3 PRO 83 HD3 PRO 83 13.404 -0.345 12.160 587 H GLU 84 H GLU 84 14.061 3.154 13.469 588 HA GLU 84 HA GLU 84 14.604 5.017 14.707 589 HB2 GLU 84 HB2 GLU 84 14.613 6.082 11.882 590 HB3 GLU 84 HB3 GLU 84 15.127 7.056 13.261 591 HG2 GLU 84 HG2 GLU 84 16.873 5.492 13.813 592 HG3 GLU 84 HG3 GLU 84 16.275 4.326 12.645 593 H SER 85 H SER 85 11.733 4.457 14.391 594 HA SER 85 HA SER 85 10.659 7.202 14.731 595 HB2 SER 85 HB2 SER 85 9.253 4.700 13.773 596 HB3 SER 85 HB3 SER 85 8.456 6.234 14.102 597 HG SER 85 HG SER 85 10.528 5.737 12.220 598 H GLU 86 H GLU 86 10.337 7.665 16.792 599 HA GLU 86 HA GLU 86 9.043 5.676 18.531 600 HB2 GLU 86 HB2 GLU 86 11.497 7.298 19.258 601 HB3 GLU 86 HB3 GLU 86 10.540 6.360 20.404 602 HG2 GLU 86 HG2 GLU 86 11.006 4.306 19.129 603 HG3 GLU 86 HG3 GLU 86 11.942 5.237 17.959 604 HA PRO 87 HA PRO 87 6.430 9.168 19.508 605 HB2 PRO 87 HB2 PRO 87 6.315 8.241 22.331 606 HB3 PRO 87 HB3 PRO 87 4.999 8.475 21.166 607 HG2 PRO 87 HG2 PRO 87 5.794 6.044 21.878 608 HG3 PRO 87 HG3 PRO 87 5.288 6.402 20.217 609 HD2 PRO 87 HD2 PRO 87 8.070 6.078 21.309 610 HD3 PRO 87 HD3 PRO 87 7.392 5.520 19.760 611 H ALA 88 H ALA 88 7.444 11.110 19.565 612 HA ALA 88 HA ALA 88 8.222 12.404 21.911 613 HB1 ALA 88 HB1 ALA 88 10.180 11.149 22.199 614 HB2 ALA 88 HB2 ALA 88 10.755 12.556 21.307 615 HB3 ALA 88 HB3 ALA 88 10.476 11.031 20.465 616 H TYR 89 H TYR 89 8.915 12.028 18.468 617 HA TYR 89 HA TYR 89 8.594 14.949 18.122 618 HB2 TYR 89 HB2 TYR 89 10.525 13.129 16.661 619 HB3 TYR 89 HB3 TYR 89 10.229 14.820 16.261 620 HD1 TYR 89 HD1 TYR 89 11.769 12.500 18.655 621 HD2 TYR 89 HD2 TYR 89 10.940 16.623 17.781 622 HE1 TYR 89 HE1 TYR 89 13.420 13.196 20.370 623 HE2 TYR 89 HE2 TYR 89 12.591 17.319 19.496 624 HH TYR 89 HH TYR 89 13.763 15.316 21.838 625 H THR 90 H THR 90 7.648 15.613 16.141 626 HA THR 90 HA THR 90 6.236 13.486 14.646 627 HB THR 90 HB THR 90 5.127 16.186 15.487 628 HG1 THR 90 HG1 THR 90 4.680 13.529 16.351 629 HG21 THR 90 HG21 THR 90 3.640 13.887 14.202 630 HG22 THR 90 HG22 THR 90 4.349 15.194 13.252 631 HG23 THR 90 HG23 THR 90 3.088 15.546 14.432 632 HA PRO 91 HA PRO 91 8.217 15.615 11.214 633 HB2 PRO 91 HB2 PRO 91 6.761 14.669 9.107 634 HB3 PRO 91 HB3 PRO 91 7.962 13.691 9.965 635 HG2 PRO 91 HG2 PRO 91 4.995 13.728 10.258 636 HG3 PRO 91 HG3 PRO 91 6.106 12.348 10.194 637 HD2 PRO 91 HD2 PRO 91 5.106 13.290 12.538 638 HD3 PRO 91 HD3 PRO 91 6.724 12.564 12.419 639 HA PRO 92 HA PRO 92 5.653 19.334 10.866 640 HB2 PRO 92 HB2 PRO 92 7.247 19.893 8.403 641 HB3 PRO 92 HB3 PRO 92 6.941 20.924 9.812 642 HG2 PRO 92 HG2 PRO 92 9.292 19.789 9.510 643 HG3 PRO 92 HG3 PRO 92 8.529 19.853 11.112 644 HD2 PRO 92 HD2 PRO 92 8.707 17.527 9.208 645 HD3 PRO 92 HD3 PRO 92 8.921 17.556 10.974 646 HA PRO 93 HA PRO 93 4.051 18.616 6.231 647 HB2 PRO 93 HB2 PRO 93 4.776 15.724 6.006 648 HB3 PRO 93 HB3 PRO 93 4.739 16.979 4.753 649 HG2 PRO 93 HG2 PRO 93 7.039 16.137 5.707 650 HG3 PRO 93 HG3 PRO 93 6.778 17.864 5.395 651 HD2 PRO 93 HD2 PRO 93 6.757 16.406 8.020 652 HD3 PRO 93 HD3 PRO 93 7.431 17.998 7.626 653 H ALA 94 H ALA 94 1.904 18.127 6.049 654 HA ALA 94 HA ALA 94 0.495 17.064 8.245 655 HB1 ALA 94 HB1 ALA 94 -0.592 18.649 6.784 656 HB2 ALA 94 HB2 ALA 94 -1.480 17.128 6.691 657 HB3 ALA 94 HB3 ALA 94 -0.373 17.585 5.394 658 H ALA 95 H ALA 95 1.480 15.658 5.162 659 HA ALA 95 HA ALA 95 1.459 13.497 4.388 660 HB1 ALA 95 HB1 ALA 95 1.662 11.884 6.594 661 HB2 ALA 95 HB2 ALA 95 2.175 13.446 7.250 662 HB3 ALA 95 HB3 ALA 95 3.018 12.747 5.861 663 HA PRO 96 HA PRO 96 -3.008 12.767 5.747 664 HB2 PRO 96 HB2 PRO 96 -4.412 13.885 3.740 665 HB3 PRO 96 HB3 PRO 96 -3.778 14.864 5.079 666 HG2 PRO 96 HG2 PRO 96 -2.716 14.524 2.314 667 HG3 PRO 96 HG3 PRO 96 -2.835 15.988 3.306 668 HD2 PRO 96 HD2 PRO 96 -0.518 14.494 3.006 669 HD3 PRO 96 HD3 PRO 96 -0.846 15.576 4.378 670 H VAL 97 H VAL 97 -1.395 10.852 4.774 671 HA VAL 97 HA VAL 97 -2.747 9.717 2.397 672 HB VAL 97 HB VAL 97 -0.045 8.994 3.585 673 HG11 VAL 97 HG11 VAL 97 0.201 7.791 1.365 674 HG12 VAL 97 HG12 VAL 97 -1.525 8.056 1.110 675 HG13 VAL 97 HG13 VAL 97 -0.973 7.069 2.466 676 HG21 VAL 97 HG21 VAL 97 0.818 10.034 1.463 677 HG22 VAL 97 HG22 VAL 97 0.060 11.193 2.555 678 HG23 VAL 97 HG23 VAL 97 -0.814 10.613 1.136 679 H PHE 98 H PHE 98 -1.473 8.911 5.612 680 HA PHE 98 HA PHE 98 -2.967 6.394 5.655 681 HB2 PHE 98 HB2 PHE 98 -0.587 6.589 6.487 682 HB3 PHE 98 HB3 PHE 98 -1.202 7.584 7.808 683 HD1 PHE 98 HD1 PHE 98 -1.278 4.220 6.268 684 HD2 PHE 98 HD2 PHE 98 -2.434 6.613 9.644 685 HE1 PHE 98 HE1 PHE 98 -1.876 2.163 7.519 686 HE2 PHE 98 HE2 PHE 98 -3.033 4.557 10.894 687 HZ PHE 98 HZ PHE 98 -2.751 2.333 9.832 688 H ASP 99 H ASP 99 -4.944 6.239 6.516 689 HA ASP 99 HA ASP 99 -6.001 8.492 8.078 690 HB2 ASP 99 HB2 ASP 99 -7.091 7.281 5.968 691 HB3 ASP 99 HB3 ASP 99 -7.695 6.188 7.210 692 H ARG 100 H ARG 100 -7.975 7.297 9.511 693 HA ARG 100 HA ARG 100 -6.664 6.359 11.842 694 HB2 ARG 100 HB2 ARG 100 -9.554 6.123 10.967 695 HB3 ARG 100 HB3 ARG 100 -8.980 5.632 12.560 696 HG2 ARG 100 HG2 ARG 100 -8.247 7.876 13.067 697 HG3 ARG 100 HG3 ARG 100 -8.564 8.404 11.414 698 HD2 ARG 100 HD2 ARG 100 -10.696 7.339 13.283 699 HD3 ARG 100 HD3 ARG 100 -10.362 9.053 13.049 700 HE ARG 100 HE ARG 100 -10.763 7.924 10.516 701 HH11 ARG 100 HH11 ARG 100 -12.619 8.507 13.433 702 HH12 ARG 100 HH12 ARG 100 -14.124 8.644 12.585 703 HH21 ARG 100 HH21 ARG 100 -12.739 8.105 9.457 704 HH22 ARG 100 HH22 ARG 100 -14.188 8.418 10.352 705 H ASP 101 H ASP 101 -8.491 4.654 9.330 706 HA ASP 101 HA ASP 101 -8.357 2.044 10.191 707 HB2 ASP 101 HB2 ASP 101 -8.044 3.086 7.364 708 HB3 ASP 101 HB3 ASP 101 -8.450 1.422 7.792 709 H GLU 102 H GLU 102 -6.862 0.402 10.172 710 HA GLU 102 HA GLU 102 -4.120 1.074 9.291 711 HB2 GLU 102 HB2 GLU 102 -4.970 -0.661 11.631 712 HB3 GLU 102 HB3 GLU 102 -3.310 -0.375 11.119 713 HG2 GLU 102 HG2 GLU 102 -3.603 2.048 11.544 714 HG3 GLU 102 HG3 GLU 102 -5.254 1.746 12.080 715 H VAL 103 H VAL 103 -6.096 -0.071 7.614 716 HA VAL 103 HA VAL 103 -4.748 -2.227 6.466 717 HB VAL 103 HB VAL 103 -5.490 -3.516 8.443 718 HG11 VAL 103 HG11 VAL 103 -7.613 -2.047 8.699 719 HG12 VAL 103 HG12 VAL 103 -7.732 -3.761 9.093 720 HG13 VAL 103 HG13 VAL 103 -8.348 -3.167 7.553 721 HG21 VAL 103 HG21 VAL 103 -6.215 -5.414 7.277 722 HG22 VAL 103 HG22 VAL 103 -5.444 -4.463 6.007 723 HG23 VAL 103 HG23 VAL 103 -7.202 -4.478 6.153 724 H ALA 104 H ALA 104 -5.573 -0.051 5.304 725 HA ALA 104 HA ALA 104 -7.391 -0.904 3.284 726 HB1 ALA 104 HB1 ALA 104 -8.506 1.415 4.818 727 HB2 ALA 104 HB2 ALA 104 -8.860 -0.229 5.351 728 HB3 ALA 104 HB3 ALA 104 -9.325 0.293 3.731 729 H GLU 105 H GLU 105 -7.804 0.750 1.665 730 HA GLU 105 HA GLU 105 -5.970 3.059 1.744 731 HB2 GLU 105 HB2 GLU 105 -4.886 1.213 0.439 732 HB3 GLU 105 HB3 GLU 105 -6.279 1.201 -0.641 733 HG2 GLU 105 HG2 GLU 105 -4.516 2.568 -1.658 734 HG3 GLU 105 HG3 GLU 105 -5.844 3.613 -1.162 735 H GLN 106 H GLN 106 -6.875 4.907 0.945 736 HA GLN 106 HA GLN 106 -9.677 4.807 0.166 737 HB2 GLN 106 HB2 GLN 106 -7.803 7.168 0.516 738 HB3 GLN 106 HB3 GLN 106 -9.539 7.273 0.237 739 HG2 GLN 106 HG2 GLN 106 -8.237 5.911 2.616 740 HG3 GLN 106 HG3 GLN 106 -8.972 7.511 2.644 741 HE21 GLN 106 HE21 GLN 106 -9.632 4.374 3.474 742 HE22 GLN 106 HE22 GLN 106 -11.321 4.382 3.302 743 H LEU 107 H LEU 107 -10.116 4.320 -1.874 744 HA LEU 107 HA LEU 107 -8.927 5.873 -4.021 745 HB2 LEU 107 HB2 LEU 107 -8.208 3.892 -5.299 746 HB3 LEU 107 HB3 LEU 107 -7.306 4.064 -3.802 747 HG LEU 107 HG LEU 107 -9.756 2.423 -3.470 748 HD11 LEU 107 HD11 LEU 107 -7.583 1.409 -5.325 749 HD12 LEU 107 HD12 LEU 107 -9.256 1.744 -5.769 750 HD13 LEU 107 HD13 LEU 107 -8.889 0.436 -4.647 751 HD21 LEU 107 HD21 LEU 107 -8.370 1.116 -2.098 752 HD22 LEU 107 HD22 LEU 107 -7.641 2.715 -1.953 753 HD23 LEU 107 HD23 LEU 107 -6.914 1.511 -3.012 754 H VAL 108 H VAL 108 -11.619 5.338 -2.776 755 HA VAL 108 HA VAL 108 -13.031 4.628 -5.268 756 HB VAL 108 HB VAL 108 -14.769 3.469 -3.934 757 HG11 VAL 108 HG11 VAL 108 -13.470 1.437 -3.506 758 HG12 VAL 108 HG12 VAL 108 -11.976 2.373 -3.500 759 HG13 VAL 108 HG13 VAL 108 -12.908 2.211 -4.987 760 HG21 VAL 108 HG21 VAL 108 -12.801 3.624 -1.631 761 HG22 VAL 108 HG22 VAL 108 -14.428 2.943 -1.606 762 HG23 VAL 108 HG23 VAL 108 -14.204 4.685 -1.773 763 H GLY 109 H GLY 109 -15.221 5.468 -5.393 764 HA2 GLY 109 HA2 GLY 109 -16.107 7.503 -3.554 765 HA3 GLY 109 HA3 GLY 109 -15.499 8.161 -5.069 766 H VAL 110 H VAL 110 -18.128 8.577 -4.383 767 HA VAL 110 HA VAL 110 -19.951 6.640 -5.330 768 HB VAL 110 HB VAL 110 -21.582 8.506 -5.416 769 HG11 VAL 110 HG11 VAL 110 -21.059 7.364 -3.285 770 HG12 VAL 110 HG12 VAL 110 -21.460 9.061 -3.025 771 HG13 VAL 110 HG13 VAL 110 -19.777 8.534 -2.978 772 HG21 VAL 110 HG21 VAL 110 -20.840 10.768 -4.732 773 HG22 VAL 110 HG22 VAL 110 -20.066 10.276 -6.239 774 HG23 VAL 110 HG23 VAL 110 -19.165 10.215 -4.724 775 H SER 111 H SER 111 -17.987 8.978 -7.019 776 HA SER 111 HA SER 111 -19.045 7.974 -9.572 777 HB2 SER 111 HB2 SER 111 -20.228 10.080 -9.179 778 HB3 SER 111 HB3 SER 111 -18.700 10.905 -8.891 779 HG SER 111 HG SER 111 -18.484 11.080 -10.966 780 H ALA 112 H ALA 112 -17.513 7.650 -11.089 781 HA ALA 112 HA ALA 112 -14.913 8.949 -10.920 782 HB1 ALA 112 HB1 ALA 112 -14.264 7.191 -9.547 783 HB2 ALA 112 HB2 ALA 112 -13.882 6.542 -11.141 784 HB3 ALA 112 HB3 ALA 112 -15.362 6.047 -10.320 785 H ALA 113 H ALA 113 -13.617 8.596 -12.831 786 HA ALA 113 HA ALA 113 -14.835 7.206 -15.085 787 HB1 ALA 113 HB1 ALA 113 -14.295 10.187 -15.171 788 HB2 ALA 113 HB2 ALA 113 -15.890 9.434 -15.162 789 HB3 ALA 113 HB3 ALA 113 -14.807 9.189 -16.532 790 H SER 114 H SER 114 -13.377 6.843 -16.799 791 HA SER 114 HA SER 114 -10.669 6.490 -16.039 792 HB2 SER 114 HB2 SER 114 -11.712 5.105 -17.771 793 HB3 SER 114 HB3 SER 114 -11.907 6.515 -18.805 794 HG SER 114 HG SER 114 -9.981 6.015 -19.475 795 H ALA 115 H ALA 115 -12.013 8.653 -18.553 796 HA ALA 115 HA ALA 115 -10.340 10.853 -17.710 797 HB1 ALA 115 HB1 ALA 115 -8.617 9.991 -19.001 798 HB2 ALA 115 HB2 ALA 115 -9.468 10.969 -20.198 799 HB3 ALA 115 HB3 ALA 115 -9.718 9.223 -20.145 800 H ALA 116 H ALA 116 -10.975 12.823 -18.684 801 HA ALA 116 HA ALA 116 -13.059 12.817 -20.689 802 HB1 ALA 116 HB1 ALA 116 -13.743 14.096 -18.053 803 HB2 ALA 116 HB2 ALA 116 -14.159 12.417 -18.397 804 HB3 ALA 116 HB3 ALA 116 -14.812 13.712 -19.402 805 H ALA 117 H ALA 117 -10.296 14.070 -19.765 806 HA ALA 117 HA ALA 117 -10.689 16.566 -21.110 807 HB1 ALA 117 HB1 ALA 117 -10.043 18.031 -19.267 808 HB2 ALA 117 HB2 ALA 117 -9.964 16.650 -18.173 809 HB3 ALA 117 HB3 ALA 117 -11.513 17.151 -18.850 810 H SER 118 H SER 118 -8.633 17.815 -21.237 811 HA SER 118 HA SER 118 -6.272 16.037 -21.015 812 HB2 SER 118 HB2 SER 118 -5.369 17.195 -22.993 813 HB3 SER 118 HB3 SER 118 -6.907 16.421 -23.364 814 HG SER 118 HG SER 118 -7.268 18.401 -24.091 815 H ALA 119 H ALA 119 -7.308 19.432 -21.233 816 HA ALA 119 HA ALA 119 -5.405 20.102 -19.097 817 HB1 ALA 119 HB1 ALA 119 -5.650 21.472 -21.774 818 HB2 ALA 119 HB2 ALA 119 -4.204 20.785 -21.035 819 HB3 ALA 119 HB3 ALA 119 -4.921 22.254 -20.374 820 H PHE 120 H PHE 120 -7.811 21.703 -21.209 821 HA PHE 120 HA PHE 120 -9.601 23.052 -20.749 822 HB2 PHE 120 HB2 PHE 120 -10.307 20.939 -19.551 823 HB3 PHE 120 HB3 PHE 120 -9.696 21.666 -18.063 824 HD1 PHE 120 HD1 PHE 120 -12.127 22.125 -20.849 825 HD2 PHE 120 HD2 PHE 120 -10.954 23.324 -16.893 826 HE1 PHE 120 HE1 PHE 120 -14.245 23.389 -20.602 827 HE2 PHE 120 HE2 PHE 120 -13.072 24.589 -16.648 828 HZ PHE 120 HZ PHE 120 -14.719 24.622 -18.504 829 H GLY 121 H GLY 121 -10.360 24.849 -19.435 830 HA2 GLY 121 HA2 GLY 121 -10.098 26.645 -17.967 831 HA3 GLY 121 HA3 GLY 121 -8.649 25.880 -17.328 832 H SER 122 H SER 122 -9.492 26.759 -20.660 833 HA SER 122 HA SER 122 -7.729 29.020 -20.742 834 HB2 SER 122 HB2 SER 122 -6.853 26.451 -22.078 835 HB3 SER 122 HB3 SER 122 -6.178 28.033 -22.457 836 HG SER 122 HG SER 122 -5.225 28.099 -20.540 837 H LEU 123 H LEU 123 -8.597 26.570 -23.206 838 HA LEU 123 HA LEU 123 -10.831 27.906 -24.279 839 HB2 LEU 123 HB2 LEU 123 -9.024 29.599 -24.870 840 HB3 LEU 123 HB3 LEU 123 -8.335 28.373 -25.927 841 HG LEU 123 HG LEU 123 -10.599 28.219 -27.062 842 HD11 LEU 123 HD11 LEU 123 -11.087 30.636 -25.300 843 HD12 LEU 123 HD12 LEU 123 -12.062 29.171 -25.416 844 HD13 LEU 123 HD13 LEU 123 -12.026 30.312 -26.759 845 HD21 LEU 123 HD21 LEU 123 -10.230 30.220 -28.411 846 HD22 LEU 123 HD22 LEU 123 -8.672 29.520 -27.971 847 HD23 LEU 123 HD23 LEU 123 -9.270 30.945 -27.122 848 H SER 124 H SER 124 -7.925 26.358 -25.667 849 HA SER 124 HA SER 124 -9.080 23.808 -26.035 850 HB2 SER 124 HB2 SER 124 -9.335 23.835 -28.496 851 HB3 SER 124 HB3 SER 124 -10.474 24.926 -27.715 852 HG SER 124 HG SER 124 -9.262 25.782 -29.567 853 H SER 125 H SER 125 -7.009 26.030 -27.894 854 HA SER 125 HA SER 125 -4.709 24.242 -27.409 855 HB2 SER 125 HB2 SER 125 -5.551 25.562 -29.995 856 HB3 SER 125 HB3 SER 125 -3.946 24.885 -29.737 857 HG SER 125 HG SER 125 -4.883 22.880 -29.419 858 H ALA 126 H ALA 126 -5.422 26.443 -25.858 859 HA ALA 126 HA ALA 126 -4.053 28.848 -26.629 860 HB1 ALA 126 HB1 ALA 126 -4.869 29.727 -24.684 861 HB2 ALA 126 HB2 ALA 126 -4.503 28.275 -23.749 862 HB3 ALA 126 HB3 ALA 126 -5.937 28.325 -24.775 863 H LEU 127 H LEU 127 -3.302 26.072 -24.602 864 HA LEU 127 HA LEU 127 -0.864 27.001 -23.538 865 HB2 LEU 127 HB2 LEU 127 -1.897 24.197 -23.992 866 HB3 LEU 127 HB3 LEU 127 -0.407 24.556 -23.125 867 HG LEU 127 HG LEU 127 -3.082 25.758 -22.358 868 HD11 LEU 127 HD11 LEU 127 -1.689 23.368 -21.111 869 HD12 LEU 127 HD12 LEU 127 -3.065 23.245 -22.210 870 HD13 LEU 127 HD13 LEU 127 -3.252 24.046 -20.649 871 HD21 LEU 127 HD21 LEU 127 -1.829 26.007 -20.148 872 HD22 LEU 127 HD22 LEU 127 -1.229 27.015 -21.465 873 HD23 LEU 127 HD23 LEU 127 -0.367 25.542 -21.018 874 H LEU 128 H LEU 128 1.156 27.000 -24.211 875 HA LEU 128 HA LEU 128 1.784 25.878 -26.881 876 HB2 LEU 128 HB2 LEU 128 2.916 28.347 -25.534 877 HB3 LEU 128 HB3 LEU 128 3.464 27.696 -27.076 878 HG LEU 128 HG LEU 128 0.595 28.530 -26.557 879 HD11 LEU 128 HD11 LEU 128 1.932 30.521 -26.347 880 HD12 LEU 128 HD12 LEU 128 1.243 30.534 -27.972 881 HD13 LEU 128 HD13 LEU 128 2.925 30.066 -27.730 882 HD21 LEU 128 HD21 LEU 128 2.193 27.889 -29.059 883 HD22 LEU 128 HD22 LEU 128 0.577 28.597 -29.081 884 HD23 LEU 128 HD23 LEU 128 0.822 26.982 -28.419 885 H MET 129 H MET 129 3.957 25.086 -27.173 886 HA MET 129 HA MET 129 5.319 24.353 -24.648 887 HB2 MET 129 HB2 MET 129 4.061 22.441 -25.694 888 HB3 MET 129 HB3 MET 129 5.103 22.596 -27.109 889 HG2 MET 129 HG2 MET 129 7.086 22.201 -25.707 890 HG3 MET 129 HG3 MET 129 6.062 22.076 -24.277 891 HE1 MET 129 HE1 MET 129 7.529 18.550 -25.151 892 HE2 MET 129 HE2 MET 129 6.952 19.396 -23.717 893 HE3 MET 129 HE3 MET 129 8.066 20.203 -24.818 894 HA PRO 130 HA PRO 130 8.309 26.546 -27.500 895 HB2 PRO 130 HB2 PRO 130 9.508 28.083 -25.602 896 HB3 PRO 130 HB3 PRO 130 8.008 28.562 -26.419 897 HG2 PRO 130 HG2 PRO 130 8.385 27.326 -23.728 898 HG3 PRO 130 HG3 PRO 130 7.320 28.655 -24.218 899 HD2 PRO 130 HD2 PRO 130 6.407 26.112 -23.885 900 HD3 PRO 130 HD3 PRO 130 5.704 27.230 -25.078 901 H LYS 131 H LYS 131 8.604 24.661 -24.616 902 HA LYS 131 HA LYS 131 10.209 23.224 -23.828 903 HB2 LYS 131 HB2 LYS 131 10.231 22.467 -26.229 904 HB3 LYS 131 HB3 LYS 131 11.558 23.591 -26.515 905 HG2 LYS 131 HG2 LYS 131 12.921 22.444 -24.822 906 HG3 LYS 131 HG3 LYS 131 11.589 21.339 -24.481 907 HD2 LYS 131 HD2 LYS 131 11.667 20.508 -26.794 908 HD3 LYS 131 HD3 LYS 131 12.978 21.628 -27.162 909 HE2 LYS 131 HE2 LYS 131 13.910 19.419 -26.689 910 HE3 LYS 131 HE3 LYS 131 14.363 20.536 -25.401 911 HZ1 LYS 131 HZ1 LYS 131 13.561 18.387 -24.563 912 HZ2 LYS 131 HZ2 LYS 131 12.051 18.676 -25.289 913 HZ3 LYS 131 HZ3 LYS 131 12.601 19.682 -24.036 914 H ASP 132 H ASP 132 11.365 24.053 -22.226 915 HA ASP 132 HA ASP 132 13.762 25.625 -22.843 916 HB2 ASP 132 HB2 ASP 132 11.931 27.255 -22.390 917 HB3 ASP 132 HB3 ASP 132 11.704 26.520 -20.808 918 H GLY 133 H GLY 133 15.303 24.353 -21.995 919 HA2 GLY 133 HA2 GLY 133 15.025 23.497 -19.191 920 HA3 GLY 133 HA3 GLY 133 15.549 22.346 -20.419 921 H LEU 134 H LEU 134 16.887 23.630 -18.013 922 HA LEU 134 HA LEU 134 19.413 24.242 -19.367 923 HB2 LEU 134 HB2 LEU 134 17.984 26.044 -17.424 924 HB3 LEU 134 HB3 LEU 134 19.727 26.151 -17.679 925 HG LEU 134 HG LEU 134 17.717 26.298 -19.945 926 HD11 LEU 134 HD11 LEU 134 17.237 28.171 -18.505 927 HD12 LEU 134 HD12 LEU 134 18.203 28.781 -19.849 928 HD13 LEU 134 HD13 LEU 134 18.954 28.505 -18.276 929 HD21 LEU 134 HD21 LEU 134 20.666 26.943 -19.644 930 HD22 LEU 134 HD22 LEU 134 19.707 27.484 -21.023 931 HD23 LEU 134 HD23 LEU 134 19.929 25.759 -20.725 932 H GLU 135 H GLU 135 21.237 23.711 -18.196 933 HA GLU 135 HA GLU 135 22.484 22.443 -16.738 934 HB2 GLU 135 HB2 GLU 135 21.766 24.426 -15.306 935 HB3 GLU 135 HB3 GLU 135 20.528 23.367 -14.631 936 HG2 GLU 135 HG2 GLU 135 22.478 23.293 -13.184 937 HG3 GLU 135 HG3 GLU 135 22.322 21.742 -13.999 938 H HIS 136 H HIS 136 22.065 20.379 -17.470 939 HA HIS 136 HA HIS 136 19.721 18.884 -16.954 940 HB2 HIS 136 HB2 HIS 136 22.545 18.067 -17.655 941 HB3 HIS 136 HB3 HIS 136 21.233 16.903 -17.481 942 HD2 HIS 136 HD2 HIS 136 19.497 16.772 -19.672 943 HE1 HIS 136 HE1 HIS 136 21.125 20.011 -21.833 944 HE2 HIS 136 HE2 HIS 136 19.460 18.096 -21.922 945 H HIS 137 H HIS 137 22.799 19.157 -15.219 946 HA HIS 137 HA HIS 137 21.533 17.879 -12.881 947 HB2 HIS 137 HB2 HIS 137 24.313 17.266 -13.918 948 HB3 HIS 137 HB3 HIS 137 23.646 16.685 -12.395 949 HD2 HIS 137 HD2 HIS 137 23.773 15.586 -16.047 950 HE1 HIS 137 HE1 HIS 137 20.582 13.433 -14.310 951 HE2 HIS 137 HE2 HIS 137 22.081 13.619 -16.350 952 H HIS 138 H HIS 138 22.281 18.592 -10.874 953 HA HIS 138 HA HIS 138 24.383 20.575 -10.703 954 HB2 HIS 138 HB2 HIS 138 22.954 22.348 -9.764 955 HB3 HIS 138 HB3 HIS 138 22.501 21.974 -11.423 956 HD2 HIS 138 HD2 HIS 138 20.886 22.050 -7.920 957 HE1 HIS 138 HE1 HIS 138 18.139 20.106 -10.472 958 HE2 HIS 138 HE2 HIS 138 18.452 21.137 -8.172 959 H HIS 139 H HIS 139 24.760 21.275 -8.448 960 HA HIS 139 HA HIS 139 23.548 19.698 -6.330 961 HB2 HIS 139 HB2 HIS 139 25.339 18.228 -7.359 962 HB3 HIS 139 HB3 HIS 139 26.520 19.425 -6.828 963 HD2 HIS 139 HD2 HIS 139 24.422 16.518 -5.338 964 HE1 HIS 139 HE1 HIS 139 26.387 18.410 -2.117 965 HE2 HIS 139 HE2 HIS 139 25.011 16.387 -2.799 966 H HIS 140 H HIS 140 23.815 20.610 -4.326 967 HA HIS 140 HA HIS 140 25.554 22.990 -4.111 968 HB2 HIS 140 HB2 HIS 140 22.682 22.794 -3.166 969 HB3 HIS 140 HB3 HIS 140 23.771 24.140 -2.836 970 HD2 HIS 140 HD2 HIS 140 21.286 23.088 -5.538 971 HE1 HIS 140 HE1 HIS 140 23.749 26.017 -7.318 972 HE2 HIS 140 HE2 HIS 140 21.611 24.672 -7.585 973 H HIS 141 H HIS 141 26.455 23.355 -2.102 974 HA HIS 141 HA HIS 141 26.751 21.067 -0.399 975 HB2 HIS 141 HB2 HIS 141 27.710 23.925 -0.188 976 HB3 HIS 141 HB3 HIS 141 28.099 22.688 1.006 977 HD2 HIS 141 HD2 HIS 141 30.122 20.910 0.231 978 HE1 HIS 141 HE1 HIS 141 30.591 22.343 -3.714 979 HE2 HIS 141 HE2 HIS 141 31.539 20.771 -1.960 Start of MODEL 20 1 H1 MET 1 HT1 MET 1 -2.260 12.960 -10.526 2 H2 MET 1 HT2 MET 1 -2.815 12.376 -12.021 3 H3 MET 1 HT3 MET 1 -1.301 13.135 -11.913 4 HA MET 1 HA MET 1 -0.414 11.365 -10.606 5 HB2 MET 1 HB2 MET 1 -1.807 9.368 -10.111 6 HB3 MET 1 HB3 MET 1 -2.429 10.819 -9.329 7 HG2 MET 1 HG2 MET 1 -4.041 11.081 -11.242 8 HG3 MET 1 HG3 MET 1 -3.484 9.529 -11.863 9 HE1 MET 1 HE1 MET 1 -5.189 11.559 -9.304 10 HE2 MET 1 HE2 MET 1 -4.206 10.778 -8.071 11 HE3 MET 1 HE3 MET 1 -5.936 10.459 -8.138 12 H SER 2 H SER 2 -2.762 11.082 -13.247 13 HA SER 2 HA SER 2 -0.744 9.571 -14.796 14 HB2 SER 2 HB2 SER 2 -2.527 8.045 -14.083 15 HB3 SER 2 HB3 SER 2 -3.737 9.117 -14.782 16 HG SER 2 HG SER 2 -1.900 7.416 -16.007 17 H ASP 3 H ASP 3 -3.496 11.792 -14.839 18 HA ASP 3 HA ASP 3 -3.587 12.288 -17.605 19 HB2 ASP 3 HB2 ASP 3 -4.748 14.385 -16.993 20 HB3 ASP 3 HB3 ASP 3 -5.384 12.995 -16.118 21 H GLN 4 H GLN 4 -1.801 13.977 -15.010 22 HA GLN 4 HA GLN 4 -0.237 15.368 -17.102 23 HB2 GLN 4 HB2 GLN 4 -1.620 16.713 -15.381 24 HB3 GLN 4 HB3 GLN 4 -0.399 16.214 -14.212 25 HG2 GLN 4 HG2 GLN 4 0.400 17.484 -16.832 26 HG3 GLN 4 HG3 GLN 4 -0.052 18.472 -15.447 27 HE21 GLN 4 HE21 GLN 4 2.656 18.136 -16.741 28 HE22 GLN 4 HE22 GLN 4 3.683 17.623 -15.489 29 H SER 5 H SER 5 0.095 14.085 -13.781 30 HA SER 5 HA SER 5 2.931 13.971 -13.821 31 HB2 SER 5 HB2 SER 5 1.708 13.984 -11.718 32 HB3 SER 5 HB3 SER 5 0.919 12.466 -12.133 33 HG SER 5 HG SER 5 3.658 12.960 -11.602 34 H GLN 6 H GLN 6 4.330 12.409 -14.434 35 HA GLN 6 HA GLN 6 3.205 10.087 -15.853 36 HB2 GLN 6 HB2 GLN 6 5.374 9.942 -16.996 37 HB3 GLN 6 HB3 GLN 6 4.636 11.528 -17.205 38 HG2 GLN 6 HG2 GLN 6 6.054 12.377 -15.317 39 HG3 GLN 6 HG3 GLN 6 6.855 10.807 -15.270 40 HE21 GLN 6 HE21 GLN 6 7.296 13.858 -16.465 41 HE22 GLN 6 HE22 GLN 6 8.229 13.494 -17.834 42 H GLU 7 H GLU 7 4.230 10.635 -12.808 43 HA GLU 7 HA GLU 7 5.360 7.915 -12.556 44 HB2 GLU 7 HB2 GLU 7 6.225 10.358 -10.980 45 HB3 GLU 7 HB3 GLU 7 6.808 8.716 -10.728 46 HG2 GLU 7 HG2 GLU 7 7.140 10.303 -13.289 47 HG3 GLU 7 HG3 GLU 7 8.395 10.055 -12.084 48 HA PRO 8 HA PRO 8 1.658 8.600 -9.750 49 HB2 PRO 8 HB2 PRO 8 0.218 6.400 -10.462 50 HB3 PRO 8 HB3 PRO 8 0.105 7.943 -11.331 51 HG2 PRO 8 HG2 PRO 8 1.616 5.477 -12.042 52 HG3 PRO 8 HG3 PRO 8 0.687 6.571 -13.080 53 HD2 PRO 8 HD2 PRO 8 3.422 6.649 -12.897 54 HD3 PRO 8 HD3 PRO 8 2.431 8.070 -13.292 55 H THR 9 H THR 9 2.089 7.987 -7.721 56 HA THR 9 HA THR 9 3.667 5.648 -7.118 57 HB THR 9 HB THR 9 3.395 6.341 -4.770 58 HG1 THR 9 HG1 THR 9 1.652 8.272 -5.893 59 HG21 THR 9 HG21 THR 9 4.290 8.716 -5.035 60 HG22 THR 9 HG22 THR 9 4.041 8.516 -6.769 61 HG23 THR 9 HG23 THR 9 5.165 7.462 -5.913 62 H MET 10 H MET 10 2.936 3.992 -5.572 63 HA MET 10 HA MET 10 0.830 2.509 -6.431 64 HB2 MET 10 HB2 MET 10 2.025 2.668 -3.665 65 HB3 MET 10 HB3 MET 10 0.862 1.431 -4.139 66 HG2 MET 10 HG2 MET 10 2.350 0.698 -5.950 67 HG3 MET 10 HG3 MET 10 3.506 1.961 -5.528 68 HE1 MET 10 HE1 MET 10 4.987 -1.562 -4.554 69 HE2 MET 10 HE2 MET 10 5.513 -0.004 -5.186 70 HE3 MET 10 HE3 MET 10 4.168 -0.850 -5.951 71 H GLU 11 H GLU 11 0.647 4.950 -3.825 72 HA GLU 11 HA GLU 11 -2.057 4.444 -3.092 73 HB2 GLU 11 HB2 GLU 11 -0.496 5.837 -1.742 74 HB3 GLU 11 HB3 GLU 11 -0.518 7.064 -3.006 75 HG2 GLU 11 HG2 GLU 11 -2.084 7.708 -1.251 76 HG3 GLU 11 HG3 GLU 11 -2.991 7.279 -2.698 77 H GLU 12 H GLU 12 -0.573 6.736 -5.291 78 HA GLU 12 HA GLU 12 -2.891 7.950 -6.312 79 HB2 GLU 12 HB2 GLU 12 -0.133 7.609 -7.488 80 HB3 GLU 12 HB3 GLU 12 -1.398 8.567 -8.258 81 HG2 GLU 12 HG2 GLU 12 -1.559 10.024 -6.329 82 HG3 GLU 12 HG3 GLU 12 -0.462 9.000 -5.410 83 H ILE 13 H ILE 13 -1.160 5.073 -7.400 84 HA ILE 13 HA ILE 13 -2.501 4.697 -9.850 85 HB ILE 13 HB ILE 13 -1.109 2.728 -8.006 86 HG12 ILE 13 HG12 ILE 13 -0.206 3.896 -10.653 87 HG13 ILE 13 HG13 ILE 13 0.157 4.669 -9.114 88 HG21 ILE 13 HG21 ILE 13 -2.172 2.372 -10.832 89 HG22 ILE 13 HG22 ILE 13 -2.605 1.424 -9.408 90 HG23 ILE 13 HG23 ILE 13 -0.986 1.293 -10.097 91 HD11 ILE 13 HD11 ILE 13 1.506 2.864 -8.391 92 HD12 ILE 13 HD12 ILE 13 1.930 3.054 -10.093 93 HD13 ILE 13 HD13 ILE 13 0.833 1.765 -9.595 94 H LEU 14 H LEU 14 -3.189 3.320 -6.606 95 HA LEU 14 HA LEU 14 -5.396 1.754 -7.338 96 HB2 LEU 14 HB2 LEU 14 -4.206 1.655 -5.143 97 HB3 LEU 14 HB3 LEU 14 -4.989 3.168 -4.690 98 HG LEU 14 HG LEU 14 -6.711 0.885 -5.656 99 HD11 LEU 14 HD11 LEU 14 -5.530 -0.349 -4.052 100 HD12 LEU 14 HD12 LEU 14 -6.887 0.275 -3.121 101 HD13 LEU 14 HD13 LEU 14 -5.303 1.041 -2.993 102 HD21 LEU 14 HD21 LEU 14 -7.013 3.292 -3.853 103 HD22 LEU 14 HD22 LEU 14 -8.155 1.953 -3.742 104 HD23 LEU 14 HD23 LEU 14 -7.978 2.831 -5.254 105 H ALA 15 H ALA 15 -5.196 5.153 -6.306 106 HA ALA 15 HA ALA 15 -8.015 5.653 -6.347 107 HB1 ALA 15 HB1 ALA 15 -6.589 7.151 -5.109 108 HB2 ALA 15 HB2 ALA 15 -7.300 8.063 -6.440 109 HB3 ALA 15 HB3 ALA 15 -5.631 7.504 -6.546 110 H SER 16 H SER 16 -5.419 6.058 -8.643 111 HA SER 16 HA SER 16 -6.566 7.483 -10.669 112 HB2 SER 16 HB2 SER 16 -4.233 6.747 -10.735 113 HB3 SER 16 HB3 SER 16 -4.751 5.091 -11.026 114 HG SER 16 HG SER 16 -5.368 5.617 -13.016 115 H ILE 17 H ILE 17 -6.822 3.873 -10.352 116 HA ILE 17 HA ILE 17 -8.784 3.882 -12.518 117 HB ILE 17 HB ILE 17 -7.660 1.586 -10.873 118 HG12 ILE 17 HG12 ILE 17 -7.043 2.353 -13.743 119 HG13 ILE 17 HG13 ILE 17 -6.060 2.896 -12.387 120 HG21 ILE 17 HG21 ILE 17 -8.589 0.199 -12.760 121 HG22 ILE 17 HG22 ILE 17 -9.385 1.646 -13.376 122 HG23 ILE 17 HG23 ILE 17 -9.841 0.993 -11.801 123 HD11 ILE 17 HD11 ILE 17 -6.467 0.086 -13.408 124 HD12 ILE 17 HD12 ILE 17 -5.930 0.373 -11.752 125 HD13 ILE 17 HD13 ILE 17 -4.954 0.941 -13.108 126 H ARG 18 H ARG 18 -8.673 2.644 -9.153 127 HA ARG 18 HA ARG 18 -11.551 2.436 -9.013 128 HB2 ARG 18 HB2 ARG 18 -9.419 2.141 -6.886 129 HB3 ARG 18 HB3 ARG 18 -11.131 1.799 -6.644 130 HG2 ARG 18 HG2 ARG 18 -11.043 0.106 -8.446 131 HG3 ARG 18 HG3 ARG 18 -9.325 0.436 -8.665 132 HD2 ARG 18 HD2 ARG 18 -9.557 -1.518 -7.244 133 HD3 ARG 18 HD3 ARG 18 -8.953 -0.182 -6.267 134 HE ARG 18 HE ARG 18 -11.807 -0.296 -6.186 135 HH11 ARG 18 HH11 ARG 18 -8.941 -1.842 -4.893 136 HH12 ARG 18 HH12 ARG 18 -9.745 -2.384 -3.455 137 HH21 ARG 18 HH21 ARG 18 -12.810 -1.027 -4.312 138 HH22 ARG 18 HH22 ARG 18 -11.916 -1.926 -3.132 139 H ARG 19 H ARG 19 -12.972 3.709 -7.859 140 HA ARG 19 HA ARG 19 -13.844 5.687 -7.081 141 HB2 ARG 19 HB2 ARG 19 -11.247 5.576 -5.524 142 HB3 ARG 19 HB3 ARG 19 -12.566 6.693 -5.173 143 HG2 ARG 19 HG2 ARG 19 -14.089 4.673 -4.979 144 HG3 ARG 19 HG3 ARG 19 -12.640 3.669 -5.057 145 HD2 ARG 19 HD2 ARG 19 -13.123 5.853 -3.010 146 HD3 ARG 19 HD3 ARG 19 -13.344 4.131 -2.712 147 HE ARG 19 HE ARG 19 -10.804 5.548 -2.967 148 HH11 ARG 19 HH11 ARG 19 -12.425 2.439 -2.878 149 HH12 ARG 19 HH12 ARG 19 -10.988 1.577 -2.441 150 HH21 ARG 19 HH21 ARG 19 -8.969 4.387 -2.387 151 HH22 ARG 19 HH22 ARG 19 -9.050 2.672 -2.165 152 H ILE 20 H ILE 20 -12.801 6.023 -9.562 153 HA ILE 20 HA ILE 20 -10.805 7.869 -10.035 154 HB ILE 20 HB ILE 20 -12.028 8.482 -12.102 155 HG12 ILE 20 HG12 ILE 20 -14.240 6.659 -11.100 156 HG13 ILE 20 HG13 ILE 20 -14.319 8.412 -10.949 157 HG21 ILE 20 HG21 ILE 20 -11.924 6.299 -13.090 158 HG22 ILE 20 HG22 ILE 20 -12.274 5.515 -11.548 159 HG23 ILE 20 HG23 ILE 20 -10.724 6.315 -11.797 160 HD11 ILE 20 HD11 ILE 20 -15.487 7.701 -12.984 161 HD12 ILE 20 HD12 ILE 20 -14.045 6.853 -13.539 162 HD13 ILE 20 HD13 ILE 20 -14.041 8.614 -13.416 163 H ILE 21 H ILE 21 -10.700 10.114 -10.265 164 HA ILE 21 HA ILE 21 -12.805 11.629 -8.827 165 HB ILE 21 HB ILE 21 -9.811 12.172 -8.884 166 HG12 ILE 21 HG12 ILE 21 -11.550 11.376 -6.527 167 HG13 ILE 21 HG13 ILE 21 -10.667 10.193 -7.492 168 HG21 ILE 21 HG21 ILE 21 -10.345 13.934 -7.232 169 HG22 ILE 21 HG22 ILE 21 -12.061 13.555 -7.374 170 HG23 ILE 21 HG23 ILE 21 -11.191 14.236 -8.749 171 HD11 ILE 21 HD11 ILE 21 -9.388 12.552 -6.074 172 HD12 ILE 21 HD12 ILE 21 -8.544 11.272 -6.945 173 HD13 ILE 21 HD13 ILE 21 -9.407 10.902 -5.453 174 H SER 22 H SER 22 -13.754 13.215 -9.920 175 HA SER 22 HA SER 22 -12.373 14.588 -12.099 176 HB2 SER 22 HB2 SER 22 -13.465 12.711 -13.237 177 HB3 SER 22 HB3 SER 22 -15.003 13.137 -12.491 178 HG SER 22 HG SER 22 -13.563 14.400 -14.529 179 H GLU 23 H GLU 23 -13.023 16.684 -12.321 180 HA GLU 23 HA GLU 23 -15.341 17.576 -10.708 181 HB2 GLU 23 HB2 GLU 23 -13.102 18.141 -9.694 182 HB3 GLU 23 HB3 GLU 23 -12.777 19.130 -11.118 183 HG2 GLU 23 HG2 GLU 23 -14.801 20.469 -10.652 184 HG3 GLU 23 HG3 GLU 23 -15.124 19.484 -9.229 185 H ASP 24 H ASP 24 -16.736 18.939 -11.674 186 HA ASP 24 HA ASP 24 -16.038 20.496 -14.009 187 HB2 ASP 24 HB2 ASP 24 -16.622 18.014 -14.710 188 HB3 ASP 24 HB3 ASP 24 -18.280 18.560 -14.449 189 H ASP 25 H ASP 25 -17.679 22.010 -14.566 190 HA ASP 25 HA ASP 25 -19.556 22.514 -12.378 191 HB2 ASP 25 HB2 ASP 25 -18.687 24.272 -14.678 192 HB3 ASP 25 HB3 ASP 25 -19.755 24.765 -13.365 193 H ALA 26 H ALA 26 -19.836 20.658 -14.955 194 HA ALA 26 HA ALA 26 -22.064 21.692 -16.390 195 HB1 ALA 26 HB1 ALA 26 -20.919 20.015 -17.542 196 HB2 ALA 26 HB2 ALA 26 -22.337 19.152 -16.944 197 HB3 ALA 26 HB3 ALA 26 -20.790 18.987 -16.115 198 HA PRO 27 HA PRO 27 -25.558 21.010 -13.740 199 HB2 PRO 27 HB2 PRO 27 -26.752 19.357 -15.939 200 HB3 PRO 27 HB3 PRO 27 -27.461 20.709 -15.030 201 HG2 PRO 27 HG2 PRO 27 -26.619 21.098 -17.482 202 HG3 PRO 27 HG3 PRO 27 -26.274 22.306 -16.227 203 HD2 PRO 27 HD2 PRO 27 -24.431 20.252 -17.422 204 HD3 PRO 27 HD3 PRO 27 -24.094 21.939 -16.967 205 H ALA 28 H ALA 28 -24.426 18.162 -15.523 206 HA ALA 28 HA ALA 28 -25.080 16.466 -13.184 207 HB1 ALA 28 HB1 ALA 28 -26.344 15.616 -14.980 208 HB2 ALA 28 HB2 ALA 28 -24.912 14.586 -14.944 209 HB3 ALA 28 HB3 ALA 28 -25.039 15.879 -16.139 210 H GLU 29 H GLU 29 -23.501 15.251 -12.276 211 HA GLU 29 HA GLU 29 -20.770 15.621 -13.292 212 HB2 GLU 29 HB2 GLU 29 -21.517 16.254 -10.854 213 HB3 GLU 29 HB3 GLU 29 -21.396 14.524 -10.561 214 HG2 GLU 29 HG2 GLU 29 -19.172 16.257 -11.674 215 HG3 GLU 29 HG3 GLU 29 -19.287 15.703 -10.007 216 HA PRO 30 HA PRO 30 -21.195 10.848 -12.358 217 HB2 PRO 30 HB2 PRO 30 -24.102 10.455 -12.870 218 HB3 PRO 30 HB3 PRO 30 -23.050 9.664 -11.677 219 HG2 PRO 30 HG2 PRO 30 -24.796 11.494 -10.921 220 HG3 PRO 30 HG3 PRO 30 -23.175 11.433 -10.201 221 HD2 PRO 30 HD2 PRO 30 -24.224 13.298 -12.316 222 HD3 PRO 30 HD3 PRO 30 -23.189 13.653 -10.917 223 H ALA 31 H ALA 31 -21.056 9.238 -14.026 224 HA ALA 31 HA ALA 31 -22.216 9.882 -16.636 225 HB1 ALA 31 HB1 ALA 31 -20.185 10.926 -17.058 226 HB2 ALA 31 HB2 ALA 31 -19.824 9.274 -17.559 227 HB3 ALA 31 HB3 ALA 31 -19.293 9.854 -15.980 228 H ALA 32 H ALA 32 -22.706 8.068 -17.803 229 HA ALA 32 HA ALA 32 -21.498 5.507 -17.207 230 HB1 ALA 32 HB1 ALA 32 -24.032 4.666 -16.839 231 HB2 ALA 32 HB2 ALA 32 -24.152 6.274 -16.126 232 HB3 ALA 32 HB3 ALA 32 -22.970 5.124 -15.507 233 H GLU 33 H GLU 33 -22.368 3.773 -18.568 234 HA GLU 33 HA GLU 33 -23.690 4.742 -21.028 235 HB2 GLU 33 HB2 GLU 33 -21.328 2.843 -20.874 236 HB3 GLU 33 HB3 GLU 33 -22.203 3.268 -22.342 237 HG2 GLU 33 HG2 GLU 33 -20.721 5.235 -20.570 238 HG3 GLU 33 HG3 GLU 33 -20.110 4.588 -22.088 239 H ALA 34 H ALA 34 -24.716 2.935 -22.274 240 HA ALA 34 HA ALA 34 -25.255 0.515 -20.714 241 HB1 ALA 34 HB1 ALA 34 -27.528 2.160 -21.836 242 HB2 ALA 34 HB2 ALA 34 -26.997 2.292 -20.161 243 HB3 ALA 34 HB3 ALA 34 -27.625 0.759 -20.769 244 H ALA 35 H ALA 35 -25.956 -1.228 -21.936 245 HA ALA 35 HA ALA 35 -26.438 -0.974 -24.777 246 HB1 ALA 35 HB1 ALA 35 -24.395 -2.806 -24.900 247 HB2 ALA 35 HB2 ALA 35 -23.784 -1.661 -23.703 248 HB3 ALA 35 HB3 ALA 35 -24.238 -1.097 -25.311 249 HA PRO 36 HA PRO 36 -28.744 -4.723 -24.202 250 HB2 PRO 36 HB2 PRO 36 -27.235 -6.019 -26.434 251 HB3 PRO 36 HB3 PRO 36 -28.987 -5.824 -26.223 252 HG2 PRO 36 HG2 PRO 36 -27.689 -4.331 -27.963 253 HG3 PRO 36 HG3 PRO 36 -28.959 -3.625 -26.945 254 HD2 PRO 36 HD2 PRO 36 -25.975 -3.402 -26.652 255 HD3 PRO 36 HD3 PRO 36 -27.224 -2.157 -26.416 256 HA PRO 37 HA PRO 37 -26.168 -7.269 -21.541 257 HB2 PRO 37 HB2 PRO 37 -28.043 -9.503 -22.211 258 HB3 PRO 37 HB3 PRO 37 -27.521 -8.907 -20.622 259 HG2 PRO 37 HG2 PRO 37 -29.931 -8.340 -21.511 260 HG3 PRO 37 HG3 PRO 37 -28.971 -7.100 -20.681 261 HD2 PRO 37 HD2 PRO 37 -29.489 -7.417 -23.628 262 HD3 PRO 37 HD3 PRO 37 -29.431 -5.935 -22.646 263 HA PRO 38 HA PRO 38 -23.660 -9.443 -24.621 264 HB2 PRO 38 HB2 PRO 38 -21.741 -10.519 -23.039 265 HB3 PRO 38 HB3 PRO 38 -21.817 -8.779 -23.382 266 HG2 PRO 38 HG2 PRO 38 -22.762 -10.272 -20.976 267 HG3 PRO 38 HG3 PRO 38 -21.862 -8.749 -21.073 268 HD2 PRO 38 HD2 PRO 38 -24.557 -8.830 -20.660 269 HD3 PRO 38 HD3 PRO 38 -23.760 -7.495 -21.519 270 HA PRO 39 HA PRO 39 -25.150 -13.665 -24.517 271 HB2 PRO 39 HB2 PRO 39 -23.365 -14.969 -26.104 272 HB3 PRO 39 HB3 PRO 39 -24.568 -13.835 -26.751 273 HG2 PRO 39 HG2 PRO 39 -21.678 -13.387 -26.157 274 HG3 PRO 39 HG3 PRO 39 -22.631 -12.880 -27.564 275 HD2 PRO 39 HD2 PRO 39 -22.041 -11.176 -25.524 276 HD3 PRO 39 HD3 PRO 39 -23.550 -11.057 -26.457 277 HA PRO 40 HA PRO 40 -22.906 -15.805 -21.302 278 HB2 PRO 40 HB2 PRO 40 -23.488 -18.443 -21.782 279 HB3 PRO 40 HB3 PRO 40 -24.637 -17.299 -21.061 280 HG2 PRO 40 HG2 PRO 40 -24.424 -18.244 -23.881 281 HG3 PRO 40 HG3 PRO 40 -25.865 -17.998 -22.878 282 HD2 PRO 40 HD2 PRO 40 -25.105 -16.187 -24.744 283 HD3 PRO 40 HD3 PRO 40 -25.887 -15.697 -23.222 284 H GLU 41 H GLU 41 -22.352 -16.777 -24.622 285 HA GLU 41 HA GLU 41 -19.573 -17.474 -23.932 286 HB2 GLU 41 HB2 GLU 41 -19.667 -19.320 -25.649 287 HB3 GLU 41 HB3 GLU 41 -20.607 -19.621 -24.192 288 HG2 GLU 41 HG2 GLU 41 -22.661 -18.889 -25.379 289 HG3 GLU 41 HG3 GLU 41 -21.718 -18.625 -26.841 290 HA PRO 42 HA PRO 42 -19.831 -14.446 -27.498 291 HB2 PRO 42 HB2 PRO 42 -18.018 -12.640 -26.573 292 HB3 PRO 42 HB3 PRO 42 -19.729 -12.600 -26.105 293 HG2 PRO 42 HG2 PRO 42 -17.388 -13.687 -24.614 294 HG3 PRO 42 HG3 PRO 42 -18.749 -12.719 -24.023 295 HD2 PRO 42 HD2 PRO 42 -18.625 -15.426 -23.699 296 HD3 PRO 42 HD3 PRO 42 -20.161 -14.551 -23.871 297 H GLU 43 H GLU 43 -18.494 -14.498 -29.251 298 HA GLU 43 HA GLU 43 -15.720 -15.436 -28.890 299 HB2 GLU 43 HB2 GLU 43 -17.692 -16.484 -30.942 300 HB3 GLU 43 HB3 GLU 43 -15.976 -16.882 -30.892 301 HG2 GLU 43 HG2 GLU 43 -16.263 -17.834 -28.629 302 HG3 GLU 43 HG3 GLU 43 -17.982 -17.447 -28.685 303 HA PRO 44 HA PRO 44 -16.068 -11.654 -31.667 304 HB2 PRO 44 HB2 PRO 44 -14.115 -10.163 -30.479 305 HB3 PRO 44 HB3 PRO 44 -15.802 -10.156 -29.930 306 HG2 PRO 44 HG2 PRO 44 -13.463 -11.634 -28.822 307 HG3 PRO 44 HG3 PRO 44 -14.752 -10.761 -27.971 308 HD2 PRO 44 HD2 PRO 44 -14.759 -13.472 -28.224 309 HD3 PRO 44 HD3 PRO 44 -16.256 -12.517 -28.163 310 H GLU 45 H GLU 45 -14.861 -11.411 -33.481 311 HA GLU 45 HA GLU 45 -12.042 -12.124 -33.530 312 HB2 GLU 45 HB2 GLU 45 -12.353 -13.702 -35.459 313 HB3 GLU 45 HB3 GLU 45 -12.985 -14.309 -33.931 314 HG2 GLU 45 HG2 GLU 45 -15.264 -13.597 -34.599 315 HG3 GLU 45 HG3 GLU 45 -14.630 -13.015 -36.133 316 HA PRO 46 HA PRO 46 -13.528 -8.617 -36.364 317 HB2 PRO 46 HB2 PRO 46 -11.689 -6.761 -35.485 318 HB3 PRO 46 HB3 PRO 46 -13.324 -6.935 -34.818 319 HG2 PRO 46 HG2 PRO 46 -10.736 -7.980 -33.775 320 HG3 PRO 46 HG3 PRO 46 -12.091 -7.243 -32.900 321 HD2 PRO 46 HD2 PRO 46 -11.718 -9.922 -32.930 322 HD3 PRO 46 HD3 PRO 46 -13.348 -9.208 -32.920 323 H VAL 47 H VAL 47 -10.339 -9.802 -35.430 324 HA VAL 47 HA VAL 47 -9.517 -10.356 -38.061 325 HB VAL 47 HB VAL 47 -9.362 -7.916 -38.308 326 HG11 VAL 47 HG11 VAL 47 -7.236 -7.938 -36.165 327 HG12 VAL 47 HG12 VAL 47 -8.915 -7.517 -35.830 328 HG13 VAL 47 HG13 VAL 47 -7.968 -6.542 -36.954 329 HG21 VAL 47 HG21 VAL 47 -7.714 -9.379 -39.469 330 HG22 VAL 47 HG22 VAL 47 -6.613 -9.181 -38.106 331 HG23 VAL 47 HG23 VAL 47 -7.051 -7.788 -39.094 332 H SER 48 H SER 48 -8.243 -9.322 -34.889 333 HA SER 48 HA SER 48 -7.007 -11.869 -34.422 334 HB2 SER 48 HB2 SER 48 -5.271 -9.518 -35.160 335 HB3 SER 48 HB3 SER 48 -4.668 -10.902 -34.254 336 HG SER 48 HG SER 48 -4.370 -11.144 -36.513 337 H PHE 49 H PHE 49 -7.549 -8.532 -33.502 338 HA PHE 49 HA PHE 49 -7.185 -9.277 -30.672 339 HB2 PHE 49 HB2 PHE 49 -6.469 -6.639 -31.982 340 HB3 PHE 49 HB3 PHE 49 -6.436 -6.949 -30.245 341 HD1 PHE 49 HD1 PHE 49 -4.776 -7.549 -33.459 342 HD2 PHE 49 HD2 PHE 49 -4.787 -8.509 -29.270 343 HE1 PHE 49 HE1 PHE 49 -2.488 -8.484 -33.667 344 HE2 PHE 49 HE2 PHE 49 -2.498 -9.445 -29.479 345 HZ PHE 49 HZ PHE 49 -1.349 -9.432 -31.678 346 H ASP 50 H ASP 50 -8.778 -8.654 -29.324 347 HA ASP 50 HA ASP 50 -11.189 -7.550 -30.551 348 HB2 ASP 50 HB2 ASP 50 -12.344 -8.429 -28.624 349 HB3 ASP 50 HB3 ASP 50 -11.271 -9.665 -29.280 350 H ASP 51 H ASP 51 -12.526 -6.308 -28.647 351 HA ASP 51 HA ASP 51 -10.988 -4.502 -27.054 352 HB2 ASP 51 HB2 ASP 51 -10.549 -3.531 -29.286 353 HB3 ASP 51 HB3 ASP 51 -12.285 -3.368 -29.545 354 H GLU 52 H GLU 52 -12.540 -5.534 -25.609 355 HA GLU 52 HA GLU 52 -14.783 -3.885 -25.068 356 HB2 GLU 52 HB2 GLU 52 -15.724 -5.249 -26.953 357 HB3 GLU 52 HB3 GLU 52 -15.407 -6.703 -26.010 358 HG2 GLU 52 HG2 GLU 52 -17.737 -6.047 -25.705 359 HG3 GLU 52 HG3 GLU 52 -16.865 -5.812 -24.195 360 H VAL 53 H VAL 53 -15.103 -4.014 -22.902 361 HA VAL 53 HA VAL 53 -14.102 -6.430 -21.539 362 HB VAL 53 HB VAL 53 -13.319 -4.979 -19.680 363 HG11 VAL 53 HG11 VAL 53 -11.780 -5.713 -21.483 364 HG12 VAL 53 HG12 VAL 53 -11.328 -4.135 -20.836 365 HG13 VAL 53 HG13 VAL 53 -12.162 -4.247 -22.386 366 HG21 VAL 53 HG21 VAL 53 -13.206 -2.581 -19.925 367 HG22 VAL 53 HG22 VAL 53 -14.871 -3.051 -20.257 368 HG23 VAL 53 HG23 VAL 53 -13.784 -2.668 -21.590 369 H LEU 54 H LEU 54 -15.148 -6.945 -19.532 370 HA LEU 54 HA LEU 54 -17.356 -5.471 -18.524 371 HB2 LEU 54 HB2 LEU 54 -19.166 -7.021 -19.146 372 HB3 LEU 54 HB3 LEU 54 -18.467 -6.240 -20.561 373 HG LEU 54 HG LEU 54 -17.408 -8.928 -19.670 374 HD11 LEU 54 HD11 LEU 54 -19.760 -8.591 -21.548 375 HD12 LEU 54 HD12 LEU 54 -19.939 -9.021 -19.847 376 HD13 LEU 54 HD13 LEU 54 -19.072 -10.099 -20.942 377 HD21 LEU 54 HD21 LEU 54 -16.111 -8.017 -21.423 378 HD22 LEU 54 HD22 LEU 54 -17.515 -7.328 -22.234 379 HD23 LEU 54 HD23 LEU 54 -17.238 -9.068 -22.278 380 H GLU 55 H GLU 55 -18.614 -6.799 -16.886 381 HA GLU 55 HA GLU 55 -16.986 -8.993 -15.763 382 HB2 GLU 55 HB2 GLU 55 -18.115 -6.616 -14.261 383 HB3 GLU 55 HB3 GLU 55 -17.440 -8.051 -13.492 384 HG2 GLU 55 HG2 GLU 55 -15.619 -6.562 -13.538 385 HG3 GLU 55 HG3 GLU 55 -15.333 -7.586 -14.936 386 H LEU 56 H LEU 56 -18.147 -10.675 -14.941 387 HA LEU 56 HA LEU 56 -21.099 -10.400 -14.894 388 HB2 LEU 56 HB2 LEU 56 -20.330 -11.726 -16.839 389 HB3 LEU 56 HB3 LEU 56 -19.473 -12.814 -15.754 390 HG LEU 56 HG LEU 56 -21.667 -13.358 -14.653 391 HD11 LEU 56 HD11 LEU 56 -22.723 -11.623 -16.901 392 HD12 LEU 56 HD12 LEU 56 -23.000 -11.426 -15.171 393 HD13 LEU 56 HD13 LEU 56 -23.727 -12.784 -16.031 394 HD21 LEU 56 HD21 LEU 56 -21.511 -13.832 -17.645 395 HD22 LEU 56 HD22 LEU 56 -22.491 -14.766 -16.517 396 HD23 LEU 56 HD23 LEU 56 -20.732 -14.812 -16.403 397 H THR 57 H THR 57 -21.867 -10.624 -12.906 398 HA THR 57 HA THR 57 -20.599 -12.573 -11.078 399 HB THR 57 HB THR 57 -21.007 -11.028 -9.199 400 HG1 THR 57 HG1 THR 57 -22.628 -9.762 -9.916 401 HG21 THR 57 HG21 THR 57 -19.424 -9.644 -11.379 402 HG22 THR 57 HG22 THR 57 -18.826 -11.040 -10.481 403 HG23 THR 57 HG23 THR 57 -19.173 -9.532 -9.636 404 H ASP 58 H ASP 58 -22.011 -13.421 -9.439 405 HA ASP 58 HA ASP 58 -24.754 -13.699 -10.398 406 HB2 ASP 58 HB2 ASP 58 -23.275 -15.129 -8.182 407 HB3 ASP 58 HB3 ASP 58 -24.893 -15.524 -8.745 408 HA PRO 59 HA PRO 59 -26.014 -10.545 -7.341 409 HB2 PRO 59 HB2 PRO 59 -28.725 -11.692 -7.850 410 HB3 PRO 59 HB3 PRO 59 -28.183 -10.001 -7.905 411 HG2 PRO 59 HG2 PRO 59 -28.669 -11.305 -10.139 412 HG3 PRO 59 HG3 PRO 59 -27.265 -10.226 -10.018 413 HD2 PRO 59 HD2 PRO 59 -27.346 -13.232 -9.873 414 HD3 PRO 59 HD3 PRO 59 -26.180 -12.178 -10.707 415 H ILE 60 H ILE 60 -26.330 -10.620 -5.153 416 HA ILE 60 HA ILE 60 -27.552 -12.964 -3.914 417 HB ILE 60 HB ILE 60 -25.168 -13.564 -4.148 418 HG12 ILE 60 HG12 ILE 60 -25.726 -12.936 -1.240 419 HG13 ILE 60 HG13 ILE 60 -26.620 -14.181 -2.108 420 HG21 ILE 60 HG21 ILE 60 -24.255 -11.254 -4.111 421 HG22 ILE 60 HG22 ILE 60 -23.443 -12.303 -2.949 422 HG23 ILE 60 HG23 ILE 60 -24.649 -11.143 -2.394 423 HD11 ILE 60 HD11 ILE 60 -24.524 -15.351 -2.635 424 HD12 ILE 60 HD12 ILE 60 -24.675 -15.130 -0.892 425 HD13 ILE 60 HD13 ILE 60 -23.600 -14.087 -1.825 426 H ALA 61 H ALA 61 -28.595 -12.492 -2.043 427 HA ALA 61 HA ALA 61 -29.011 -9.751 -1.356 428 HB1 ALA 61 HB1 ALA 61 -30.611 -10.542 0.187 429 HB2 ALA 61 HB2 ALA 61 -29.795 -12.094 0.368 430 HB3 ALA 61 HB3 ALA 61 -30.657 -11.720 -1.125 431 HA PRO 62 HA PRO 62 -25.730 -9.069 1.595 432 HB2 PRO 62 HB2 PRO 62 -27.767 -7.808 3.378 433 HB3 PRO 62 HB3 PRO 62 -26.236 -7.148 2.772 434 HG2 PRO 62 HG2 PRO 62 -28.525 -6.314 1.773 435 HG3 PRO 62 HG3 PRO 62 -27.137 -6.610 0.710 436 HD2 PRO 62 HD2 PRO 62 -29.563 -8.331 1.159 437 HD3 PRO 62 HD3 PRO 62 -28.711 -7.958 -0.359 438 H GLU 63 H GLU 63 -24.838 -10.172 3.291 439 HA GLU 63 HA GLU 63 -26.477 -11.386 5.350 440 HB2 GLU 63 HB2 GLU 63 -25.697 -13.685 4.914 441 HB3 GLU 63 HB3 GLU 63 -26.658 -13.066 3.575 442 HG2 GLU 63 HG2 GLU 63 -24.598 -12.523 2.333 443 HG3 GLU 63 HG3 GLU 63 -23.625 -13.112 3.677 444 HA PRO 64 HA PRO 64 -22.616 -10.811 7.496 445 HB2 PRO 64 HB2 PRO 64 -22.953 -12.263 9.733 446 HB3 PRO 64 HB3 PRO 64 -23.990 -10.864 9.384 447 HG2 PRO 64 HG2 PRO 64 -24.561 -13.768 9.070 448 HG3 PRO 64 HG3 PRO 64 -25.615 -12.467 9.649 449 HD2 PRO 64 HD2 PRO 64 -25.645 -13.500 7.057 450 HD3 PRO 64 HD3 PRO 64 -26.290 -11.911 7.528 451 H GLU 65 H GLU 65 -22.067 -12.434 5.416 452 HA GLU 65 HA GLU 65 -21.222 -15.051 5.913 453 HB2 GLU 65 HB2 GLU 65 -21.481 -14.028 3.658 454 HB3 GLU 65 HB3 GLU 65 -20.032 -13.072 3.951 455 HG2 GLU 65 HG2 GLU 65 -18.709 -15.134 4.209 456 HG3 GLU 65 HG3 GLU 65 -20.157 -16.104 3.945 457 H LEU 66 H LEU 66 -19.468 -11.969 6.267 458 HA LEU 66 HA LEU 66 -17.283 -13.462 7.590 459 HB2 LEU 66 HB2 LEU 66 -15.788 -11.622 6.918 460 HB3 LEU 66 HB3 LEU 66 -16.536 -12.397 5.528 461 HG LEU 66 HG LEU 66 -18.344 -10.489 5.779 462 HD11 LEU 66 HD11 LEU 66 -16.047 -9.496 7.459 463 HD12 LEU 66 HD12 LEU 66 -17.779 -9.350 7.746 464 HD13 LEU 66 HD13 LEU 66 -17.005 -8.343 6.531 465 HD21 LEU 66 HD21 LEU 66 -16.682 -10.816 3.904 466 HD22 LEU 66 HD22 LEU 66 -15.566 -9.777 4.790 467 HD23 LEU 66 HD23 LEU 66 -17.099 -9.131 4.206 468 HA PRO 67 HA PRO 67 -18.196 -11.250 11.314 469 HB2 PRO 67 HB2 PRO 67 -15.775 -10.966 12.512 470 HB3 PRO 67 HB3 PRO 67 -16.581 -12.540 12.352 471 HG2 PRO 67 HG2 PRO 67 -14.403 -11.356 10.690 472 HG3 PRO 67 HG3 PRO 67 -14.564 -13.003 11.326 473 HD2 PRO 67 HD2 PRO 67 -15.188 -12.374 8.754 474 HD3 PRO 67 HD3 PRO 67 -16.029 -13.656 9.650 475 HA PRO 68 HA PRO 68 -17.592 -6.872 10.641 476 HB2 PRO 68 HB2 PRO 68 -17.888 -5.824 13.137 477 HB3 PRO 68 HB3 PRO 68 -19.248 -6.486 12.208 478 HG2 PRO 68 HG2 PRO 68 -17.651 -7.756 14.386 479 HG3 PRO 68 HG3 PRO 68 -19.406 -7.754 14.129 480 HD2 PRO 68 HD2 PRO 68 -17.849 -9.871 13.435 481 HD3 PRO 68 HD3 PRO 68 -19.313 -9.432 12.525 482 H LEU 69 H LEU 69 -16.164 -5.050 11.090 483 HA LEU 69 HA LEU 69 -14.113 -4.084 11.408 484 HB2 LEU 69 HB2 LEU 69 -14.078 -6.010 13.744 485 HB3 LEU 69 HB3 LEU 69 -12.802 -4.836 13.442 486 HG LEU 69 HG LEU 69 -15.717 -4.052 13.685 487 HD11 LEU 69 HD11 LEU 69 -15.125 -3.336 15.998 488 HD12 LEU 69 HD12 LEU 69 -13.551 -4.112 15.809 489 HD13 LEU 69 HD13 LEU 69 -15.022 -5.086 15.792 490 HD21 LEU 69 HD21 LEU 69 -14.390 -2.365 12.587 491 HD22 LEU 69 HD22 LEU 69 -13.080 -2.556 13.751 492 HD23 LEU 69 HD23 LEU 69 -14.607 -1.832 14.254 493 H GLU 70 H GLU 70 -11.877 -4.379 10.980 494 HA GLU 70 HA GLU 70 -10.162 -5.294 9.753 495 HB2 GLU 70 HB2 GLU 70 -10.051 -6.576 11.939 496 HB3 GLU 70 HB3 GLU 70 -10.922 -7.879 11.124 497 HG2 GLU 70 HG2 GLU 70 -9.150 -7.997 9.411 498 HG3 GLU 70 HG3 GLU 70 -8.278 -6.700 10.221 499 H THR 71 H THR 71 -11.335 -4.990 7.770 500 HA THR 71 HA THR 71 -12.102 -7.545 6.493 501 HB THR 71 HB THR 71 -13.856 -6.351 5.238 502 HG1 THR 71 HG1 THR 71 -14.134 -4.265 5.460 503 HG21 THR 71 HG21 THR 71 -14.157 -5.947 8.226 504 HG22 THR 71 HG22 THR 71 -14.369 -7.495 7.407 505 HG23 THR 71 HG23 THR 71 -15.458 -6.153 7.051 506 H VAL 72 H VAL 72 -11.934 -7.517 4.148 507 HA VAL 72 HA VAL 72 -9.489 -6.253 3.279 508 HB VAL 72 HB VAL 72 -11.478 -7.983 1.763 509 HG11 VAL 72 HG11 VAL 72 -10.106 -6.630 0.233 510 HG12 VAL 72 HG12 VAL 72 -9.602 -8.320 0.168 511 HG13 VAL 72 HG13 VAL 72 -8.641 -7.148 1.069 512 HG21 VAL 72 HG21 VAL 72 -10.454 -9.185 3.628 513 HG22 VAL 72 HG22 VAL 72 -8.853 -8.630 3.143 514 HG23 VAL 72 HG23 VAL 72 -9.744 -9.752 2.115 515 H GLY 73 H GLY 73 -9.310 -4.391 2.214 516 HA2 GLY 73 HA2 GLY 73 -10.246 -3.060 0.291 517 HA3 GLY 73 HA3 GLY 73 -11.768 -3.107 1.174 518 H ASP 74 H ASP 74 -8.477 -2.643 2.405 519 HA ASP 74 HA ASP 74 -9.049 0.160 3.048 520 HB2 ASP 74 HB2 ASP 74 -8.170 -1.865 5.122 521 HB3 ASP 74 HB3 ASP 74 -8.355 -0.131 5.383 522 H ILE 75 H ILE 75 -7.427 1.073 1.931 523 HA ILE 75 HA ILE 75 -4.896 -0.079 1.440 524 HB ILE 75 HB ILE 75 -5.781 2.831 1.380 525 HG12 ILE 75 HG12 ILE 75 -5.311 0.886 -0.901 526 HG13 ILE 75 HG13 ILE 75 -6.890 1.116 -0.164 527 HG21 ILE 75 HG21 ILE 75 -3.399 2.917 1.504 528 HG22 ILE 75 HG22 ILE 75 -3.749 2.982 -0.224 529 HG23 ILE 75 HG23 ILE 75 -3.215 1.472 0.512 530 HD11 ILE 75 HD11 ILE 75 -5.374 2.907 -1.989 531 HD12 ILE 75 HD12 ILE 75 -6.228 3.717 -0.670 532 HD13 ILE 75 HD13 ILE 75 -7.115 2.698 -1.802 533 H ASP 76 H ASP 76 -6.004 2.334 3.810 534 HA ASP 76 HA ASP 76 -4.214 1.376 5.802 535 HB2 ASP 76 HB2 ASP 76 -2.598 2.645 4.443 536 HB3 ASP 76 HB3 ASP 76 -3.596 4.088 4.606 537 H VAL 77 H VAL 77 -6.511 1.271 6.516 538 HA VAL 77 HA VAL 77 -7.084 3.519 8.253 539 HB VAL 77 HB VAL 77 -8.201 4.195 6.155 540 HG11 VAL 77 HG11 VAL 77 -8.614 2.003 5.168 541 HG12 VAL 77 HG12 VAL 77 -10.144 2.862 5.344 542 HG13 VAL 77 HG13 VAL 77 -9.713 1.586 6.482 543 HG21 VAL 77 HG21 VAL 77 -9.207 4.801 8.336 544 HG22 VAL 77 HG22 VAL 77 -10.151 3.311 8.307 545 HG23 VAL 77 HG23 VAL 77 -10.445 4.564 7.099 546 H TYR 78 H TYR 78 -8.062 2.867 10.116 547 HA TYR 78 HA TYR 78 -9.312 0.206 10.217 548 HB2 TYR 78 HB2 TYR 78 -6.912 0.030 10.919 549 HB3 TYR 78 HB3 TYR 78 -7.247 1.188 12.206 550 HD1 TYR 78 HD1 TYR 78 -8.087 -2.188 10.895 551 HD2 TYR 78 HD2 TYR 78 -8.395 0.529 14.209 552 HE1 TYR 78 HE1 TYR 78 -8.930 -4.028 12.326 553 HE2 TYR 78 HE2 TYR 78 -9.238 -1.312 15.640 554 HH TYR 78 HH TYR 78 -8.849 -4.272 15.242 555 H SER 79 H SER 79 -10.724 -0.064 12.066 556 HA SER 79 HA SER 79 -12.325 0.599 13.568 557 HB2 SER 79 HB2 SER 79 -10.335 1.684 14.719 558 HB3 SER 79 HB3 SER 79 -10.788 3.181 13.913 559 HG SER 79 HG SER 79 -12.649 3.234 15.041 560 HA PRO 80 HA PRO 80 -14.328 3.099 10.215 561 HB2 PRO 80 HB2 PRO 80 -16.707 1.774 10.207 562 HB3 PRO 80 HB3 PRO 80 -15.281 1.194 9.325 563 HG2 PRO 80 HG2 PRO 80 -16.334 0.337 11.982 564 HG3 PRO 80 HG3 PRO 80 -15.732 -0.650 10.638 565 HD2 PRO 80 HD2 PRO 80 -14.193 -0.085 12.801 566 HD3 PRO 80 HD3 PRO 80 -13.503 -0.272 11.174 567 HA PRO 81 HA PRO 81 -16.683 5.843 12.810 568 HB2 PRO 81 HB2 PRO 81 -18.754 6.680 11.222 569 HB3 PRO 81 HB3 PRO 81 -17.081 7.233 11.020 570 HG2 PRO 81 HG2 PRO 81 -18.567 5.130 9.519 571 HG3 PRO 81 HG3 PRO 81 -17.469 6.386 8.916 572 HD2 PRO 81 HD2 PRO 81 -16.657 3.820 9.241 573 HD3 PRO 81 HD3 PRO 81 -15.560 5.195 9.499 574 H GLU 82 H GLU 82 -19.145 6.396 13.389 575 HA GLU 82 HA GLU 82 -20.167 4.196 14.788 576 HB2 GLU 82 HB2 GLU 82 -21.441 6.824 14.013 577 HB3 GLU 82 HB3 GLU 82 -22.197 5.659 15.099 578 HG2 GLU 82 HG2 GLU 82 -20.237 5.778 16.595 579 HG3 GLU 82 HG3 GLU 82 -19.485 6.950 15.515 580 HA PRO 83 HA PRO 83 -22.590 2.033 11.757 581 HB2 PRO 83 HB2 PRO 83 -24.616 0.986 13.240 582 HB3 PRO 83 HB3 PRO 83 -22.947 0.394 13.339 583 HG2 PRO 83 HG2 PRO 83 -24.396 2.274 15.146 584 HG3 PRO 83 HG3 PRO 83 -23.325 0.920 15.553 585 HD2 PRO 83 HD2 PRO 83 -22.466 3.500 15.588 586 HD3 PRO 83 HD3 PRO 83 -21.394 2.149 15.159 587 H GLU 84 H GLU 84 -25.043 1.658 11.160 588 HA GLU 84 HA GLU 84 -26.840 2.620 10.083 589 HB2 GLU 84 HB2 GLU 84 -26.982 4.074 12.738 590 HB3 GLU 84 HB3 GLU 84 -28.295 3.964 11.568 591 HG2 GLU 84 HG2 GLU 84 -28.257 1.496 11.766 592 HG3 GLU 84 HG3 GLU 84 -26.965 1.621 12.958 593 H SER 85 H SER 85 -24.284 3.898 9.556 594 HA SER 85 HA SER 85 -25.233 6.296 8.308 595 HB2 SER 85 HB2 SER 85 -23.759 7.868 9.420 596 HB3 SER 85 HB3 SER 85 -24.773 7.097 10.638 597 HG SER 85 HG SER 85 -22.809 6.841 11.473 598 H GLU 86 H GLU 86 -23.472 7.264 6.921 599 HA GLU 86 HA GLU 86 -21.189 5.470 6.517 600 HB2 GLU 86 HB2 GLU 86 -21.546 5.562 4.047 601 HB3 GLU 86 HB3 GLU 86 -22.815 4.684 4.894 602 HG2 GLU 86 HG2 GLU 86 -23.084 7.616 4.179 603 HG3 GLU 86 HG3 GLU 86 -23.575 6.336 3.080 604 HA PRO 87 HA PRO 87 -20.287 10.126 6.303 605 HB2 PRO 87 HB2 PRO 87 -18.597 10.316 8.428 606 HB3 PRO 87 HB3 PRO 87 -20.357 10.489 8.583 607 HG2 PRO 87 HG2 PRO 87 -18.634 8.120 9.143 608 HG3 PRO 87 HG3 PRO 87 -19.984 8.777 10.084 609 HD2 PRO 87 HD2 PRO 87 -20.274 6.622 8.446 610 HD3 PRO 87 HD3 PRO 87 -21.590 7.782 8.739 611 H ALA 88 H ALA 88 -18.351 11.076 5.560 612 HA ALA 88 HA ALA 88 -16.310 11.202 4.548 613 HB1 ALA 88 HB1 ALA 88 -15.408 8.633 5.812 614 HB2 ALA 88 HB2 ALA 88 -15.637 10.065 6.814 615 HB3 ALA 88 HB3 ALA 88 -14.488 10.101 5.479 616 H TYR 89 H TYR 89 -16.711 7.641 4.742 617 HA TYR 89 HA TYR 89 -17.174 7.551 1.846 618 HB2 TYR 89 HB2 TYR 89 -14.710 7.399 2.175 619 HB3 TYR 89 HB3 TYR 89 -14.955 5.991 3.206 620 HD1 TYR 89 HD1 TYR 89 -15.432 7.305 -0.247 621 HD2 TYR 89 HD2 TYR 89 -15.332 3.825 2.269 622 HE1 TYR 89 HE1 TYR 89 -15.479 5.851 -2.255 623 HE2 TYR 89 HE2 TYR 89 -15.380 2.371 0.260 624 HH TYR 89 HH TYR 89 -14.641 2.706 -2.268 625 H THR 90 H THR 90 -18.693 6.110 1.360 626 HA THR 90 HA THR 90 -19.868 4.466 3.409 627 HB THR 90 HB THR 90 -20.461 4.624 0.437 628 HG1 THR 90 HG1 THR 90 -20.750 6.581 1.599 629 HG21 THR 90 HG21 THR 90 -21.393 2.586 1.318 630 HG22 THR 90 HG22 THR 90 -22.714 3.749 1.213 631 HG23 THR 90 HG23 THR 90 -21.960 3.407 2.772 632 HA PRO 91 HA PRO 91 -17.135 0.938 2.668 633 HB2 PRO 91 HB2 PRO 91 -19.485 -0.685 3.553 634 HB3 PRO 91 HB3 PRO 91 -17.806 -0.725 4.129 635 HG2 PRO 91 HG2 PRO 91 -19.677 0.399 5.598 636 HG3 PRO 91 HG3 PRO 91 -18.079 1.158 5.450 637 HD2 PRO 91 HD2 PRO 91 -20.656 1.919 4.098 638 HD3 PRO 91 HD3 PRO 91 -19.395 2.964 4.792 639 HA PRO 92 HA PRO 92 -18.722 -0.329 -1.374 640 HB2 PRO 92 HB2 PRO 92 -16.849 -2.148 -2.110 641 HB3 PRO 92 HB3 PRO 92 -16.514 -0.405 -2.069 642 HG2 PRO 92 HG2 PRO 92 -15.842 -2.508 -0.058 643 HG3 PRO 92 HG3 PRO 92 -14.839 -1.185 -0.681 644 HD2 PRO 92 HD2 PRO 92 -16.121 -1.040 1.722 645 HD3 PRO 92 HD3 PRO 92 -15.809 0.392 0.715 646 HA PRO 93 HA PRO 93 -21.266 -3.961 -0.718 647 HB2 PRO 93 HB2 PRO 93 -20.622 -4.718 -3.541 648 HB3 PRO 93 HB3 PRO 93 -22.204 -4.559 -2.750 649 HG2 PRO 93 HG2 PRO 93 -21.383 -2.702 -4.419 650 HG3 PRO 93 HG3 PRO 93 -22.188 -2.243 -2.905 651 HD2 PRO 93 HD2 PRO 93 -19.257 -2.166 -3.576 652 HD3 PRO 93 HD3 PRO 93 -20.235 -0.989 -2.668 653 H ALA 94 H ALA 94 -18.156 -4.349 -2.316 654 HA ALA 94 HA ALA 94 -16.461 -5.863 -2.063 655 HB1 ALA 94 HB1 ALA 94 -16.242 -7.109 -0.098 656 HB2 ALA 94 HB2 ALA 94 -17.981 -7.341 0.067 657 HB3 ALA 94 HB3 ALA 94 -17.268 -5.767 0.417 658 H ALA 95 H ALA 95 -16.091 -7.297 -3.523 659 HA ALA 95 HA ALA 95 -17.815 -9.639 -3.836 660 HB1 ALA 95 HB1 ALA 95 -17.254 -8.755 -6.472 661 HB2 ALA 95 HB2 ALA 95 -17.884 -7.360 -5.592 662 HB3 ALA 95 HB3 ALA 95 -18.826 -8.850 -5.676 663 HA PRO 96 HA PRO 96 -13.271 -10.707 -3.853 664 HB2 PRO 96 HB2 PRO 96 -14.586 -13.396 -3.633 665 HB3 PRO 96 HB3 PRO 96 -13.160 -12.766 -2.780 666 HG2 PRO 96 HG2 PRO 96 -15.454 -12.917 -1.521 667 HG3 PRO 96 HG3 PRO 96 -14.441 -11.472 -1.336 668 HD2 PRO 96 HD2 PRO 96 -16.931 -11.826 -2.980 669 HD3 PRO 96 HD3 PRO 96 -16.408 -10.426 -2.014 670 H VAL 97 H VAL 97 -15.885 -12.420 -5.564 671 HA VAL 97 HA VAL 97 -15.931 -13.542 -7.591 672 HB VAL 97 HB VAL 97 -14.481 -11.008 -8.429 673 HG11 VAL 97 HG11 VAL 97 -14.587 -12.738 -10.195 674 HG12 VAL 97 HG12 VAL 97 -15.636 -11.374 -10.581 675 HG13 VAL 97 HG13 VAL 97 -16.329 -12.870 -9.957 676 HG21 VAL 97 HG21 VAL 97 -17.469 -11.518 -8.335 677 HG22 VAL 97 HG22 VAL 97 -16.649 -9.991 -8.658 678 HG23 VAL 97 HG23 VAL 97 -16.594 -10.696 -7.041 679 H PHE 98 H PHE 98 -14.612 -15.349 -7.279 680 HA PHE 98 HA PHE 98 -11.749 -15.124 -7.859 681 HB2 PHE 98 HB2 PHE 98 -12.550 -16.489 -5.925 682 HB3 PHE 98 HB3 PHE 98 -13.375 -17.556 -7.062 683 HD1 PHE 98 HD1 PHE 98 -10.030 -16.223 -6.092 684 HD2 PHE 98 HD2 PHE 98 -12.184 -19.264 -8.232 685 HE1 PHE 98 HE1 PHE 98 -7.918 -17.477 -6.440 686 HE2 PHE 98 HE2 PHE 98 -10.072 -20.517 -8.580 687 HZ PHE 98 HZ PHE 98 -7.939 -19.622 -7.683 688 H ASP 99 H ASP 99 -11.406 -14.918 -10.009 689 HA ASP 99 HA ASP 99 -12.586 -16.958 -11.793 690 HB2 ASP 99 HB2 ASP 99 -12.456 -15.284 -13.594 691 HB3 ASP 99 HB3 ASP 99 -13.475 -14.722 -12.274 692 H ARG 100 H ARG 100 -10.196 -17.282 -10.273 693 HA ARG 100 HA ARG 100 -8.081 -18.116 -10.506 694 HB2 ARG 100 HB2 ARG 100 -8.581 -17.927 -13.494 695 HB3 ARG 100 HB3 ARG 100 -7.282 -18.819 -12.715 696 HG2 ARG 100 HG2 ARG 100 -10.212 -19.364 -12.163 697 HG3 ARG 100 HG3 ARG 100 -9.289 -20.221 -13.397 698 HD2 ARG 100 HD2 ARG 100 -8.606 -20.131 -10.441 699 HD3 ARG 100 HD3 ARG 100 -9.356 -21.489 -11.272 700 HE ARG 100 HE ARG 100 -6.560 -20.702 -11.399 701 HH11 ARG 100 HH11 ARG 100 -9.130 -22.545 -12.916 702 HH12 ARG 100 HH12 ARG 100 -8.037 -23.591 -13.758 703 HH21 ARG 100 HH21 ARG 100 -5.178 -22.080 -12.519 704 HH22 ARG 100 HH22 ARG 100 -5.819 -23.329 -13.534 705 H ASP 101 H ASP 101 -8.663 -15.204 -10.427 706 HA ASP 101 HA ASP 101 -6.090 -14.224 -11.516 707 HB2 ASP 101 HB2 ASP 101 -8.658 -12.659 -11.150 708 HB3 ASP 101 HB3 ASP 101 -7.122 -11.995 -11.703 709 H GLU 102 H GLU 102 -4.838 -12.924 -10.136 710 HA GLU 102 HA GLU 102 -5.834 -12.177 -7.521 711 HB2 GLU 102 HB2 GLU 102 -5.204 -14.620 -7.327 712 HB3 GLU 102 HB3 GLU 102 -3.539 -14.137 -7.657 713 HG2 GLU 102 HG2 GLU 102 -3.495 -12.719 -5.703 714 HG3 GLU 102 HG3 GLU 102 -5.215 -12.972 -5.421 715 H VAL 103 H VAL 103 -4.342 -10.839 -6.336 716 HA VAL 103 HA VAL 103 -3.055 -8.955 -6.318 717 HB VAL 103 HB VAL 103 -0.619 -9.423 -6.743 718 HG11 VAL 103 HG11 VAL 103 -1.414 -9.733 -4.536 719 HG12 VAL 103 HG12 VAL 103 -0.536 -11.215 -4.909 720 HG13 VAL 103 HG13 VAL 103 -2.299 -11.193 -4.970 721 HG21 VAL 103 HG21 VAL 103 -1.001 -11.157 -8.529 722 HG22 VAL 103 HG22 VAL 103 -1.595 -12.247 -7.276 723 HG23 VAL 103 HG23 VAL 103 0.080 -11.694 -7.243 724 H ALA 104 H ALA 104 -4.424 -8.096 -8.081 725 HA ALA 104 HA ALA 104 -2.810 -7.528 -10.498 726 HB1 ALA 104 HB1 ALA 104 -5.764 -7.904 -10.100 727 HB2 ALA 104 HB2 ALA 104 -4.716 -8.571 -11.353 728 HB3 ALA 104 HB3 ALA 104 -5.182 -6.869 -11.405 729 H GLU 105 H GLU 105 -1.730 -5.814 -9.438 730 HA GLU 105 HA GLU 105 -1.386 -3.657 -8.738 731 HB2 GLU 105 HB2 GLU 105 -2.609 -3.344 -11.007 732 HB3 GLU 105 HB3 GLU 105 -4.007 -2.909 -10.026 733 HG2 GLU 105 HG2 GLU 105 -2.820 -1.063 -9.006 734 HG3 GLU 105 HG3 GLU 105 -1.295 -1.592 -9.721 735 H GLN 106 H GLN 106 -3.170 -5.563 -7.167 736 HA GLN 106 HA GLN 106 -5.091 -3.919 -5.792 737 HB2 GLN 106 HB2 GLN 106 -5.240 -6.432 -6.041 738 HB3 GLN 106 HB3 GLN 106 -3.904 -6.559 -4.895 739 HG2 GLN 106 HG2 GLN 106 -6.014 -6.810 -3.697 740 HG3 GLN 106 HG3 GLN 106 -5.261 -5.287 -3.229 741 HE21 GLN 106 HE21 GLN 106 -6.828 -3.679 -3.073 742 HE22 GLN 106 HE22 GLN 106 -8.157 -3.508 -4.115 743 H LEU 107 H LEU 107 -4.693 -2.542 -4.200 744 HA LEU 107 HA LEU 107 -2.184 -2.825 -2.651 745 HB2 LEU 107 HB2 LEU 107 -3.472 -0.321 -3.754 746 HB3 LEU 107 HB3 LEU 107 -2.227 -0.295 -2.503 747 HG LEU 107 HG LEU 107 -1.846 -1.720 -5.149 748 HD11 LEU 107 HD11 LEU 107 -2.198 0.594 -5.706 749 HD12 LEU 107 HD12 LEU 107 -0.455 0.320 -5.732 750 HD13 LEU 107 HD13 LEU 107 -1.200 1.129 -4.354 751 HD21 LEU 107 HD21 LEU 107 -0.284 -2.454 -3.464 752 HD22 LEU 107 HD22 LEU 107 -0.007 -0.800 -2.918 753 HD23 LEU 107 HD23 LEU 107 0.588 -1.319 -4.496 754 H VAL 108 H VAL 108 -2.893 -3.657 -0.789 755 HA VAL 108 HA VAL 108 -4.827 -2.070 0.761 756 HB VAL 108 HB VAL 108 -5.889 -4.140 1.613 757 HG11 VAL 108 HG11 VAL 108 -7.061 -4.730 -0.564 758 HG12 VAL 108 HG12 VAL 108 -5.921 -3.653 -1.371 759 HG13 VAL 108 HG13 VAL 108 -7.033 -3.013 -0.162 760 HG21 VAL 108 HG21 VAL 108 -4.117 -5.762 1.241 761 HG22 VAL 108 HG22 VAL 108 -4.145 -5.458 -0.496 762 HG23 VAL 108 HG23 VAL 108 -5.514 -6.250 0.283 763 H GLY 109 H GLY 109 -4.709 -2.444 3.076 764 HA2 GLY 109 HA2 GLY 109 -2.137 -3.586 3.991 765 HA3 GLY 109 HA3 GLY 109 -2.651 -1.986 4.520 766 H VAL 110 H VAL 110 -2.195 -4.604 5.973 767 HA VAL 110 HA VAL 110 -4.655 -5.662 6.873 768 HB VAL 110 HB VAL 110 -1.926 -5.533 8.197 769 HG11 VAL 110 HG11 VAL 110 -3.544 -5.917 9.960 770 HG12 VAL 110 HG12 VAL 110 -2.779 -7.462 9.579 771 HG13 VAL 110 HG13 VAL 110 -4.400 -7.106 8.978 772 HG21 VAL 110 HG21 VAL 110 -3.355 -7.779 6.747 773 HG22 VAL 110 HG22 VAL 110 -1.718 -7.830 7.397 774 HG23 VAL 110 HG23 VAL 110 -2.094 -6.769 6.040 775 H SER 111 H SER 111 -2.564 -3.090 8.164 776 HA SER 111 HA SER 111 -2.904 -1.491 9.784 777 HB2 SER 111 HB2 SER 111 -4.376 -0.826 7.785 778 HB3 SER 111 HB3 SER 111 -5.735 -1.395 8.750 779 HG SER 111 HG SER 111 -4.260 0.885 8.966 780 H ALA 112 H ALA 112 -2.775 -3.455 11.295 781 HA ALA 112 HA ALA 112 -5.085 -4.503 12.565 782 HB1 ALA 112 HB1 ALA 112 -3.618 -5.519 14.045 783 HB2 ALA 112 HB2 ALA 112 -2.518 -4.138 14.067 784 HB3 ALA 112 HB3 ALA 112 -2.547 -5.223 12.675 785 H ALA 113 H ALA 113 -2.979 -1.775 13.290 786 HA ALA 113 HA ALA 113 -3.103 -0.081 14.866 787 HB1 ALA 113 HB1 ALA 113 -5.591 0.893 14.764 788 HB2 ALA 113 HB2 ALA 113 -5.682 -0.192 13.378 789 HB3 ALA 113 HB3 ALA 113 -4.460 1.079 13.426 790 H SER 114 H SER 114 -2.883 -2.015 16.477 791 HA SER 114 HA SER 114 -5.178 -1.946 18.353 792 HB2 SER 114 HB2 SER 114 -4.874 -4.186 17.466 793 HB3 SER 114 HB3 SER 114 -3.159 -4.149 17.871 794 HG SER 114 HG SER 114 -4.006 -5.101 19.604 795 H ALA 115 H ALA 115 -4.804 -0.926 20.183 796 HA ALA 115 HA ALA 115 -2.192 -1.079 21.488 797 HB1 ALA 115 HB1 ALA 115 -1.682 1.151 21.409 798 HB2 ALA 115 HB2 ALA 115 -3.381 1.637 21.382 799 HB3 ALA 115 HB3 ALA 115 -2.598 1.067 19.903 800 H ALA 116 H ALA 116 -5.264 0.708 21.661 801 HA ALA 116 HA ALA 116 -6.222 -0.623 23.946 802 HB1 ALA 116 HB1 ALA 116 -5.500 2.138 24.765 803 HB2 ALA 116 HB2 ALA 116 -4.186 0.963 24.682 804 HB3 ALA 116 HB3 ALA 116 -5.576 0.660 25.728 805 H ALA 117 H ALA 117 -7.689 -0.359 21.921 806 HA ALA 117 HA ALA 117 -9.346 2.078 22.238 807 HB1 ALA 117 HB1 ALA 117 -9.339 0.340 19.783 808 HB2 ALA 117 HB2 ALA 117 -8.147 1.623 19.996 809 HB3 ALA 117 HB3 ALA 117 -9.865 2.016 19.949 810 H SER 118 H SER 118 -11.164 1.701 23.288 811 HA SER 118 HA SER 118 -12.950 -0.414 22.504 812 HB2 SER 118 HB2 SER 118 -13.097 -1.500 24.670 813 HB3 SER 118 HB3 SER 118 -11.426 -1.574 24.123 814 HG SER 118 HG SER 118 -12.550 -0.243 26.252 815 H ALA 119 H ALA 119 -15.062 -0.135 23.596 816 HA ALA 119 HA ALA 119 -15.373 2.325 25.119 817 HB1 ALA 119 HB1 ALA 119 -17.140 3.168 23.553 818 HB2 ALA 119 HB2 ALA 119 -16.642 1.925 22.404 819 HB3 ALA 119 HB3 ALA 119 -15.511 3.193 22.878 820 H PHE 120 H PHE 120 -17.237 2.405 26.340 821 HA PHE 120 HA PHE 120 -19.031 0.049 26.202 822 HB2 PHE 120 HB2 PHE 120 -18.053 1.532 28.660 823 HB3 PHE 120 HB3 PHE 120 -19.285 0.267 28.669 824 HD1 PHE 120 HD1 PHE 120 -15.713 1.005 28.366 825 HD2 PHE 120 HD2 PHE 120 -18.699 -2.068 28.075 826 HE1 PHE 120 HE1 PHE 120 -13.939 -0.724 28.446 827 HE2 PHE 120 HE2 PHE 120 -16.926 -3.798 28.154 828 HZ PHE 120 HZ PHE 120 -14.545 -3.128 28.340 829 H GLY 121 H GLY 121 -18.687 3.442 27.146 830 HA2 GLY 121 HA2 GLY 121 -21.196 4.209 26.016 831 HA3 GLY 121 HA3 GLY 121 -21.288 4.123 27.774 832 H SER 122 H SER 122 -21.748 6.543 26.902 833 HA SER 122 HA SER 122 -19.267 8.027 27.480 834 HB2 SER 122 HB2 SER 122 -19.572 8.113 25.055 835 HB3 SER 122 HB3 SER 122 -21.229 8.672 25.266 836 HG SER 122 HG SER 122 -18.804 9.983 25.909 837 H LEU 123 H LEU 123 -19.532 9.958 28.561 838 HA LEU 123 HA LEU 123 -21.699 10.165 30.350 839 HB2 LEU 123 HB2 LEU 123 -19.509 12.084 29.560 840 HB3 LEU 123 HB3 LEU 123 -20.738 12.509 30.752 841 HG LEU 123 HG LEU 123 -20.099 10.311 31.941 842 HD11 LEU 123 HD11 LEU 123 -17.849 10.588 29.939 843 HD12 LEU 123 HD12 LEU 123 -18.823 9.161 30.300 844 HD13 LEU 123 HD13 LEU 123 -17.629 9.730 31.467 845 HD21 LEU 123 HD21 LEU 123 -19.487 12.504 32.833 846 HD22 LEU 123 HD22 LEU 123 -18.110 12.595 31.736 847 HD23 LEU 123 HD23 LEU 123 -18.127 11.397 33.029 848 H SER 124 H SER 124 -21.012 11.769 27.268 849 HA SER 124 HA SER 124 -23.787 12.379 26.874 850 HB2 SER 124 HB2 SER 124 -23.563 14.790 26.710 851 HB3 SER 124 HB3 SER 124 -23.041 14.291 28.316 852 HG SER 124 HG SER 124 -21.631 15.445 26.279 853 H SER 125 H SER 125 -24.136 13.162 24.661 854 HA SER 125 HA SER 125 -21.776 12.969 22.930 855 HB2 SER 125 HB2 SER 125 -22.768 10.733 22.951 856 HB3 SER 125 HB3 SER 125 -24.344 11.406 22.549 857 HG SER 125 HG SER 125 -23.342 10.702 20.671 858 H ALA 126 H ALA 126 -22.021 14.018 20.906 859 HA ALA 126 HA ALA 126 -24.363 15.817 20.722 860 HB1 ALA 126 HB1 ALA 126 -22.863 17.494 20.928 861 HB2 ALA 126 HB2 ALA 126 -22.329 17.064 19.297 862 HB3 ALA 126 HB3 ALA 126 -21.495 16.404 20.709 863 H LEU 127 H LEU 127 -24.541 16.714 18.385 864 HA LEU 127 HA LEU 127 -23.851 14.647 16.419 865 HB2 LEU 127 HB2 LEU 127 -26.556 15.970 16.764 866 HB3 LEU 127 HB3 LEU 127 -26.102 14.976 15.382 867 HG LEU 127 HG LEU 127 -25.985 13.978 18.244 868 HD11 LEU 127 HD11 LEU 127 -28.160 13.549 16.170 869 HD12 LEU 127 HD12 LEU 127 -28.309 14.595 17.583 870 HD13 LEU 127 HD13 LEU 127 -28.111 12.855 17.791 871 HD21 LEU 127 HD21 LEU 127 -26.050 11.754 17.046 872 HD22 LEU 127 HD22 LEU 127 -24.596 12.694 16.713 873 HD23 LEU 127 HD23 LEU 127 -25.893 12.629 15.522 874 H LEU 128 H LEU 128 -23.558 15.439 14.271 875 HA LEU 128 HA LEU 128 -22.582 18.138 14.150 876 HB2 LEU 128 HB2 LEU 128 -22.819 15.856 12.196 877 HB3 LEU 128 HB3 LEU 128 -22.390 17.470 11.633 878 HG LEU 128 HG LEU 128 -20.566 17.447 13.445 879 HD11 LEU 128 HD11 LEU 128 -19.820 15.080 14.009 880 HD12 LEU 128 HD12 LEU 128 -21.389 14.532 13.419 881 HD13 LEU 128 HD13 LEU 128 -21.297 15.611 14.811 882 HD21 LEU 128 HD21 LEU 128 -20.270 15.333 11.297 883 HD22 LEU 128 HD22 LEU 128 -19.009 16.359 11.979 884 HD23 LEU 128 HD23 LEU 128 -20.253 17.060 10.945 885 H MET 129 H MET 129 -23.402 19.864 12.984 886 HA MET 129 HA MET 129 -26.193 20.189 12.921 887 HB2 MET 129 HB2 MET 129 -24.488 22.030 13.050 888 HB3 MET 129 HB3 MET 129 -24.156 21.771 11.337 889 HG2 MET 129 HG2 MET 129 -26.559 22.205 10.837 890 HG3 MET 129 HG3 MET 129 -26.828 22.551 12.546 891 HE1 MET 129 HE1 MET 129 -25.088 25.740 13.330 892 HE2 MET 129 HE2 MET 129 -24.315 24.171 13.540 893 HE3 MET 129 HE3 MET 129 -26.044 24.338 13.830 894 HA PRO 130 HA PRO 130 -26.976 18.045 9.020 895 HB2 PRO 130 HB2 PRO 130 -29.548 18.800 8.561 896 HB3 PRO 130 HB3 PRO 130 -29.107 17.611 9.803 897 HG2 PRO 130 HG2 PRO 130 -29.718 20.517 10.103 898 HG3 PRO 130 HG3 PRO 130 -30.252 19.146 11.093 899 HD2 PRO 130 HD2 PRO 130 -28.199 20.761 11.848 900 HD3 PRO 130 HD3 PRO 130 -28.254 19.034 12.267 901 H LYS 131 H LYS 131 -27.136 18.480 6.794 902 HA LYS 131 HA LYS 131 -26.137 20.968 5.899 903 HB2 LYS 131 HB2 LYS 131 -25.850 18.774 4.720 904 HB3 LYS 131 HB3 LYS 131 -27.550 18.847 4.260 905 HG2 LYS 131 HG2 LYS 131 -26.345 19.719 2.391 906 HG3 LYS 131 HG3 LYS 131 -27.025 21.122 3.211 907 HD2 LYS 131 HD2 LYS 131 -24.901 21.577 4.307 908 HD3 LYS 131 HD3 LYS 131 -24.207 20.091 3.653 909 HE2 LYS 131 HE2 LYS 131 -23.472 21.971 2.288 910 HE3 LYS 131 HE3 LYS 131 -24.586 20.980 1.349 911 HZ1 LYS 131 HZ1 LYS 131 -26.304 22.509 1.639 912 HZ2 LYS 131 HZ2 LYS 131 -24.944 23.478 1.328 913 HZ3 LYS 131 HZ3 LYS 131 -25.521 23.303 2.917 914 H ASP 132 H ASP 132 -27.122 22.790 5.225 915 HA ASP 132 HA ASP 132 -30.000 23.028 5.587 916 HB2 ASP 132 HB2 ASP 132 -27.922 25.089 4.816 917 HB3 ASP 132 HB3 ASP 132 -29.604 25.429 5.212 918 H GLY 133 H GLY 133 -31.492 23.233 4.015 919 HA2 GLY 133 HA2 GLY 133 -30.686 22.683 1.274 920 HA3 GLY 133 HA3 GLY 133 -32.332 22.727 1.897 921 H LEU 134 H LEU 134 -32.898 23.964 0.020 922 HA LEU 134 HA LEU 134 -33.387 25.903 -1.111 923 HB2 LEU 134 HB2 LEU 134 -32.746 27.016 1.627 924 HB3 LEU 134 HB3 LEU 134 -33.337 28.016 0.304 925 HG LEU 134 HG LEU 134 -34.789 25.530 1.247 926 HD11 LEU 134 HD11 LEU 134 -35.151 28.424 2.081 927 HD12 LEU 134 HD12 LEU 134 -34.698 27.075 3.125 928 HD13 LEU 134 HD13 LEU 134 -36.314 27.142 2.418 929 HD21 LEU 134 HD21 LEU 134 -35.510 27.906 -0.493 930 HD22 LEU 134 HD22 LEU 134 -36.713 26.782 0.139 931 HD23 LEU 134 HD23 LEU 134 -35.464 26.208 -0.964 932 H GLU 135 H GLU 135 -32.417 28.226 -1.580 933 HA GLU 135 HA GLU 135 -29.779 27.783 -2.616 934 HB2 GLU 135 HB2 GLU 135 -31.473 30.294 -2.513 935 HB3 GLU 135 HB3 GLU 135 -29.974 30.122 -3.425 936 HG2 GLU 135 HG2 GLU 135 -32.459 28.424 -3.821 937 HG3 GLU 135 HG3 GLU 135 -31.982 29.768 -4.851 938 H HIS 136 H HIS 136 -27.849 28.681 -1.996 939 HA HIS 136 HA HIS 136 -27.505 29.267 0.773 940 HB2 HIS 136 HB2 HIS 136 -25.138 29.615 0.193 941 HB3 HIS 136 HB3 HIS 136 -25.763 28.130 -0.517 942 HD2 HIS 136 HD2 HIS 136 -25.735 28.069 -3.331 943 HE1 HIS 136 HE1 HIS 136 -24.285 31.992 -3.907 944 HE2 HIS 136 HE2 HIS 136 -24.842 29.802 -5.069 945 H HIS 137 H HIS 137 -28.246 31.254 -1.939 946 HA HIS 137 HA HIS 137 -27.068 33.699 -1.125 947 HB2 HIS 137 HB2 HIS 137 -28.022 33.199 -3.403 948 HB3 HIS 137 HB3 HIS 137 -29.630 33.340 -2.699 949 HD2 HIS 137 HD2 HIS 137 -30.581 35.928 -2.805 950 HE1 HIS 137 HE1 HIS 137 -26.873 37.927 -3.087 951 HE2 HIS 137 HE2 HIS 137 -29.395 38.239 -3.062 952 H HIS 138 H HIS 138 -27.730 35.268 0.248 953 HA HIS 138 HA HIS 138 -28.794 36.226 2.037 954 HB2 HIS 138 HB2 HIS 138 -30.498 36.434 0.076 955 HB3 HIS 138 HB3 HIS 138 -31.386 35.165 0.914 956 HD2 HIS 138 HD2 HIS 138 -30.945 38.971 1.099 957 HE1 HIS 138 HE1 HIS 138 -32.774 37.825 4.724 958 HE2 HIS 138 HE2 HIS 138 -32.150 39.801 3.261 959 H HIS 139 H HIS 139 -27.746 33.697 2.521 960 HA HIS 139 HA HIS 139 -29.755 32.363 4.230 961 HB2 HIS 139 HB2 HIS 139 -28.552 31.017 2.467 962 HB3 HIS 139 HB3 HIS 139 -27.057 31.310 3.352 963 HD2 HIS 139 HD2 HIS 139 -30.212 29.043 3.582 964 HE1 HIS 139 HE1 HIS 139 -27.851 28.268 6.996 965 HE2 HIS 139 HE2 HIS 139 -29.866 27.495 5.656 966 H HIS 140 H HIS 140 -29.704 33.146 6.244 967 HA HIS 140 HA HIS 140 -27.142 33.977 7.426 968 HB2 HIS 140 HB2 HIS 140 -29.167 35.501 7.472 969 HB3 HIS 140 HB3 HIS 140 -29.914 34.347 8.573 970 HD2 HIS 140 HD2 HIS 140 -27.262 37.182 8.659 971 HE1 HIS 140 HE1 HIS 140 -27.269 35.370 12.472 972 HE2 HIS 140 HE2 HIS 140 -26.405 37.338 11.120 973 H HIS 141 H HIS 141 -30.042 32.090 8.309 974 HA HIS 141 HA HIS 141 -28.470 30.654 10.344 975 HB2 HIS 141 HB2 HIS 141 -31.441 30.897 9.839 976 HB3 HIS 141 HB3 HIS 141 -30.753 29.781 11.020 977 HD2 HIS 141 HD2 HIS 141 -29.962 30.973 13.427 978 HE1 HIS 141 HE1 HIS 141 -30.668 34.976 12.290 979 HE2 HIS 141 HE2 HIS 141 -30.056 33.456 14.229
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