NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
603960 | 2ncz | 26041 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H1 SER 1 HT1 SER 1 -12.937 -9.040 -10.725 2 H2 SER 1 HT2 SER 1 -12.975 -10.111 -12.035 3 H3 SER 1 HT3 SER 1 -14.411 -9.454 -11.443 4 HA SER 1 HA SER 1 -12.227 -8.020 -12.811 5 HB2 SER 1 HB2 SER 1 -13.722 -9.330 -14.281 6 HB3 SER 1 HB1 SER 1 -15.111 -8.485 -13.605 7 HG SER 1 HG SER 1 -12.982 -7.369 -15.116 8 H GLU 2 HN GLU 2 -15.560 -7.590 -11.509 9 HA GLU 2 HA GLU 2 -14.997 -4.726 -11.306 10 HB2 GLU 2 HB2 GLU 2 -17.431 -4.488 -10.913 11 HB3 GLU 2 HB1 GLU 2 -17.057 -5.277 -12.438 12 HG2 GLU 2 HG2 GLU 2 -17.630 -7.415 -11.552 13 HG3 GLU 2 HG1 GLU 2 -17.791 -6.755 -9.927 14 H GLU 3 HN GLU 3 -14.765 -7.381 -9.339 15 HA GLU 3 HA GLU 3 -15.948 -6.306 -6.966 16 HB2 GLU 3 HB2 GLU 3 -15.202 -8.242 -5.840 17 HB3 GLU 3 HB1 GLU 3 -15.700 -8.761 -7.445 18 HG2 GLU 3 HG2 GLU 3 -12.881 -8.096 -6.779 19 HG3 GLU 3 HG1 GLU 3 -13.538 -9.713 -6.530 20 H GLU 4 HN GLU 4 -12.970 -5.886 -8.537 21 HA GLU 4 HA GLU 4 -11.585 -5.141 -6.098 22 HB2 GLU 4 HB2 GLU 4 -9.623 -4.763 -7.553 23 HB3 GLU 4 HB1 GLU 4 -10.320 -6.363 -7.767 24 HG2 GLU 4 HG2 GLU 4 -11.431 -5.628 -9.808 25 HG3 GLU 4 HG1 GLU 4 -10.744 -4.018 -9.605 26 H ASP 5 HN ASP 5 -12.820 -3.472 -9.021 27 HA ASP 5 HA ASP 5 -11.828 -0.960 -7.930 28 HB2 ASP 5 HB2 ASP 5 -13.072 -1.615 -10.608 29 HB3 ASP 5 HB1 ASP 5 -12.649 0.024 -10.111 30 H LYS 6 HN LYS 6 -14.706 -2.758 -7.905 31 HA LYS 6 HA LYS 6 -16.205 -0.346 -7.115 32 HB2 LYS 6 HB2 LYS 6 -17.044 -1.460 -9.192 33 HB3 LYS 6 HB1 LYS 6 -17.352 -2.909 -8.247 34 HG2 LYS 6 HG2 LYS 6 -19.086 -1.888 -7.045 35 HG3 LYS 6 HG1 LYS 6 -18.598 -0.271 -7.548 36 HD2 LYS 6 HD2 LYS 6 -20.635 -1.104 -8.701 37 HD3 LYS 6 HD1 LYS 6 -19.321 -0.690 -9.802 38 HE2 LYS 6 HE2 LYS 6 -20.326 -2.752 -10.516 39 HE3 LYS 6 HE1 LYS 6 -18.711 -3.085 -9.902 40 HZ1 LYS 6 HZ1 LYS 6 -21.244 -3.506 -8.415 41 HZ2 LYS 6 HZ2 LYS 6 -19.695 -3.827 -7.823 42 HZ3 LYS 6 HZ3 LYS 6 -20.303 -4.719 -9.129 43 H CYS 7 HN CYS 7 -14.474 -1.796 -5.470 44 HA CYS 7 HA CYS 7 -16.040 -3.556 -3.783 45 HB2 CYS 7 HB2 CYS 7 -13.550 -3.822 -4.323 46 HB3 CYS 7 HB1 CYS 7 -13.280 -2.481 -3.214 47 HG CYS 7 HG CYS 7 -13.950 -3.736 -0.944 48 H LYS 8 HN LYS 8 -16.233 -3.196 -1.474 49 HA LYS 8 HA LYS 8 -16.663 -0.398 -0.767 50 HB2 LYS 8 HB2 LYS 8 -17.518 -3.028 0.378 51 HB3 LYS 8 HB1 LYS 8 -17.477 -1.620 1.422 52 HG2 LYS 8 HG2 LYS 8 -19.695 -1.917 0.581 53 HG3 LYS 8 HG1 LYS 8 -18.998 -0.462 -0.123 54 HD2 LYS 8 HD2 LYS 8 -18.534 -1.656 -2.188 55 HD3 LYS 8 HD1 LYS 8 -19.145 -3.152 -1.480 56 HE2 LYS 8 HE2 LYS 8 -20.726 -0.637 -2.012 57 HE3 LYS 8 HE1 LYS 8 -20.829 -2.150 -2.911 58 HZ1 LYS 8 HZ1 LYS 8 -21.581 -3.233 -0.852 59 HZ2 LYS 8 HZ2 LYS 8 -22.633 -2.010 -1.357 60 HZ3 LYS 8 HZ3 LYS 8 -21.575 -1.734 -0.068 61 HA PRO 9 HA PRO 9 -12.976 0.080 1.568 62 HB2 PRO 9 HB2 PRO 9 -14.384 1.181 3.868 63 HB3 PRO 9 HB1 PRO 9 -13.274 1.971 2.745 64 HG2 PRO 9 HG2 PRO 9 -15.956 2.469 2.809 65 HG3 PRO 9 HG1 PRO 9 -14.951 2.669 1.367 66 HD2 PRO 9 HD2 PRO 9 -16.877 0.515 2.054 67 HD3 PRO 9 HD1 PRO 9 -16.425 1.167 0.468 68 H MET 10 HN MET 10 -11.750 -0.927 3.071 69 HA MET 10 HA MET 10 -12.974 -3.002 4.673 70 HB2 MET 10 HB2 MET 10 -10.645 -3.610 5.241 71 HB3 MET 10 HB1 MET 10 -10.917 -3.544 3.509 72 HG2 MET 10 HG2 MET 10 -9.873 -1.349 3.419 73 HG3 MET 10 HG1 MET 10 -9.601 -1.415 5.157 74 HE1 MET 10 HE1 MET 10 -8.871 -3.187 1.747 75 HE2 MET 10 HE2 MET 10 -9.268 -4.559 2.785 76 HE3 MET 10 HE3 MET 10 -7.619 -4.346 2.196 77 H SER 11 HN SER 11 -12.169 -3.219 6.972 78 HA SER 11 HA SER 11 -13.116 -0.918 8.356 79 HB2 SER 11 HB2 SER 11 -12.768 -2.305 10.392 80 HB3 SER 11 HB1 SER 11 -13.700 -3.131 9.144 81 HG SER 11 HG SER 11 -11.810 -4.250 8.546 82 H TYR 12 HN TYR 12 -11.951 -0.300 10.489 83 HA TYR 12 HA TYR 12 -9.598 1.110 9.839 84 HB2 TYR 12 HB2 TYR 12 -11.271 1.683 11.635 85 HB3 TYR 12 HB1 TYR 12 -10.577 0.389 12.614 86 HD1 TYR 12 HD1 TYR 12 -8.087 0.582 13.202 87 HD2 TYR 12 HD2 TYR 12 -10.369 3.823 11.685 88 HE1 TYR 12 HE1 TYR 12 -6.440 2.158 14.124 89 HE2 TYR 12 HE2 TYR 12 -8.730 5.411 12.596 90 HH TYR 12 HH TYR 12 -5.674 4.411 13.816 91 H GLU 13 HN GLU 13 -10.126 -1.952 11.516 92 HA GLU 13 HA GLU 13 -7.497 -2.431 12.387 93 HB2 GLU 13 HB2 GLU 13 -9.798 -3.732 12.750 94 HB3 GLU 13 HB1 GLU 13 -9.198 -4.700 11.414 95 HG2 GLU 13 HG2 GLU 13 -7.954 -4.329 14.132 96 HG3 GLU 13 HG1 GLU 13 -8.604 -5.801 13.426 97 H GLU 14 HN GLU 14 -9.163 -3.154 9.365 98 HA GLU 14 HA GLU 14 -7.026 -4.685 8.254 99 HB2 GLU 14 HB2 GLU 14 -9.487 -3.460 7.009 100 HB3 GLU 14 HB1 GLU 14 -8.364 -4.493 6.135 101 HG2 GLU 14 HG2 GLU 14 -8.908 -6.372 7.443 102 HG3 GLU 14 HG1 GLU 14 -9.739 -5.386 8.650 103 H LYS 15 HN LYS 15 -8.204 -1.369 7.723 104 HA LYS 15 HA LYS 15 -6.358 -0.568 5.805 105 HB2 LYS 15 HB2 LYS 15 -7.739 0.961 8.006 106 HB3 LYS 15 HB1 LYS 15 -6.697 1.743 6.830 107 HG2 LYS 15 HG2 LYS 15 -8.141 1.232 5.043 108 HG3 LYS 15 HG1 LYS 15 -9.050 0.080 6.028 109 HD2 LYS 15 HD2 LYS 15 -10.343 1.674 6.922 110 HD3 LYS 15 HD1 LYS 15 -8.987 2.776 7.162 111 HE2 LYS 15 HE2 LYS 15 -9.073 3.375 4.787 112 HE3 LYS 15 HE1 LYS 15 -10.441 2.283 4.559 113 HZ1 LYS 15 HZ1 LYS 15 -10.407 4.640 6.381 114 HZ2 LYS 15 HZ2 LYS 15 -11.734 3.630 6.074 115 HZ3 LYS 15 HZ3 LYS 15 -11.119 4.609 4.841 116 H ARG 16 HN ARG 16 -6.114 -0.522 9.330 117 HA ARG 16 HA ARG 16 -3.538 0.635 9.453 118 HB2 ARG 16 HB2 ARG 16 -5.141 0.558 11.342 119 HB3 ARG 16 HB1 ARG 16 -4.886 -1.179 11.464 120 HG2 ARG 16 HG2 ARG 16 -2.371 -0.456 11.696 121 HG3 ARG 16 HG1 ARG 16 -3.099 1.061 12.225 122 HD2 ARG 16 HD2 ARG 16 -2.672 -0.408 14.127 123 HD3 ARG 16 HD1 ARG 16 -4.398 -0.135 13.900 124 HE ARG 16 HE ARG 16 -4.568 -2.350 12.964 125 HH11 ARG 16 HH11 ARG 16 -1.593 -1.623 14.664 126 HH12 ARG 16 HH12 ARG 16 -1.202 -3.288 14.943 127 HH21 ARG 16 HH21 ARG 16 -4.077 -4.527 13.336 128 HH22 ARG 16 HH22 ARG 16 -2.614 -4.944 14.185 129 H GLN 17 HN GLN 17 -4.609 -2.762 9.490 130 HA GLN 17 HA GLN 17 -2.025 -3.841 9.755 131 HB2 GLN 17 HB2 GLN 17 -4.118 -5.096 10.210 132 HB3 GLN 17 HB1 GLN 17 -4.431 -5.129 8.480 133 HG2 GLN 17 HG2 GLN 17 -3.482 -7.225 9.162 134 HG3 GLN 17 HG1 GLN 17 -2.333 -6.356 8.146 135 HE21 GLN 17 HE21 GLN 17 -0.559 -7.428 8.925 136 HE22 GLN 17 HE22 GLN 17 0.063 -7.178 10.521 137 H LEU 18 HN LEU 18 -3.822 -2.657 7.069 138 HA LEU 18 HA LEU 18 -2.246 -3.784 4.984 139 HB2 LEU 18 HB2 LEU 18 -4.598 -2.446 5.098 140 HB3 LEU 18 HB1 LEU 18 -3.541 -1.147 4.597 141 HG LEU 18 HG LEU 18 -3.831 -3.753 3.103 142 HD11 LEU 18 HD11 LEU 18 -5.091 -1.078 2.558 143 HD12 LEU 18 HD12 LEU 18 -5.933 -2.519 3.119 144 HD13 LEU 18 HD13 LEU 18 -5.189 -2.495 1.520 145 HD21 LEU 18 HD21 LEU 18 -1.764 -2.795 2.519 146 HD22 LEU 18 HD22 LEU 18 -2.432 -1.168 2.496 147 HD23 LEU 18 HD23 LEU 18 -2.878 -2.324 1.244 148 H SER 19 HN SER 19 -2.132 -0.782 6.827 149 HA SER 19 HA SER 19 0.077 0.353 5.496 150 HB2 SER 19 HB2 SER 19 -0.600 0.610 8.442 151 HB3 SER 19 HB1 SER 19 0.326 1.750 7.468 152 HG SER 19 HG SER 19 -2.259 1.110 6.622 153 H LEU 20 HN LEU 20 -0.258 -2.100 7.908 154 HA LEU 20 HA LEU 20 2.521 -2.211 8.587 155 HB2 LEU 20 HB2 LEU 20 0.148 -3.905 9.265 156 HB3 LEU 20 HB1 LEU 20 1.762 -4.286 9.825 157 HG LEU 20 HG LEU 20 0.203 -1.785 10.448 158 HD11 LEU 20 HD11 LEU 20 -0.444 -3.932 11.544 159 HD12 LEU 20 HD12 LEU 20 0.028 -2.634 12.642 160 HD13 LEU 20 HD13 LEU 20 1.150 -3.954 12.297 161 HD21 LEU 20 HD21 LEU 20 3.050 -2.557 10.956 162 HD22 LEU 20 HD22 LEU 20 2.189 -1.506 12.078 163 HD23 LEU 20 HD23 LEU 20 2.387 -1.022 10.395 164 H ASP 21 HN ASP 21 0.393 -3.870 6.344 165 HA ASP 21 HA ASP 21 2.227 -6.037 5.930 166 HB2 ASP 21 HB2 ASP 21 0.677 -6.796 4.193 167 HB3 ASP 21 HB1 ASP 21 -0.139 -6.464 5.708 168 H ILE 22 HN ILE 22 1.545 -2.993 4.298 169 HA ILE 22 HA ILE 22 3.298 -3.485 2.101 170 HB ILE 22 HB ILE 22 2.351 -0.881 3.311 171 HG12 ILE 22 HG12 ILE 22 1.477 -2.149 0.721 172 HG13 ILE 22 HG11 ILE 22 0.704 -2.568 2.252 173 HG21 ILE 22 HG21 ILE 22 4.293 -0.289 2.152 174 HG22 ILE 22 HG22 ILE 22 2.968 0.034 1.027 175 HG23 ILE 22 HG23 ILE 22 3.951 -1.418 0.838 176 HD11 ILE 22 HD11 ILE 22 0.063 -0.296 2.572 177 HD12 ILE 22 HD12 ILE 22 -0.510 -0.851 1.006 178 HD13 ILE 22 HD13 ILE 22 0.902 0.205 1.112 179 H ASN 23 HN ASN 23 3.675 -2.180 5.316 180 HA ASN 23 HA ASN 23 6.306 -1.260 5.179 181 HB2 ASN 23 HB2 ASN 23 4.962 -0.732 7.077 182 HB3 ASN 23 HB1 ASN 23 4.658 -2.427 7.416 183 HD21 ASN 23 HD21 ASN 23 6.804 0.220 7.789 184 HD22 ASN 23 HD22 ASN 23 7.938 -0.553 8.836 185 H LYS 24 HN LYS 24 5.018 -4.451 5.108 186 HA LYS 24 HA LYS 24 7.409 -5.763 6.066 187 HB2 LYS 24 HB2 LYS 24 4.787 -6.752 4.974 188 HB3 LYS 24 HB1 LYS 24 6.117 -7.845 5.344 189 HG2 LYS 24 HG2 LYS 24 6.091 -7.127 7.654 190 HG3 LYS 24 HG1 LYS 24 4.825 -5.952 7.296 191 HD2 LYS 24 HD2 LYS 24 3.333 -7.790 6.645 192 HD3 LYS 24 HD1 LYS 24 4.599 -8.949 7.061 193 HE2 LYS 24 HE2 LYS 24 3.267 -7.006 8.945 194 HE3 LYS 24 HE1 LYS 24 2.998 -8.748 8.880 195 HZ1 LYS 24 HZ1 LYS 24 5.551 -7.396 9.586 196 HZ2 LYS 24 HZ2 LYS 24 5.343 -9.068 9.462 197 HZ3 LYS 24 HZ3 LYS 24 4.518 -8.201 10.657 198 H LEU 25 HN LEU 25 6.067 -4.846 3.003 199 HA LEU 25 HA LEU 25 7.462 -6.674 1.368 200 HB2 LEU 25 HB2 LEU 25 6.539 -3.890 0.726 201 HB3 LEU 25 HB1 LEU 25 6.995 -5.092 -0.448 202 HG LEU 25 HG LEU 25 4.569 -5.034 1.305 203 HD11 LEU 25 HD11 LEU 25 5.022 -5.246 -1.652 204 HD12 LEU 25 HD12 LEU 25 4.447 -3.829 -0.782 205 HD13 LEU 25 HD13 LEU 25 3.449 -5.280 -0.864 206 HD21 LEU 25 HD21 LEU 25 5.719 -7.318 -0.231 207 HD22 LEU 25 HD22 LEU 25 4.045 -7.259 0.305 208 HD23 LEU 25 HD23 LEU 25 5.355 -7.271 1.488 209 HA PRO 26 HA PRO 26 11.667 -5.051 1.640 210 HB2 PRO 26 HB2 PRO 26 11.859 -6.532 -0.935 211 HB3 PRO 26 HB1 PRO 26 12.887 -6.634 0.500 212 HG2 PRO 26 HG2 PRO 26 11.149 -8.571 -0.088 213 HG3 PRO 26 HG1 PRO 26 11.444 -8.082 1.590 214 HD2 PRO 26 HD2 PRO 26 9.128 -7.461 -0.195 215 HD3 PRO 26 HD1 PRO 26 9.157 -7.794 1.551 216 H GLY 27 HN GLY 27 12.840 -3.468 0.472 217 HA2 GLY 27 HA2 GLY 27 11.488 -1.380 -0.567 218 HA3 GLY 27 HA1 GLY 27 13.154 -1.713 -0.993 219 H GLU 28 HN GLU 28 12.933 -3.917 -2.585 220 HA GLU 28 HA GLU 28 12.263 -2.967 -5.083 221 HB2 GLU 28 HB2 GLU 28 13.679 -4.910 -4.824 222 HB3 GLU 28 HB1 GLU 28 12.409 -5.791 -4.014 223 HG2 GLU 28 HG2 GLU 28 11.129 -5.650 -6.209 224 HG3 GLU 28 HG1 GLU 28 12.670 -5.173 -6.907 225 H LYS 29 HN LYS 29 10.345 -5.279 -3.181 226 HA LYS 29 HA LYS 29 8.095 -5.250 -4.893 227 HB2 LYS 29 HB2 LYS 29 8.512 -6.097 -2.032 228 HB3 LYS 29 HB1 LYS 29 6.983 -6.321 -2.875 229 HG2 LYS 29 HG2 LYS 29 9.611 -7.467 -3.795 230 HG3 LYS 29 HG1 LYS 29 8.422 -8.344 -2.826 231 HD2 LYS 29 HD2 LYS 29 6.753 -7.850 -4.643 232 HD3 LYS 29 HD1 LYS 29 8.098 -7.285 -5.631 233 HE2 LYS 29 HE2 LYS 29 7.701 -9.531 -6.264 234 HE3 LYS 29 HE1 LYS 29 9.160 -9.549 -5.277 235 HZ1 LYS 29 HZ1 LYS 29 6.424 -10.292 -4.407 236 HZ2 LYS 29 HZ2 LYS 29 7.769 -10.220 -3.382 237 HZ3 LYS 29 HZ3 LYS 29 7.727 -11.343 -4.645 238 H LEU 30 HN LEU 30 9.032 -3.460 -2.091 239 HA LEU 30 HA LEU 30 6.596 -2.233 -1.387 240 HB2 LEU 30 HB2 LEU 30 8.561 -2.306 0.049 241 HB3 LEU 30 HB1 LEU 30 9.463 -1.325 -1.089 242 HG LEU 30 HG LEU 30 8.263 0.617 -0.539 243 HD11 LEU 30 HD11 LEU 30 6.369 -0.781 1.277 244 HD12 LEU 30 HD12 LEU 30 6.039 -0.767 -0.447 245 HD13 LEU 30 HD13 LEU 30 6.193 0.748 0.430 246 HD21 LEU 30 HD21 LEU 30 8.507 0.725 1.917 247 HD22 LEU 30 HD22 LEU 30 9.895 -0.023 1.126 248 HD23 LEU 30 HD23 LEU 30 8.701 -1.027 1.950 249 H GLY 31 HN GLY 31 9.096 -1.254 -3.709 250 HA2 GLY 31 HA2 GLY 31 8.266 1.358 -4.193 251 HA3 GLY 31 HA1 GLY 31 9.071 0.342 -5.369 252 H ARG 32 HN ARG 32 6.820 -1.626 -5.319 253 HA ARG 32 HA ARG 32 5.243 -0.517 -7.388 254 HB2 ARG 32 HB2 ARG 32 5.508 -2.908 -7.269 255 HB3 ARG 32 HB1 ARG 32 4.824 -2.946 -5.653 256 HG2 ARG 32 HG2 ARG 32 3.197 -3.767 -7.246 257 HG3 ARG 32 HG1 ARG 32 2.654 -2.233 -6.578 258 HD2 ARG 32 HD2 ARG 32 2.250 -2.266 -8.964 259 HD3 ARG 32 HD1 ARG 32 3.485 -1.071 -8.579 260 HE ARG 32 HE ARG 32 5.081 -2.986 -9.226 261 HH11 ARG 32 HH11 ARG 32 1.966 -2.376 -10.705 262 HH12 ARG 32 HH12 ARG 32 2.440 -3.000 -12.251 263 HH21 ARG 32 HH21 ARG 32 5.703 -3.807 -11.246 264 HH22 ARG 32 HH22 ARG 32 4.567 -3.832 -12.557 265 H VAL 33 HN VAL 33 4.585 -1.038 -3.937 266 HA VAL 33 HA VAL 33 1.843 -0.276 -4.095 267 HB VAL 33 HB VAL 33 3.155 0.156 -1.496 268 HG11 VAL 33 HG11 VAL 33 0.847 -1.561 -2.402 269 HG12 VAL 33 HG12 VAL 33 0.735 0.122 -1.880 270 HG13 VAL 33 HG13 VAL 33 1.243 -1.115 -0.741 271 HG21 VAL 33 HG21 VAL 33 4.571 -1.644 -2.136 272 HG22 VAL 33 HG22 VAL 33 3.229 -2.525 -2.868 273 HG23 VAL 33 HG23 VAL 33 3.305 -2.330 -1.117 274 H VAL 34 HN VAL 34 4.731 1.475 -2.976 275 HA VAL 34 HA VAL 34 3.566 3.921 -2.391 276 HB VAL 34 HB VAL 34 5.724 4.389 -1.997 277 HG11 VAL 34 HG11 VAL 34 6.170 2.015 -2.203 278 HG12 VAL 34 HG12 VAL 34 7.549 2.995 -2.700 279 HG13 VAL 34 HG13 VAL 34 6.520 2.232 -3.914 280 HG21 VAL 34 HG21 VAL 34 5.588 5.816 -3.965 281 HG22 VAL 34 HG22 VAL 34 6.085 4.475 -4.990 282 HG23 VAL 34 HG23 VAL 34 7.205 5.139 -3.802 283 H HIS 35 HN HIS 35 4.479 2.571 -5.490 284 HA HIS 35 HA HIS 35 3.721 4.823 -7.048 285 HB2 HIS 35 HB2 HIS 35 5.277 3.090 -7.862 286 HB3 HIS 35 HB1 HIS 35 3.944 1.938 -7.897 287 HD1 HIS 35 HD1 HIS 35 5.062 5.152 -9.561 288 HD2 HIS 35 HD2 HIS 35 2.440 1.993 -10.202 289 HE1 HIS 35 HE1 HIS 35 4.177 5.472 -11.888 290 HE2 HIS 35 HE2 HIS 35 2.481 3.639 -12.196 291 H ILE 36 HN ILE 36 2.027 1.834 -6.132 292 HA ILE 36 HA ILE 36 -0.239 2.136 -7.719 293 HB ILE 36 HB ILE 36 -0.189 0.929 -4.945 294 HG12 ILE 36 HG12 ILE 36 0.256 -0.271 -7.681 295 HG13 ILE 36 HG11 ILE 36 1.390 -0.228 -6.345 296 HG21 ILE 36 HG21 ILE 36 -2.398 0.678 -5.194 297 HG22 ILE 36 HG22 ILE 36 -2.097 -0.291 -6.636 298 HG23 ILE 36 HG23 ILE 36 -2.323 1.450 -6.778 299 HD11 ILE 36 HD11 ILE 36 -0.189 -1.694 -5.075 300 HD12 ILE 36 HD12 ILE 36 0.537 -2.433 -6.500 301 HD13 ILE 36 HD13 ILE 36 -1.124 -1.851 -6.559 302 H ILE 37 HN ILE 37 0.205 3.218 -4.334 303 HA ILE 37 HA ILE 37 -2.325 4.403 -4.112 304 HB ILE 37 HB ILE 37 0.182 5.237 -2.648 305 HG12 ILE 37 HG12 ILE 37 -1.576 3.839 -0.957 306 HG13 ILE 37 HG11 ILE 37 -1.510 2.896 -2.441 307 HG21 ILE 37 HG21 ILE 37 -2.027 6.683 -2.806 308 HG22 ILE 37 HG22 ILE 37 -1.104 6.556 -1.306 309 HG23 ILE 37 HG23 ILE 37 -2.551 5.571 -1.541 310 HD11 ILE 37 HD11 ILE 37 0.853 2.684 -2.274 311 HD12 ILE 37 HD12 ILE 37 0.134 2.216 -0.732 312 HD13 ILE 37 HD13 ILE 37 0.902 3.791 -0.909 313 H GLN 38 HN GLN 38 0.799 5.883 -4.913 314 HA GLN 38 HA GLN 38 -0.081 8.490 -5.319 315 HB2 GLN 38 HB2 GLN 38 2.194 6.948 -6.547 316 HB3 GLN 38 HB1 GLN 38 1.937 8.651 -6.896 317 HG2 GLN 38 HG2 GLN 38 1.884 8.571 -4.133 318 HG3 GLN 38 HG1 GLN 38 3.092 7.362 -4.551 319 HE21 GLN 38 HE21 GLN 38 4.711 8.675 -3.653 320 HE22 GLN 38 HE22 GLN 38 5.315 10.063 -4.487 321 H SER 39 HN SER 39 -0.259 5.729 -7.464 322 HA SER 39 HA SER 39 -0.986 7.269 -9.773 323 HB2 SER 39 HB2 SER 39 0.122 5.153 -10.106 324 HB3 SER 39 HB1 SER 39 -1.124 4.304 -9.194 325 HG SER 39 HG SER 39 -1.752 5.780 -11.520 326 H ARG 40 HN ARG 40 -2.744 5.585 -7.225 327 HA ARG 40 HA ARG 40 -5.261 5.878 -8.659 328 HB2 ARG 40 HB2 ARG 40 -4.829 4.814 -5.888 329 HB3 ARG 40 HB1 ARG 40 -6.253 4.598 -6.894 330 HG2 ARG 40 HG2 ARG 40 -4.561 3.440 -8.526 331 HG3 ARG 40 HG1 ARG 40 -3.596 3.260 -7.057 332 HD2 ARG 40 HD2 ARG 40 -4.916 1.295 -7.358 333 HD3 ARG 40 HD1 ARG 40 -5.494 2.203 -5.969 334 HE ARG 40 HE ARG 40 -7.195 3.099 -7.724 335 HH11 ARG 40 HH11 ARG 40 -5.981 -0.171 -7.452 336 HH12 ARG 40 HH12 ARG 40 -7.397 -0.895 -8.135 337 HH21 ARG 40 HH21 ARG 40 -9.058 2.156 -8.635 338 HH22 ARG 40 HH22 ARG 40 -9.153 0.429 -8.830 339 H GLU 41 HN GLU 41 -3.554 7.302 -5.982 340 HA GLU 41 HA GLU 41 -5.841 9.075 -5.458 341 HB2 GLU 41 HB2 GLU 41 -3.473 8.492 -3.701 342 HB3 GLU 41 HB1 GLU 41 -4.847 9.492 -3.275 343 HG2 GLU 41 HG2 GLU 41 -4.831 6.522 -3.746 344 HG3 GLU 41 HG1 GLU 41 -5.054 7.362 -2.215 345 HA PRO 42 HA PRO 42 -2.871 11.804 -7.936 346 HB2 PRO 42 HB2 PRO 42 -5.369 13.382 -7.769 347 HB3 PRO 42 HB1 PRO 42 -4.320 13.061 -9.151 348 HG2 PRO 42 HG2 PRO 42 -6.736 11.778 -8.613 349 HG3 PRO 42 HG1 PRO 42 -5.493 11.250 -9.738 350 HD2 PRO 42 HD2 PRO 42 -6.313 9.953 -7.352 351 HD3 PRO 42 HD1 PRO 42 -5.008 9.488 -8.442 352 H SER 43 HN SER 43 -4.968 12.508 -5.156 353 HA SER 43 HA SER 43 -4.082 15.112 -4.675 354 HB2 SER 43 HB2 SER 43 -5.195 13.122 -2.693 355 HB3 SER 43 HB1 SER 43 -5.174 14.878 -2.515 356 HG SER 43 HG SER 43 -7.136 13.632 -3.438 357 H LEU 44 HN LEU 44 -2.539 12.094 -4.023 358 HA LEU 44 HA LEU 44 -0.628 13.520 -2.299 359 HB2 LEU 44 HB2 LEU 44 -0.049 11.328 -1.307 360 HB3 LEU 44 HB1 LEU 44 -1.685 11.847 -0.982 361 HG LEU 44 HG LEU 44 -2.215 10.306 -3.074 362 HD11 LEU 44 HD11 LEU 44 0.199 9.817 -3.432 363 HD12 LEU 44 HD12 LEU 44 -0.804 8.384 -3.204 364 HD13 LEU 44 HD13 LEU 44 0.207 8.972 -1.884 365 HD21 LEU 44 HD21 LEU 44 -3.160 10.071 -0.841 366 HD22 LEU 44 HD22 LEU 44 -1.679 9.292 -0.284 367 HD23 LEU 44 HD23 LEU 44 -2.691 8.501 -1.492 368 H LYS 45 HN LYS 45 -0.849 12.851 -5.354 369 HA LYS 45 HA LYS 45 1.591 11.390 -5.795 370 HB2 LYS 45 HB2 LYS 45 1.267 11.733 -8.111 371 HB3 LYS 45 HB1 LYS 45 -0.346 11.542 -7.450 372 HG2 LYS 45 HG2 LYS 45 -0.577 14.007 -7.466 373 HG3 LYS 45 HG1 LYS 45 0.995 14.101 -8.266 374 HD2 LYS 45 HD2 LYS 45 -0.042 12.457 -9.970 375 HD3 LYS 45 HD1 LYS 45 -1.585 12.994 -9.300 376 HE2 LYS 45 HE2 LYS 45 -1.006 15.307 -9.806 377 HE3 LYS 45 HE1 LYS 45 0.549 14.774 -10.444 378 HZ1 LYS 45 HZ1 LYS 45 -2.125 14.107 -11.550 379 HZ2 LYS 45 HZ2 LYS 45 -0.661 13.498 -12.134 380 HZ3 LYS 45 HZ3 LYS 45 -0.987 15.153 -12.237 381 H ASN 46 HN ASN 46 0.940 14.389 -4.661 382 HA ASN 46 HA ASN 46 3.227 15.766 -5.748 383 HB2 ASN 46 HB2 ASN 46 2.622 17.500 -4.015 384 HB3 ASN 46 HB1 ASN 46 1.357 17.145 -5.184 385 HD21 ASN 46 HD21 ASN 46 -0.270 17.867 -3.840 386 HD22 ASN 46 HD22 ASN 46 -0.780 16.991 -2.441 387 H SER 47 HN SER 47 2.755 13.405 -3.439 388 HA SER 47 HA SER 47 4.643 14.231 -1.475 389 HB2 SER 47 HB2 SER 47 3.807 11.376 -2.064 390 HB3 SER 47 HB1 SER 47 4.384 12.050 -0.539 391 HG SER 47 HG SER 47 1.871 12.157 -1.698 392 H ASN 48 HN ASN 48 6.823 13.865 -1.370 393 HA ASN 48 HA ASN 48 8.306 13.207 -3.670 394 HB2 ASN 48 HB2 ASN 48 9.202 12.979 -0.780 395 HB3 ASN 48 HB1 ASN 48 10.252 13.084 -2.188 396 HD21 ASN 48 HD21 ASN 48 10.144 14.765 0.142 397 HD22 ASN 48 HD22 ASN 48 9.844 16.369 -0.436 398 HA PRO 49 HA PRO 49 7.527 8.892 -3.832 399 HB2 PRO 49 HB2 PRO 49 9.749 8.110 -5.245 400 HB3 PRO 49 HB1 PRO 49 8.301 8.813 -5.965 401 HG2 PRO 49 HG2 PRO 49 10.894 10.122 -5.246 402 HG3 PRO 49 HG1 PRO 49 9.885 10.353 -6.689 403 HD2 PRO 49 HD2 PRO 49 9.876 12.121 -4.673 404 HD3 PRO 49 HD1 PRO 49 8.394 11.740 -5.574 405 H ASP 50 HN ASP 50 10.467 10.148 -2.474 406 HA ASP 50 HA ASP 50 11.357 7.597 -1.482 407 HB2 ASP 50 HB2 ASP 50 12.345 10.273 -0.512 408 HB3 ASP 50 HB1 ASP 50 13.205 8.743 -0.550 409 H GLU 51 HN GLU 51 9.442 10.265 -0.357 410 HA GLU 51 HA GLU 51 9.011 8.950 2.238 411 HB2 GLU 51 HB2 GLU 51 9.784 11.798 1.650 412 HB3 GLU 51 HB1 GLU 51 8.756 11.476 3.039 413 HG2 GLU 51 HG2 GLU 51 11.361 10.073 2.609 414 HG3 GLU 51 HG1 GLU 51 11.262 11.632 3.416 415 H ILE 52 HN ILE 52 7.144 8.225 0.773 416 HA ILE 52 HA ILE 52 5.406 10.265 -0.218 417 HB ILE 52 HB ILE 52 4.156 8.598 -1.259 418 HG12 ILE 52 HG12 ILE 52 5.385 6.439 0.388 419 HG13 ILE 52 HG11 ILE 52 3.922 7.272 0.917 420 HG21 ILE 52 HG21 ILE 52 6.821 7.244 -1.043 421 HG22 ILE 52 HG22 ILE 52 6.600 8.757 -1.936 422 HG23 ILE 52 HG23 ILE 52 5.728 7.306 -2.433 423 HD11 ILE 52 HD11 ILE 52 2.836 6.633 -1.184 424 HD12 ILE 52 HD12 ILE 52 3.353 5.234 -0.239 425 HD13 ILE 52 HD13 ILE 52 4.287 5.743 -1.644 426 H GLU 53 HN GLU 53 3.412 10.853 0.469 427 HA GLU 53 HA GLU 53 2.865 10.262 3.278 428 HB2 GLU 53 HB2 GLU 53 3.065 12.634 1.985 429 HB3 GLU 53 HB1 GLU 53 1.348 12.341 1.788 430 HG2 GLU 53 HG2 GLU 53 2.913 12.757 4.301 431 HG3 GLU 53 HG1 GLU 53 1.519 13.649 3.704 432 H ILE 54 HN ILE 54 1.503 8.534 3.434 433 HA ILE 54 HA ILE 54 -0.744 8.329 1.530 434 HB ILE 54 HB ILE 54 0.339 6.245 3.431 435 HG12 ILE 54 HG12 ILE 54 0.403 6.292 0.413 436 HG13 ILE 54 HG11 ILE 54 1.769 6.748 1.432 437 HG21 ILE 54 HG21 ILE 54 -1.196 4.733 2.184 438 HG22 ILE 54 HG22 ILE 54 -1.899 6.152 1.420 439 HG23 ILE 54 HG23 ILE 54 -2.019 5.939 3.167 440 HD11 ILE 54 HD11 ILE 54 1.843 4.429 0.544 441 HD12 ILE 54 HD12 ILE 54 0.429 4.061 1.528 442 HD13 ILE 54 HD13 ILE 54 1.941 4.541 2.296 443 H ASP 55 HN ASP 55 -2.814 8.584 2.221 444 HA ASP 55 HA ASP 55 -3.191 8.747 5.136 445 HB2 ASP 55 HB2 ASP 55 -3.383 10.959 3.816 446 HB3 ASP 55 HB1 ASP 55 -4.890 10.290 3.192 447 H PHE 56 HN PHE 56 -3.968 6.800 5.566 448 HA PHE 56 HA PHE 56 -5.270 5.218 3.664 449 HB2 PHE 56 HB2 PHE 56 -4.393 4.933 6.417 450 HB3 PHE 56 HB1 PHE 56 -5.855 4.010 6.064 451 HD1 PHE 56 HD1 PHE 56 -2.330 4.522 5.090 452 HD2 PHE 56 HD2 PHE 56 -5.811 2.134 4.654 453 HE1 PHE 56 HE1 PHE 56 -1.012 2.809 3.909 454 HE2 PHE 56 HE2 PHE 56 -4.517 0.427 3.485 455 HZ PHE 56 HZ PHE 56 -2.110 0.742 3.111 456 H GLU 57 HN GLU 57 -6.583 7.657 5.601 457 HA GLU 57 HA GLU 57 -9.233 6.475 5.654 458 HB2 GLU 57 HB2 GLU 57 -8.123 9.058 6.710 459 HB3 GLU 57 HB1 GLU 57 -9.822 8.618 6.829 460 HG2 GLU 57 HG2 GLU 57 -7.565 6.979 7.946 461 HG3 GLU 57 HG1 GLU 57 -8.491 8.158 8.876 462 H THR 58 HN THR 58 -7.460 8.018 3.379 463 HA THR 58 HA THR 58 -9.856 9.280 2.221 464 HB THR 58 HB THR 58 -8.338 10.819 1.005 465 HG1 THR 58 HG1 THR 58 -6.393 9.502 2.618 466 HG21 THR 58 HG21 THR 58 -8.202 10.803 4.016 467 HG22 THR 58 HG22 THR 58 -9.393 11.623 3.001 468 HG23 THR 58 HG23 THR 58 -7.716 12.174 3.015 469 H LEU 59 HN LEU 59 -7.420 6.923 1.802 470 HA LEU 59 HA LEU 59 -7.251 6.820 -1.011 471 HB2 LEU 59 HB2 LEU 59 -7.199 4.282 0.567 472 HB3 LEU 59 HB1 LEU 59 -6.225 4.760 -0.801 473 HG LEU 59 HG LEU 59 -5.904 5.690 2.041 474 HD11 LEU 59 HD11 LEU 59 -4.349 3.835 0.262 475 HD12 LEU 59 HD12 LEU 59 -5.014 3.537 1.868 476 HD13 LEU 59 HD13 LEU 59 -3.629 4.610 1.675 477 HD21 LEU 59 HD21 LEU 59 -4.606 6.637 -0.486 478 HD22 LEU 59 HD22 LEU 59 -3.788 6.752 1.063 479 HD23 LEU 59 HD23 LEU 59 -5.322 7.581 0.811 480 H LYS 60 HN LYS 60 -8.502 5.833 -2.533 481 HA LYS 60 HA LYS 60 -11.238 5.340 -2.036 482 HB2 LYS 60 HB2 LYS 60 -9.512 4.414 -4.348 483 HB3 LYS 60 HB1 LYS 60 -11.271 4.515 -4.353 484 HG2 LYS 60 HG2 LYS 60 -11.131 6.942 -4.105 485 HG3 LYS 60 HG1 LYS 60 -9.367 6.845 -4.075 486 HD2 LYS 60 HD2 LYS 60 -9.431 5.850 -6.339 487 HD3 LYS 60 HD1 LYS 60 -11.179 6.097 -6.367 488 HE2 LYS 60 HE2 LYS 60 -10.059 7.907 -7.530 489 HE3 LYS 60 HE1 LYS 60 -10.829 8.509 -6.065 490 HZ1 LYS 60 HZ1 LYS 60 -7.939 7.929 -6.444 491 HZ2 LYS 60 HZ2 LYS 60 -8.633 8.356 -4.960 492 HZ3 LYS 60 HZ3 LYS 60 -8.653 9.451 -6.250 493 HA PRO 61 HA PRO 61 -11.444 1.248 -0.419 494 HB2 PRO 61 HB2 PRO 61 -13.538 0.659 -2.430 495 HB3 PRO 61 HB1 PRO 61 -13.623 0.581 -0.670 496 HG2 PRO 61 HG2 PRO 61 -14.816 2.536 -2.095 497 HG3 PRO 61 HG1 PRO 61 -14.177 2.809 -0.468 498 HD2 PRO 61 HD2 PRO 61 -13.098 3.665 -3.098 499 HD3 PRO 61 HD1 PRO 61 -12.936 4.428 -1.504 500 H SER 62 HN SER 62 -11.440 1.648 -3.909 501 HA SER 62 HA SER 62 -10.669 -1.038 -4.483 502 HB2 SER 62 HB2 SER 62 -10.141 0.016 -6.767 503 HB3 SER 62 HB1 SER 62 -11.814 0.103 -6.214 504 HG SER 62 HG SER 62 -10.935 2.115 -7.042 505 H THR 63 HN THR 63 -8.972 2.014 -3.993 506 HA THR 63 HA THR 63 -6.396 1.202 -4.723 507 HB THR 63 HB THR 63 -6.957 3.098 -2.419 508 HG1 THR 63 HG1 THR 63 -7.199 4.724 -4.036 509 HG21 THR 63 HG21 THR 63 -4.602 2.445 -2.973 510 HG22 THR 63 HG22 THR 63 -4.933 4.168 -3.084 511 HG23 THR 63 HG23 THR 63 -4.822 3.196 -4.548 512 H LEU 64 HN LEU 64 -8.054 1.109 -1.593 513 HA LEU 64 HA LEU 64 -6.040 -0.106 -0.095 514 HB2 LEU 64 HB2 LEU 64 -9.043 -0.266 0.137 515 HB3 LEU 64 HB1 LEU 64 -7.958 -0.963 1.323 516 HG LEU 64 HG LEU 64 -8.038 1.967 0.614 517 HD11 LEU 64 HD11 LEU 64 -10.115 1.316 1.712 518 HD12 LEU 64 HD12 LEU 64 -9.107 2.261 2.801 519 HD13 LEU 64 HD13 LEU 64 -9.199 0.512 2.983 520 HD21 LEU 64 HD21 LEU 64 -5.888 1.360 1.423 521 HD22 LEU 64 HD22 LEU 64 -6.590 0.407 2.726 522 HD23 LEU 64 HD23 LEU 64 -6.752 2.162 2.732 523 H ARG 65 HN ARG 65 -8.482 -1.557 -2.186 524 HA ARG 65 HA ARG 65 -7.771 -4.212 -1.326 525 HB2 ARG 65 HB2 ARG 65 -9.905 -3.008 -2.878 526 HB3 ARG 65 HB1 ARG 65 -9.345 -4.499 -3.602 527 HG2 ARG 65 HG2 ARG 65 -10.329 -4.141 -0.782 528 HG3 ARG 65 HG1 ARG 65 -11.177 -4.964 -2.097 529 HD2 ARG 65 HD2 ARG 65 -8.469 -5.852 -1.088 530 HD3 ARG 65 HD1 ARG 65 -9.979 -6.442 -0.451 531 HE ARG 65 HE ARG 65 -10.211 -6.799 -3.147 532 HH11 ARG 65 HH11 ARG 65 -7.945 -7.859 -0.685 533 HH12 ARG 65 HH12 ARG 65 -7.574 -9.347 -1.511 534 HH21 ARG 65 HH21 ARG 65 -9.711 -8.747 -4.220 535 HH22 ARG 65 HH22 ARG 65 -8.573 -9.849 -3.508 536 H GLU 66 HN GLU 66 -6.603 -2.028 -3.660 537 HA GLU 66 HA GLU 66 -5.351 -4.096 -5.244 538 HB2 GLU 66 HB2 GLU 66 -6.010 -2.072 -6.359 539 HB3 GLU 66 HB1 GLU 66 -5.111 -1.084 -5.214 540 HG2 GLU 66 HG2 GLU 66 -3.889 -1.151 -7.238 541 HG3 GLU 66 HG1 GLU 66 -3.021 -2.148 -6.069 542 H LEU 67 HN LEU 67 -4.587 -1.882 -2.649 543 HA LEU 67 HA LEU 67 -1.795 -2.343 -2.600 544 HB2 LEU 67 HB2 LEU 67 -3.629 -1.475 -0.355 545 HB3 LEU 67 HB1 LEU 67 -1.891 -1.242 -0.404 546 HG LEU 67 HG LEU 67 -3.929 0.081 -2.205 547 HD11 LEU 67 HD11 LEU 67 -2.114 1.289 -0.132 548 HD12 LEU 67 HD12 LEU 67 -3.805 0.880 0.157 549 HD13 LEU 67 HD13 LEU 67 -3.386 2.097 -1.049 550 HD21 LEU 67 HD21 LEU 67 -1.709 -0.468 -3.263 551 HD22 LEU 67 HD22 LEU 67 -0.988 0.638 -2.095 552 HD23 LEU 67 HD23 LEU 67 -2.173 1.230 -3.253 553 H GLU 68 HN GLU 68 -4.546 -3.571 -0.720 554 HA GLU 68 HA GLU 68 -3.042 -5.285 0.961 555 HB2 GLU 68 HB2 GLU 68 -5.314 -4.482 1.491 556 HB3 GLU 68 HB1 GLU 68 -5.959 -5.453 0.175 557 HG2 GLU 68 HG2 GLU 68 -4.647 -7.348 1.528 558 HG3 GLU 68 HG1 GLU 68 -5.036 -6.254 2.851 559 H ARG 69 HN ARG 69 -5.015 -5.950 -1.936 560 HA ARG 69 HA ARG 69 -4.625 -8.713 -2.024 561 HB2 ARG 69 HB2 ARG 69 -6.266 -7.487 -3.412 562 HB3 ARG 69 HB1 ARG 69 -4.943 -6.894 -4.410 563 HG2 ARG 69 HG2 ARG 69 -4.359 -9.355 -4.751 564 HG3 ARG 69 HG1 ARG 69 -5.973 -9.685 -4.129 565 HD2 ARG 69 HD2 ARG 69 -5.896 -9.566 -6.596 566 HD3 ARG 69 HD1 ARG 69 -6.991 -8.400 -5.865 567 HE ARG 69 HE ARG 69 -4.602 -7.071 -6.190 568 HH11 ARG 69 HH11 ARG 69 -6.853 -8.744 -8.274 569 HH12 ARG 69 HH12 ARG 69 -6.567 -7.709 -9.634 570 HH21 ARG 69 HH21 ARG 69 -4.219 -5.680 -7.979 571 HH22 ARG 69 HH22 ARG 69 -5.069 -5.974 -9.470 572 H TYR 70 HN TYR 70 -2.572 -6.130 -3.165 573 HA TYR 70 HA TYR 70 -0.854 -7.870 -4.665 574 HB2 TYR 70 HB2 TYR 70 -0.928 -5.638 -5.441 575 HB3 TYR 70 HB1 TYR 70 -0.689 -4.981 -3.826 576 HD1 TYR 70 HD2 TYR 70 1.016 -6.780 -6.591 577 HD2 TYR 70 HD1 TYR 70 1.452 -4.560 -2.990 578 HE1 TYR 70 HE2 TYR 70 3.437 -6.638 -6.986 579 HE2 TYR 70 HE1 TYR 70 3.883 -4.411 -3.372 580 HH TYR 70 HH TYR 70 5.619 -5.399 -4.577 581 H VAL 71 HN VAL 71 -0.622 -6.244 -1.506 582 HA VAL 71 HA VAL 71 2.019 -7.154 -1.014 583 HB VAL 71 HB VAL 71 1.661 -6.490 1.302 584 HG11 VAL 71 HG11 VAL 71 0.481 -4.146 0.405 585 HG12 VAL 71 HG12 VAL 71 1.294 -4.811 -1.005 586 HG13 VAL 71 HG13 VAL 71 2.200 -4.502 0.477 587 HG21 VAL 71 HG21 VAL 71 -0.443 -7.000 1.983 588 HG22 VAL 71 HG22 VAL 71 -1.182 -6.486 0.463 589 HG23 VAL 71 HG23 VAL 71 -0.654 -5.282 1.640 590 H THR 72 HN THR 72 -1.161 -8.379 -0.044 591 HA THR 72 HA THR 72 -0.258 -10.426 1.620 592 HB THR 72 HB THR 72 -2.645 -9.604 1.379 593 HG1 THR 72 HG1 THR 72 -3.113 -11.357 2.451 594 HG21 THR 72 HG21 THR 72 -2.756 -9.869 -1.084 595 HG22 THR 72 HG22 THR 72 -4.077 -10.671 -0.232 596 HG23 THR 72 HG23 THR 72 -2.730 -11.618 -0.865 597 H SER 73 HN SER 73 -0.486 -10.232 -1.853 598 HA SER 73 HA SER 73 -0.108 -12.970 -2.412 599 HB2 SER 73 HB2 SER 73 0.108 -12.333 -4.641 600 HB3 SER 73 HB1 SER 73 -0.770 -10.955 -3.976 601 HG SER 73 HG SER 73 1.129 -9.793 -3.892 602 H CYS 74 HN CYS 74 2.001 -10.431 -1.432 603 HA CYS 74 HA CYS 74 4.425 -11.880 -2.116 604 HB2 CYS 74 HB2 CYS 74 4.329 -9.459 -2.509 605 HB3 CYS 74 HB1 CYS 74 4.040 -9.178 -0.793 606 HG CYS 74 HG CYS 74 6.769 -10.955 -1.089 607 H LEU 75 HN LEU 75 2.890 -10.560 0.835 608 HA LEU 75 HA LEU 75 4.645 -11.507 2.747 609 HB2 LEU 75 HB2 LEU 75 1.706 -11.592 3.267 610 HB3 LEU 75 HB1 LEU 75 3.000 -11.091 4.329 611 HG LEU 75 HG LEU 75 2.127 -9.503 1.937 612 HD11 LEU 75 HD11 LEU 75 1.474 -8.847 4.767 613 HD12 LEU 75 HD12 LEU 75 0.437 -9.934 3.848 614 HD13 LEU 75 HD13 LEU 75 0.706 -8.290 3.278 615 HD21 LEU 75 HD21 LEU 75 4.432 -9.180 2.816 616 HD22 LEU 75 HD22 LEU 75 3.730 -8.722 4.366 617 HD23 LEU 75 HD23 LEU 75 3.414 -7.747 2.929 618 H ARG 76 HN ARG 76 2.005 -13.194 1.156 619 HA ARG 76 HA ARG 76 2.123 -15.505 2.844 620 HB2 ARG 76 HB2 ARG 76 0.694 -14.855 0.281 621 HB3 ARG 76 HB1 ARG 76 0.624 -16.461 0.999 622 HG2 ARG 76 HG2 ARG 76 -0.450 -15.635 2.938 623 HG3 ARG 76 HG1 ARG 76 -0.133 -13.960 2.478 624 HD2 ARG 76 HD2 ARG 76 -2.459 -14.628 2.046 625 HD3 ARG 76 HD1 ARG 76 -1.598 -14.166 0.578 626 HE ARG 76 HE ARG 76 -1.301 -16.882 0.741 627 HH11 ARG 76 HH11 ARG 76 -4.030 -14.698 0.687 628 HH12 ARG 76 HH12 ARG 76 -5.062 -15.803 -0.163 629 HH21 ARG 76 HH21 ARG 76 -2.642 -18.341 -0.368 630 HH22 ARG 76 HH22 ARG 76 -4.271 -17.890 -0.762 631 H LYS 77 HN LYS 77 4.607 -14.749 1.537 632 HA LYS 77 HA LYS 77 5.267 -17.306 0.312 633 HB2 LYS 77 HB2 LYS 77 5.481 -14.645 -1.055 634 HB3 LYS 77 HB1 LYS 77 6.663 -15.899 -1.405 635 HG2 LYS 77 HG2 LYS 77 4.986 -17.363 -2.231 636 HG3 LYS 77 HG1 LYS 77 3.698 -16.312 -1.648 637 HD2 LYS 77 HD2 LYS 77 4.291 -14.615 -3.252 638 HD3 LYS 77 HD1 LYS 77 5.724 -15.520 -3.740 639 HE2 LYS 77 HE2 LYS 77 4.293 -17.312 -4.604 640 HE3 LYS 77 HE1 LYS 77 2.856 -16.409 -4.129 641 HZ1 LYS 77 HZ1 LYS 77 3.290 -16.072 -6.443 642 HZ2 LYS 77 HZ2 LYS 77 4.876 -15.581 -6.137 643 HZ3 LYS 77 HZ3 LYS 77 3.582 -14.621 -5.628 644 H LYS 78 HN LYS 78 7.862 -16.980 -0.255 645 HA LYS 78 HA LYS 78 8.984 -16.217 2.321 646 HB2 LYS 78 HB2 LYS 78 9.975 -17.907 0.053 647 HB3 LYS 78 HB1 LYS 78 11.134 -17.222 1.177 648 HG2 LYS 78 HG2 LYS 78 8.819 -18.953 1.990 649 HG3 LYS 78 HG1 LYS 78 10.463 -19.528 1.737 650 HD2 LYS 78 HD2 LYS 78 11.261 -18.079 3.515 651 HD3 LYS 78 HD1 LYS 78 9.642 -17.418 3.733 652 HE2 LYS 78 HE2 LYS 78 10.046 -19.057 5.438 653 HE3 LYS 78 HE1 LYS 78 8.842 -19.684 4.316 654 HZ1 LYS 78 HZ1 LYS 78 11.726 -20.382 4.326 655 HZ2 LYS 78 HZ2 LYS 78 10.575 -20.982 3.242 656 HZ3 LYS 78 HZ3 LYS 78 10.468 -21.363 4.885 657 H ARG 79 HN ARG 79 8.599 -14.007 1.969 658 HA ARG 79 HA ARG 79 9.802 -12.700 -0.298 659 HB2 ARG 79 HB2 ARG 79 8.855 -10.615 1.005 660 HB3 ARG 79 HB1 ARG 79 7.802 -11.682 0.097 661 HG2 ARG 79 HG2 ARG 79 6.712 -11.226 2.135 662 HG3 ARG 79 HG1 ARG 79 7.315 -12.876 2.258 663 HD2 ARG 79 HD2 ARG 79 9.180 -12.121 3.606 664 HD3 ARG 79 HD1 ARG 79 8.675 -10.444 3.408 665 HE ARG 79 HE ARG 79 6.558 -11.915 4.526 666 HH11 ARG 79 HH11 ARG 79 9.757 -10.787 5.383 667 HH12 ARG 79 HH12 ARG 79 9.375 -10.589 7.062 668 HH21 ARG 79 HH21 ARG 79 6.052 -11.663 6.736 669 HH22 ARG 79 HH22 ARG 79 7.270 -11.097 7.835 670 H LYS 80 HN LYS 80 11.975 -13.447 0.439 671 HA LYS 80 HA LYS 80 13.144 -11.331 2.110 672 HB2 LYS 80 HB2 LYS 80 14.800 -13.007 2.923 673 HB3 LYS 80 HB1 LYS 80 13.154 -13.293 3.463 674 HG2 LYS 80 HG2 LYS 80 12.884 -15.035 1.782 675 HG3 LYS 80 HG1 LYS 80 14.519 -14.729 1.191 676 HD2 LYS 80 HD2 LYS 80 13.833 -15.625 3.990 677 HD3 LYS 80 HD1 LYS 80 14.376 -16.692 2.695 678 HE2 LYS 80 HE2 LYS 80 16.481 -15.473 2.554 679 HE3 LYS 80 HE1 LYS 80 15.935 -14.361 3.805 680 HZ1 LYS 80 HZ1 LYS 80 15.863 -16.192 5.367 681 HZ2 LYS 80 HZ2 LYS 80 17.407 -16.066 4.690 682 HZ3 LYS 80 HZ3 LYS 80 16.352 -17.276 4.166 683 HA PRO 81 HA PRO 81 15.620 -11.976 -1.892 684 HB2 PRO 81 HB2 PRO 81 14.682 -10.058 -3.523 685 HB3 PRO 81 HB1 PRO 81 13.937 -11.660 -3.453 686 HG2 PRO 81 HG2 PRO 81 13.063 -9.110 -2.162 687 HG3 PRO 81 HG1 PRO 81 12.085 -10.338 -2.985 688 HD2 PRO 81 HD2 PRO 81 12.333 -10.164 -0.262 689 HD3 PRO 81 HD1 PRO 81 11.982 -11.674 -1.125 690 H GLN 82 HN GLN 82 14.338 -8.992 -0.523 691 HA GLN 82 HA GLN 82 17.074 -7.931 -0.331 692 HB2 GLN 82 HB2 GLN 82 15.657 -6.844 -2.131 693 HB3 GLN 82 HB1 GLN 82 14.591 -6.282 -0.855 694 HG2 GLN 82 HG2 GLN 82 16.546 -5.093 0.144 695 HG3 GLN 82 HG1 GLN 82 17.467 -5.528 -1.296 696 HE21 GLN 82 HE21 GLN 82 17.749 -3.375 -1.890 697 HE22 GLN 82 HE22 GLN 82 16.454 -2.417 -2.518 698 H ALA 83 HN ALA 83 15.524 -9.462 1.570 699 HA ALA 83 HA ALA 83 15.693 -7.700 3.835 700 HB1 ALA 83 HB1 ALA 83 13.004 -8.881 3.133 701 HB2 ALA 83 HB2 ALA 83 13.434 -7.173 3.026 702 HB3 ALA 83 HB3 ALA 83 13.394 -7.976 4.596 703 H1 GLU 201 HT1 GLU 201 -7.974 9.575 11.430 704 H2 GLU 201 HT2 GLU 201 -7.385 8.138 12.090 705 H3 GLU 201 HT3 GLU 201 -7.392 8.358 10.416 706 HA GLU 201 HA GLU 201 -5.798 10.138 10.600 707 HB2 GLU 201 HB2 GLU 201 -5.837 9.421 13.536 708 HB3 GLU 201 HB1 GLU 201 -4.697 10.523 12.781 709 HG2 GLU 201 HG2 GLU 201 -7.674 10.901 12.985 710 HG3 GLU 201 HG1 GLU 201 -6.442 11.746 13.919 711 H ILE 202 HN ILE 202 -5.038 8.388 9.238 712 HA ILE 202 HA ILE 202 -2.903 6.871 10.554 713 HB ILE 202 HB ILE 202 -4.814 5.668 8.541 714 HG12 ILE 202 HG12 ILE 202 -4.379 5.140 11.487 715 HG13 ILE 202 HG11 ILE 202 -5.845 5.738 10.720 716 HG21 ILE 202 HG21 ILE 202 -3.533 3.616 8.795 717 HG22 ILE 202 HG22 ILE 202 -2.427 4.426 9.905 718 HG23 ILE 202 HG23 ILE 202 -2.500 4.924 8.214 719 HD11 ILE 202 HD11 ILE 202 -4.662 2.988 10.542 720 HD12 ILE 202 HD12 ILE 202 -5.973 3.547 9.503 721 HD13 ILE 202 HD13 ILE 202 -6.205 3.464 11.250 722 H LYS 203 HN LYS 203 -1.069 7.465 9.647 723 HA LYS 203 HA LYS 203 -1.034 8.069 6.762 724 HB2 LYS 203 HB2 LYS 203 0.577 9.320 8.995 725 HB3 LYS 203 HB1 LYS 203 0.902 9.579 7.286 726 HG2 LYS 203 HG2 LYS 203 -1.369 10.507 7.041 727 HG3 LYS 203 HG1 LYS 203 -1.599 10.336 8.777 728 HD2 LYS 203 HD2 LYS 203 0.111 11.924 9.227 729 HD3 LYS 203 HD1 LYS 203 0.636 11.925 7.539 730 HE2 LYS 203 HE2 LYS 203 -1.971 12.963 8.639 731 HE3 LYS 203 HE1 LYS 203 -0.657 13.909 7.943 732 HZ1 LYS 203 HZ1 LYS 203 -1.060 12.567 5.845 733 HZ2 LYS 203 HZ2 LYS 203 -2.238 13.714 6.252 734 HZ3 LYS 203 HZ3 LYS 203 -2.522 12.075 6.554 735 H LEU 204 HN LEU 204 0.350 6.916 5.544 736 HA LEU 204 HA LEU 204 2.362 5.297 6.965 737 HB2 LEU 204 HB2 LEU 204 0.410 4.322 5.367 738 HB3 LEU 204 HB1 LEU 204 1.663 4.603 4.174 739 HG LEU 204 HG LEU 204 1.731 2.728 6.531 740 HD11 LEU 204 HD11 LEU 204 2.335 2.214 3.635 741 HD12 LEU 204 HD12 LEU 204 0.738 2.014 4.352 742 HD13 LEU 204 HD13 LEU 204 2.087 1.033 4.919 743 HD21 LEU 204 HD21 LEU 204 4.095 3.330 4.772 744 HD22 LEU 204 HD22 LEU 204 4.032 2.278 6.184 745 HD23 LEU 204 HD23 LEU 204 3.876 4.023 6.377 746 H LYS 205 HN LYS 205 4.034 6.752 6.930 747 HA LYS 205 HA LYS 205 4.966 7.866 4.437 748 HB2 LYS 205 HB2 LYS 205 6.096 7.780 7.229 749 HB3 LYS 205 HB1 LYS 205 7.020 8.404 5.874 750 HG2 LYS 205 HG2 LYS 205 4.375 9.477 6.818 751 HG3 LYS 205 HG1 LYS 205 5.957 10.178 7.168 752 HD2 LYS 205 HD2 LYS 205 6.263 10.258 4.623 753 HD3 LYS 205 HD1 LYS 205 4.521 9.991 4.540 754 HE2 LYS 205 HE2 LYS 205 5.977 12.281 5.833 755 HE3 LYS 205 HE1 LYS 205 4.909 12.340 4.432 756 HZ1 LYS 205 HZ1 LYS 205 4.122 11.739 7.233 757 HZ2 LYS 205 HZ2 LYS 205 3.073 11.617 5.908 758 HZ3 LYS 205 HZ3 LYS 205 3.725 13.120 6.343 759 H ILE 206 HN ILE 206 5.128 5.829 3.239 760 HA ILE 206 HA ILE 206 7.008 3.861 4.102 761 HB ILE 206 HB ILE 206 6.517 4.204 1.170 762 HG12 ILE 206 HG12 ILE 206 4.533 2.829 2.981 763 HG13 ILE 206 HG11 ILE 206 4.245 4.422 2.274 764 HG21 ILE 206 HG21 ILE 206 6.178 1.587 2.353 765 HG22 ILE 206 HG22 ILE 206 7.697 2.346 2.872 766 HG23 ILE 206 HG23 ILE 206 7.356 2.149 1.152 767 HD11 ILE 206 HD11 ILE 206 4.944 2.858 0.109 768 HD12 ILE 206 HD12 ILE 206 3.305 3.288 0.593 769 HD13 ILE 206 HD13 ILE 206 4.004 1.764 1.124 770 H THR 207 HN THR 207 9.081 4.360 4.371 771 HA THR 207 HA THR 207 10.315 6.406 2.696 772 HB THR 207 HB THR 207 11.695 4.949 4.931 773 HG1 THR 207 HG1 THR 207 9.938 7.185 5.220 774 HG21 THR 207 HG21 THR 207 11.934 7.834 4.717 775 HG22 THR 207 HG22 THR 207 12.470 6.994 3.259 776 HG23 THR 207 HG23 THR 207 13.198 6.608 4.821 777 H LYS 208 HN LYS 208 10.974 5.574 0.756 778 HA LYS 208 HA LYS 208 13.091 3.715 0.701 779 HB2 LYS 208 HB2 LYS 208 12.160 1.797 -0.284 780 HB3 LYS 208 HB1 LYS 208 11.090 2.190 1.044 781 HG2 LYS 208 HG2 LYS 208 10.567 2.775 -1.867 782 HG3 LYS 208 HG1 LYS 208 9.872 1.458 -0.933 783 HD2 LYS 208 HD2 LYS 208 8.166 2.890 -0.638 784 HD3 LYS 208 HD1 LYS 208 9.212 3.614 0.587 785 HE2 LYS 208 HE2 LYS 208 10.128 5.108 -1.168 786 HE3 LYS 208 HE1 LYS 208 8.944 4.450 -2.292 787 HZ1 LYS 208 HZ1 LYS 208 8.250 6.541 -1.316 788 HZ2 LYS 208 HZ2 LYS 208 8.298 5.855 0.236 789 HZ3 LYS 208 HZ3 LYS 208 7.188 5.286 -0.910 790 H THR 209 HN THR 209 13.024 2.794 -1.860 791 HA THR 209 HA THR 209 13.690 3.344 -3.929 792 HB THR 209 HB THR 209 12.410 4.917 -5.272 793 HG1 THR 209 HG1 THR 209 11.868 6.063 -2.881 794 HG21 THR 209 HG21 THR 209 10.402 3.556 -3.513 795 HG22 THR 209 HG22 THR 209 11.485 2.633 -4.553 796 HG23 THR 209 HG23 THR 209 10.363 3.796 -5.260 797 H ILE 210 HN ILE 210 14.791 4.812 -1.508 798 HA ILE 210 HA ILE 210 15.641 7.366 -2.394 799 HB ILE 210 HB ILE 210 15.591 6.856 -0.027 800 HG12 ILE 210 HG12 ILE 210 17.904 7.562 0.615 801 HG13 ILE 210 HG11 ILE 210 18.396 7.317 -1.056 802 HG21 ILE 210 HG21 ILE 210 16.074 4.485 -0.097 803 HG22 ILE 210 HG22 ILE 210 17.178 5.302 1.010 804 HG23 ILE 210 HG23 ILE 210 17.735 4.816 -0.592 805 HD11 ILE 210 HD11 ILE 210 17.968 9.663 -0.573 806 HD12 ILE 210 HD12 ILE 210 16.311 9.270 -0.111 807 HD13 ILE 210 HD13 ILE 210 16.842 9.040 -1.777 808 H GLN 211 HN GLN 211 17.294 7.939 -3.641 809 HA GLN 211 HA GLN 211 18.596 6.040 -5.257 810 HB2 GLN 211 HB2 GLN 211 19.901 7.961 -6.105 811 HB3 GLN 211 HB1 GLN 211 18.173 8.276 -6.065 812 HG2 GLN 211 HG2 GLN 211 18.457 9.549 -3.994 813 HG3 GLN 211 HG1 GLN 211 20.192 9.243 -4.054 814 HE21 GLN 211 HE21 GLN 211 18.296 9.845 -6.915 815 HE22 GLN 211 HE22 GLN 211 18.953 11.406 -7.258 816 H ASN 212 HN ASN 212 20.629 5.222 -5.261 817 HA ASN 212 HA ASN 212 22.315 5.852 -2.945 818 HB2 ASN 212 HB2 ASN 212 22.995 3.477 -2.848 819 HB3 ASN 212 HB1 ASN 212 21.280 3.693 -2.530 820 HD21 ASN 212 HD21 ASN 212 23.653 2.362 -4.642 821 HD22 ASN 212 HD22 ASN 212 22.565 1.482 -5.656 Start of MODEL 2 1 H1 SER 1 HT1 SER 1 -12.759 -3.140 -15.204 2 H2 SER 1 HT2 SER 1 -12.136 -2.519 -16.651 3 H3 SER 1 HT3 SER 1 -13.775 -2.344 -16.300 4 HA SER 1 HA SER 1 -11.533 -1.117 -14.822 5 HB2 SER 1 HB2 SER 1 -13.646 0.241 -16.504 6 HB3 SER 1 HB1 SER 1 -12.194 0.964 -15.807 7 HG SER 1 HG SER 1 -11.475 0.545 -17.763 8 H GLU 2 HN GLU 2 -15.014 -1.701 -15.062 9 HA GLU 2 HA GLU 2 -15.762 0.130 -13.043 10 HB2 GLU 2 HB2 GLU 2 -17.939 -0.985 -13.078 11 HB3 GLU 2 HB1 GLU 2 -17.364 -0.661 -14.706 12 HG2 GLU 2 HG2 GLU 2 -16.702 -2.969 -14.969 13 HG3 GLU 2 HG1 GLU 2 -17.164 -3.315 -13.304 14 H GLU 3 HN GLU 3 -14.214 -2.854 -12.841 15 HA GLU 3 HA GLU 3 -15.265 -4.053 -10.563 16 HB2 GLU 3 HB2 GLU 3 -12.325 -3.977 -11.247 17 HB3 GLU 3 HB1 GLU 3 -13.161 -5.199 -10.308 18 HG2 GLU 3 HG2 GLU 3 -12.787 -6.195 -12.373 19 HG3 GLU 3 HG1 GLU 3 -14.474 -5.689 -12.437 20 H GLU 4 HN GLU 4 -12.963 -1.409 -10.883 21 HA GLU 4 HA GLU 4 -12.223 -1.450 -8.110 22 HB2 GLU 4 HB2 GLU 4 -11.022 0.668 -8.606 23 HB3 GLU 4 HB1 GLU 4 -10.593 -0.637 -9.705 24 HG2 GLU 4 HG2 GLU 4 -12.124 0.317 -11.383 25 HG3 GLU 4 HG1 GLU 4 -12.457 1.653 -10.282 26 H ASP 5 HN ASP 5 -14.843 -0.180 -9.835 27 HA ASP 5 HA ASP 5 -15.486 1.806 -7.809 28 HB2 ASP 5 HB2 ASP 5 -17.004 0.916 -10.279 29 HB3 ASP 5 HB1 ASP 5 -17.552 2.174 -9.175 30 H LYS 6 HN LYS 6 -15.853 -1.505 -8.252 31 HA LYS 6 HA LYS 6 -18.483 -1.633 -6.973 32 HB2 LYS 6 HB2 LYS 6 -18.088 -2.993 -9.005 33 HB3 LYS 6 HB1 LYS 6 -16.830 -3.887 -8.166 34 HG2 LYS 6 HG2 LYS 6 -18.852 -5.185 -8.199 35 HG3 LYS 6 HG1 LYS 6 -18.531 -4.673 -6.539 36 HD2 LYS 6 HD2 LYS 6 -20.138 -2.821 -6.840 37 HD3 LYS 6 HD1 LYS 6 -20.499 -3.425 -8.457 38 HE2 LYS 6 HE2 LYS 6 -21.268 -5.537 -7.495 39 HE3 LYS 6 HE1 LYS 6 -20.898 -4.939 -5.879 40 HZ1 LYS 6 HZ1 LYS 6 -22.544 -3.208 -6.170 41 HZ2 LYS 6 HZ2 LYS 6 -23.250 -4.725 -6.416 42 HZ3 LYS 6 HZ3 LYS 6 -22.878 -3.744 -7.739 43 H CYS 7 HN CYS 7 -15.234 -1.771 -6.040 44 HA CYS 7 HA CYS 7 -15.590 -3.812 -4.024 45 HB2 CYS 7 HB2 CYS 7 -13.171 -2.430 -3.511 46 HB3 CYS 7 HB1 CYS 7 -13.358 -3.962 -4.372 47 HG CYS 7 HG CYS 7 -13.344 -2.935 -6.882 48 H LYS 8 HN LYS 8 -15.681 -3.528 -1.839 49 HA LYS 8 HA LYS 8 -16.612 -0.908 -0.968 50 HB2 LYS 8 HB2 LYS 8 -16.896 -3.702 0.102 51 HB3 LYS 8 HB1 LYS 8 -17.202 -2.320 1.134 52 HG2 LYS 8 HG2 LYS 8 -19.277 -3.112 0.239 53 HG3 LYS 8 HG1 LYS 8 -18.906 -1.535 -0.456 54 HD2 LYS 8 HD2 LYS 8 -18.029 -2.677 -2.469 55 HD3 LYS 8 HD1 LYS 8 -18.516 -4.223 -1.773 56 HE2 LYS 8 HE2 LYS 8 -20.170 -3.437 -3.374 57 HE3 LYS 8 HE1 LYS 8 -20.845 -3.473 -1.746 58 HZ1 LYS 8 HZ1 LYS 8 -21.420 -1.452 -2.997 59 HZ2 LYS 8 HZ2 LYS 8 -19.782 -1.036 -3.067 60 HZ3 LYS 8 HZ3 LYS 8 -20.570 -1.116 -1.574 61 HA PRO 9 HA PRO 9 -12.999 -0.002 1.442 62 HB2 PRO 9 HB2 PRO 9 -14.625 0.910 3.677 63 HB3 PRO 9 HB1 PRO 9 -13.575 1.839 2.604 64 HG2 PRO 9 HG2 PRO 9 -16.294 2.017 2.563 65 HG3 PRO 9 HG1 PRO 9 -15.268 2.337 1.158 66 HD2 PRO 9 HD2 PRO 9 -16.937 -0.045 1.786 67 HD3 PRO 9 HD1 PRO 9 -16.540 0.680 0.216 68 H MET 10 HN MET 10 -11.785 -0.769 3.133 69 HA MET 10 HA MET 10 -12.921 -3.015 4.599 70 HB2 MET 10 HB2 MET 10 -10.575 -3.561 5.168 71 HB3 MET 10 HB1 MET 10 -10.853 -3.492 3.438 72 HG2 MET 10 HG2 MET 10 -9.882 -1.247 3.383 73 HG3 MET 10 HG1 MET 10 -9.557 -1.371 5.110 74 HE1 MET 10 HE1 MET 10 -8.887 -2.990 1.607 75 HE2 MET 10 HE2 MET 10 -9.235 -4.409 2.592 76 HE3 MET 10 HE3 MET 10 -7.607 -4.144 1.975 77 H SER 11 HN SER 11 -12.175 -3.241 6.903 78 HA SER 11 HA SER 11 -13.148 -0.930 8.271 79 HB2 SER 11 HB2 SER 11 -12.960 -2.343 10.298 80 HB3 SER 11 HB1 SER 11 -13.831 -3.141 8.993 81 HG SER 11 HG SER 11 -11.989 -4.352 8.534 82 H TYR 12 HN TYR 12 -11.995 -0.512 10.548 83 HA TYR 12 HA TYR 12 -9.676 0.986 9.926 84 HB2 TYR 12 HB2 TYR 12 -11.392 1.377 11.790 85 HB3 TYR 12 HB1 TYR 12 -10.515 0.151 12.709 86 HD1 TYR 12 HD1 TYR 12 -8.021 0.597 13.178 87 HD2 TYR 12 HD2 TYR 12 -10.711 3.591 11.808 88 HE1 TYR 12 HE1 TYR 12 -6.501 2.339 14.021 89 HE2 TYR 12 HE2 TYR 12 -9.199 5.338 12.638 90 HH TYR 12 HH TYR 12 -7.431 5.600 14.317 91 H GLU 13 HN GLU 13 -10.159 -2.139 11.495 92 HA GLU 13 HA GLU 13 -7.504 -2.582 12.354 93 HB2 GLU 13 HB2 GLU 13 -9.819 -3.907 12.711 94 HB3 GLU 13 HB1 GLU 13 -9.144 -4.901 11.430 95 HG2 GLU 13 HG2 GLU 13 -7.902 -4.344 14.124 96 HG3 GLU 13 HG1 GLU 13 -8.640 -5.847 13.589 97 H GLU 14 HN GLU 14 -9.193 -3.184 9.336 98 HA GLU 14 HA GLU 14 -7.106 -4.729 8.142 99 HB2 GLU 14 HB2 GLU 14 -9.550 -3.391 6.983 100 HB3 GLU 14 HB1 GLU 14 -8.448 -4.380 6.036 101 HG2 GLU 14 HG2 GLU 14 -9.004 -6.333 7.268 102 HG3 GLU 14 HG1 GLU 14 -9.885 -5.391 8.475 103 H LYS 15 HN LYS 15 -8.210 -1.367 7.765 104 HA LYS 15 HA LYS 15 -6.334 -0.559 5.869 105 HB2 LYS 15 HB2 LYS 15 -7.747 0.946 8.062 106 HB3 LYS 15 HB1 LYS 15 -6.669 1.738 6.923 107 HG2 LYS 15 HG2 LYS 15 -8.071 1.229 5.086 108 HG3 LYS 15 HG1 LYS 15 -9.037 0.117 6.065 109 HD2 LYS 15 HD2 LYS 15 -10.267 1.769 6.969 110 HD3 LYS 15 HD1 LYS 15 -8.893 2.866 7.104 111 HE2 LYS 15 HE2 LYS 15 -9.034 3.332 4.711 112 HE3 LYS 15 HE1 LYS 15 -10.399 2.225 4.565 113 HZ1 LYS 15 HZ1 LYS 15 -11.693 3.652 5.975 114 HZ2 LYS 15 HZ2 LYS 15 -11.046 4.583 4.721 115 HZ3 LYS 15 HZ3 LYS 15 -10.366 4.662 6.274 116 H ARG 16 HN ARG 16 -6.159 -0.578 9.395 117 HA ARG 16 HA ARG 16 -3.592 0.534 9.649 118 HB2 ARG 16 HB2 ARG 16 -5.196 0.294 11.512 119 HB3 ARG 16 HB1 ARG 16 -4.961 -1.451 11.484 120 HG2 ARG 16 HG2 ARG 16 -2.454 -0.852 11.832 121 HG3 ARG 16 HG1 ARG 16 -3.097 0.693 12.389 122 HD2 ARG 16 HD2 ARG 16 -2.813 -0.762 14.285 123 HD3 ARG 16 HD1 ARG 16 -4.533 -0.530 13.988 124 HE ARG 16 HE ARG 16 -4.640 -2.746 13.091 125 HH11 ARG 16 HH11 ARG 16 -1.598 -1.954 14.649 126 HH12 ARG 16 HH12 ARG 16 -1.169 -3.614 14.922 127 HH21 ARG 16 HH21 ARG 16 -4.090 -4.910 13.459 128 HH22 ARG 16 HH22 ARG 16 -2.587 -5.298 14.251 129 H GLN 17 HN GLN 17 -4.654 -2.866 9.455 130 HA GLN 17 HA GLN 17 -2.079 -3.977 9.668 131 HB2 GLN 17 HB2 GLN 17 -4.150 -5.276 10.026 132 HB3 GLN 17 HB1 GLN 17 -4.504 -5.147 8.307 133 HG2 GLN 17 HG2 GLN 17 -3.544 -7.296 8.748 134 HG3 GLN 17 HG1 GLN 17 -2.400 -6.328 7.819 135 HE21 GLN 17 HE21 GLN 17 -0.566 -7.334 8.453 136 HE22 GLN 17 HE22 GLN 17 0.028 -7.307 10.084 137 H LEU 18 HN LEU 18 -3.942 -2.842 6.954 138 HA LEU 18 HA LEU 18 -2.381 -3.845 4.858 139 HB2 LEU 18 HB2 LEU 18 -4.633 -2.377 5.012 140 HB3 LEU 18 HB1 LEU 18 -3.496 -1.117 4.584 141 HG LEU 18 HG LEU 18 -3.869 -3.639 2.978 142 HD11 LEU 18 HD11 LEU 18 -5.038 -0.914 2.488 143 HD12 LEU 18 HD12 LEU 18 -5.934 -2.325 3.038 144 HD13 LEU 18 HD13 LEU 18 -5.189 -2.318 1.440 145 HD21 LEU 18 HD21 LEU 18 -1.746 -2.669 2.533 146 HD22 LEU 18 HD22 LEU 18 -2.436 -1.053 2.443 147 HD23 LEU 18 HD23 LEU 18 -2.810 -2.243 1.200 148 H SER 19 HN SER 19 -2.144 -0.853 6.711 149 HA SER 19 HA SER 19 0.124 0.238 5.485 150 HB2 SER 19 HB2 SER 19 -1.283 1.524 7.017 151 HB3 SER 19 HB1 SER 19 -0.847 0.461 8.350 152 HG SER 19 HG SER 19 1.430 1.249 7.519 153 H LEU 20 HN LEU 20 -0.228 -2.063 8.120 154 HA LEU 20 HA LEU 20 2.529 -2.240 8.761 155 HB2 LEU 20 HB2 LEU 20 0.178 -4.026 9.312 156 HB3 LEU 20 HB1 LEU 20 1.777 -4.345 9.934 157 HG LEU 20 HG LEU 20 0.197 -1.857 10.539 158 HD11 LEU 20 HD11 LEU 20 -0.632 -4.156 11.356 159 HD12 LEU 20 HD12 LEU 20 -0.488 -2.839 12.520 160 HD13 LEU 20 HD13 LEU 20 0.754 -4.093 12.444 161 HD21 LEU 20 HD21 LEU 20 2.726 -1.761 10.642 162 HD22 LEU 20 HD22 LEU 20 2.633 -2.960 11.930 163 HD23 LEU 20 HD23 LEU 20 1.882 -1.378 12.141 164 H ASP 21 HN ASP 21 0.446 -3.872 6.497 165 HA ASP 21 HA ASP 21 2.204 -6.053 6.045 166 HB2 ASP 21 HB2 ASP 21 -0.302 -5.152 4.784 167 HB3 ASP 21 HB1 ASP 21 0.638 -6.428 4.056 168 H ILE 22 HN ILE 22 1.554 -3.038 4.361 169 HA ILE 22 HA ILE 22 3.284 -3.538 2.176 170 HB ILE 22 HB ILE 22 2.396 -0.927 3.400 171 HG12 ILE 22 HG12 ILE 22 1.549 -2.119 0.766 172 HG13 ILE 22 HG11 ILE 22 0.738 -2.569 2.267 173 HG21 ILE 22 HG21 ILE 22 4.392 -0.394 2.263 174 HG22 ILE 22 HG22 ILE 22 3.071 0.036 1.173 175 HG23 ILE 22 HG23 ILE 22 3.982 -1.448 0.908 176 HD11 ILE 22 HD11 ILE 22 0.123 -0.292 2.633 177 HD12 ILE 22 HD12 ILE 22 -0.423 -0.802 1.042 178 HD13 ILE 22 HD13 ILE 22 1.001 0.230 1.203 179 H ASN 23 HN ASN 23 3.750 -2.286 5.381 180 HA ASN 23 HA ASN 23 6.364 -1.337 5.186 181 HB2 ASN 23 HB2 ASN 23 5.139 -0.767 7.114 182 HB3 ASN 23 HB1 ASN 23 4.714 -2.437 7.449 183 HD21 ASN 23 HD21 ASN 23 7.146 0.015 7.704 184 HD22 ASN 23 HD22 ASN 23 8.184 -0.834 8.795 185 H LYS 24 HN LYS 24 5.111 -4.580 5.354 186 HA LYS 24 HA LYS 24 7.527 -5.881 6.181 187 HB2 LYS 24 HB2 LYS 24 4.964 -6.831 4.943 188 HB3 LYS 24 HB1 LYS 24 6.344 -7.910 5.138 189 HG2 LYS 24 HG2 LYS 24 6.109 -8.021 7.382 190 HG3 LYS 24 HG1 LYS 24 5.489 -6.367 7.519 191 HD2 LYS 24 HD2 LYS 24 3.329 -7.009 6.814 192 HD3 LYS 24 HD1 LYS 24 3.849 -8.574 6.252 193 HE2 LYS 24 HE2 LYS 24 4.117 -9.382 8.480 194 HE3 LYS 24 HE1 LYS 24 3.857 -7.774 9.185 195 HZ1 LYS 24 HZ1 LYS 24 1.597 -7.911 8.042 196 HZ2 LYS 24 HZ2 LYS 24 1.840 -8.895 9.398 197 HZ3 LYS 24 HZ3 LYS 24 1.913 -9.564 7.848 198 H LEU 25 HN LEU 25 6.168 -4.935 3.104 199 HA LEU 25 HA LEU 25 7.516 -6.690 1.397 200 HB2 LEU 25 HB2 LEU 25 6.673 -3.860 0.877 201 HB3 LEU 25 HB1 LEU 25 7.083 -5.016 -0.356 202 HG LEU 25 HG LEU 25 4.674 -4.961 1.417 203 HD11 LEU 25 HD11 LEU 25 5.126 -5.042 -1.544 204 HD12 LEU 25 HD12 LEU 25 4.541 -3.679 -0.602 205 HD13 LEU 25 HD13 LEU 25 3.550 -5.126 -0.772 206 HD21 LEU 25 HD21 LEU 25 5.740 -7.235 -0.196 207 HD22 LEU 25 HD22 LEU 25 4.071 -7.134 0.346 208 HD23 LEU 25 HD23 LEU 25 5.383 -7.229 1.524 209 HA PRO 26 HA PRO 26 11.771 -5.153 1.429 210 HB2 PRO 26 HB2 PRO 26 11.781 -6.583 -1.180 211 HB3 PRO 26 HB1 PRO 26 12.896 -6.729 0.187 212 HG2 PRO 26 HG2 PRO 26 11.108 -8.638 -0.314 213 HG3 PRO 26 HG1 PRO 26 11.481 -8.159 1.352 214 HD2 PRO 26 HD2 PRO 26 9.113 -7.459 -0.341 215 HD3 PRO 26 HD1 PRO 26 9.184 -7.863 1.388 216 H GLY 27 HN GLY 27 12.894 -3.564 0.218 217 HA2 GLY 27 HA2 GLY 27 11.446 -1.447 -0.659 218 HA3 GLY 27 HA1 GLY 27 13.102 -1.727 -1.154 219 H GLU 28 HN GLU 28 12.767 -3.949 -2.789 220 HA GLU 28 HA GLU 28 12.076 -2.807 -5.233 221 HB2 GLU 28 HB2 GLU 28 13.573 -4.694 -5.139 222 HB3 GLU 28 HB1 GLU 28 12.371 -5.681 -4.350 223 HG2 GLU 28 HG2 GLU 28 11.024 -5.486 -6.496 224 HG3 GLU 28 HG1 GLU 28 12.513 -4.880 -7.210 225 H LYS 29 HN LYS 29 10.281 -5.246 -3.367 226 HA LYS 29 HA LYS 29 7.965 -5.237 -4.971 227 HB2 LYS 29 HB2 LYS 29 8.559 -6.077 -2.146 228 HB3 LYS 29 HB1 LYS 29 6.940 -6.216 -2.819 229 HG2 LYS 29 HG2 LYS 29 9.387 -7.522 -3.980 230 HG3 LYS 29 HG1 LYS 29 8.226 -8.319 -2.914 231 HD2 LYS 29 HD2 LYS 29 6.459 -7.629 -4.617 232 HD3 LYS 29 HD1 LYS 29 7.801 -7.280 -5.704 233 HE2 LYS 29 HE2 LYS 29 7.023 -9.483 -6.180 234 HE3 LYS 29 HE1 LYS 29 8.584 -9.619 -5.379 235 HZ1 LYS 29 HZ1 LYS 29 6.951 -11.216 -4.543 236 HZ2 LYS 29 HZ2 LYS 29 5.953 -9.949 -4.045 237 HZ3 LYS 29 HZ3 LYS 29 7.468 -10.160 -3.327 238 H LEU 30 HN LEU 30 8.968 -3.417 -2.198 239 HA LEU 30 HA LEU 30 6.535 -2.197 -1.473 240 HB2 LEU 30 HB2 LEU 30 8.501 -2.263 -0.043 241 HB3 LEU 30 HB1 LEU 30 9.404 -1.289 -1.188 242 HG LEU 30 HG LEU 30 8.224 0.661 -0.634 243 HD11 LEU 30 HD11 LEU 30 6.298 -0.732 1.155 244 HD12 LEU 30 HD12 LEU 30 5.984 -0.679 -0.571 245 HD13 LEU 30 HD13 LEU 30 6.154 0.816 0.337 246 HD21 LEU 30 HD21 LEU 30 8.446 0.765 1.823 247 HD22 LEU 30 HD22 LEU 30 9.835 0.010 1.042 248 HD23 LEU 30 HD23 LEU 30 8.628 -0.988 1.854 249 H GLY 31 HN GLY 31 9.026 -1.180 -3.805 250 HA2 GLY 31 HA2 GLY 31 8.184 1.421 -4.286 251 HA3 GLY 31 HA1 GLY 31 8.954 0.398 -5.484 252 H ARG 32 HN ARG 32 6.787 -1.569 -5.463 253 HA ARG 32 HA ARG 32 5.143 -0.543 -7.489 254 HB2 ARG 32 HB2 ARG 32 5.510 -2.945 -7.163 255 HB3 ARG 32 HB1 ARG 32 4.665 -2.865 -5.625 256 HG2 ARG 32 HG2 ARG 32 3.165 -3.796 -7.239 257 HG3 ARG 32 HG1 ARG 32 2.620 -2.163 -6.862 258 HD2 ARG 32 HD2 ARG 32 2.506 -2.557 -9.261 259 HD3 ARG 32 HD1 ARG 32 3.711 -1.324 -8.888 260 HE ARG 32 HE ARG 32 4.999 -3.806 -8.984 261 HH11 ARG 32 HH11 ARG 32 3.370 -1.568 -11.123 262 HH12 ARG 32 HH12 ARG 32 4.270 -2.054 -12.525 263 HH21 ARG 32 HH21 ARG 32 6.190 -4.447 -10.820 264 HH22 ARG 32 HH22 ARG 32 5.878 -3.692 -12.350 265 H VAL 33 HN VAL 33 4.522 -1.007 -4.026 266 HA VAL 33 HA VAL 33 1.775 -0.266 -4.159 267 HB VAL 33 HB VAL 33 3.142 0.161 -1.577 268 HG11 VAL 33 HG11 VAL 33 0.785 -1.513 -2.436 269 HG12 VAL 33 HG12 VAL 33 0.720 0.153 -1.852 270 HG13 VAL 33 HG13 VAL 33 1.250 -1.134 -0.776 271 HG21 VAL 33 HG21 VAL 33 4.524 -1.650 -2.244 272 HG22 VAL 33 HG22 VAL 33 3.163 -2.515 -2.955 273 HG23 VAL 33 HG23 VAL 33 3.273 -2.331 -1.206 274 H VAL 34 HN VAL 34 4.655 1.496 -3.048 275 HA VAL 34 HA VAL 34 3.466 3.928 -2.443 276 HB VAL 34 HB VAL 34 5.621 4.387 -2.016 277 HG11 VAL 34 HG11 VAL 34 6.069 2.015 -2.275 278 HG12 VAL 34 HG12 VAL 34 7.452 3.012 -2.726 279 HG13 VAL 34 HG13 VAL 34 6.445 2.280 -3.975 280 HG21 VAL 34 HG21 VAL 34 5.472 5.838 -3.980 281 HG22 VAL 34 HG22 VAL 34 6.034 4.521 -5.000 282 HG23 VAL 34 HG23 VAL 34 7.101 5.207 -3.775 283 H HIS 35 HN HIS 35 4.415 2.608 -5.556 284 HA HIS 35 HA HIS 35 3.643 4.835 -7.132 285 HB2 HIS 35 HB2 HIS 35 5.156 3.114 -7.982 286 HB3 HIS 35 HB1 HIS 35 3.866 1.922 -7.885 287 HD1 HIS 35 HD1 HIS 35 4.750 5.091 -9.774 288 HD2 HIS 35 HD2 HIS 35 2.315 1.743 -10.134 289 HE1 HIS 35 HE1 HIS 35 3.780 5.205 -12.091 290 HE2 HIS 35 HE2 HIS 35 2.171 3.270 -12.217 291 H ILE 36 HN ILE 36 1.926 1.878 -6.163 292 HA ILE 36 HA ILE 36 -0.370 2.235 -7.707 293 HB ILE 36 HB ILE 36 -0.278 0.944 -4.972 294 HG12 ILE 36 HG12 ILE 36 0.166 -0.205 -7.735 295 HG13 ILE 36 HG11 ILE 36 1.327 -0.144 -6.421 296 HG21 ILE 36 HG21 ILE 36 -2.494 0.765 -5.245 297 HG22 ILE 36 HG22 ILE 36 -2.164 -0.312 -6.601 298 HG23 ILE 36 HG23 ILE 36 -2.397 1.411 -6.883 299 HD11 ILE 36 HD11 ILE 36 -0.182 -1.658 -5.130 300 HD12 ILE 36 HD12 ILE 36 0.525 -2.368 -6.579 301 HD13 ILE 36 HD13 ILE 36 -1.151 -1.827 -6.592 302 H ILE 37 HN ILE 37 0.194 3.270 -4.313 303 HA ILE 37 HA ILE 37 -2.338 4.454 -4.002 304 HB ILE 37 HB ILE 37 0.200 5.336 -2.617 305 HG12 ILE 37 HG12 ILE 37 -1.382 3.928 -0.818 306 HG13 ILE 37 HG11 ILE 37 -1.486 2.975 -2.294 307 HG21 ILE 37 HG21 ILE 37 -2.051 6.720 -2.709 308 HG22 ILE 37 HG22 ILE 37 -1.081 6.624 -1.239 309 HG23 ILE 37 HG23 ILE 37 -2.506 5.600 -1.424 310 HD11 ILE 37 HD11 ILE 37 0.856 2.683 -2.363 311 HD12 ILE 37 HD12 ILE 37 0.327 2.314 -0.722 312 HD13 ILE 37 HD13 ILE 37 1.103 3.856 -1.077 313 H GLN 38 HN GLN 38 0.767 5.931 -4.852 314 HA GLN 38 HA GLN 38 -0.088 8.550 -5.174 315 HB2 GLN 38 HB2 GLN 38 2.153 7.014 -6.464 316 HB3 GLN 38 HB1 GLN 38 1.903 8.723 -6.795 317 HG2 GLN 38 HG2 GLN 38 1.906 8.718 -4.068 318 HG3 GLN 38 HG1 GLN 38 2.993 7.374 -4.415 319 HE21 GLN 38 HE21 GLN 38 4.691 8.624 -3.525 320 HE22 GLN 38 HE22 GLN 38 5.453 9.872 -4.445 321 H SER 39 HN SER 39 -0.285 5.870 -7.438 322 HA SER 39 HA SER 39 -1.036 7.522 -9.655 323 HB2 SER 39 HB2 SER 39 0.057 5.332 -9.976 324 HB3 SER 39 HB1 SER 39 -1.353 4.531 -9.283 325 HG SER 39 HG SER 39 -2.556 5.110 -11.036 326 H ARG 40 HN ARG 40 -2.789 5.474 -7.344 327 HA ARG 40 HA ARG 40 -5.314 5.886 -8.643 328 HB2 ARG 40 HB2 ARG 40 -4.760 4.799 -5.888 329 HB3 ARG 40 HB1 ARG 40 -6.261 4.641 -6.779 330 HG2 ARG 40 HG2 ARG 40 -4.807 3.451 -8.554 331 HG3 ARG 40 HG1 ARG 40 -3.650 3.270 -7.230 332 HD2 ARG 40 HD2 ARG 40 -5.178 1.338 -7.493 333 HD3 ARG 40 HD1 ARG 40 -5.224 2.114 -5.915 334 HE ARG 40 HE ARG 40 -7.422 2.571 -6.251 335 HH11 ARG 40 HH11 ARG 40 -5.934 2.040 -9.376 336 HH12 ARG 40 HH12 ARG 40 -7.429 2.153 -10.249 337 HH21 ARG 40 HH21 ARG 40 -9.396 2.678 -7.389 338 HH22 ARG 40 HH22 ARG 40 -9.398 2.521 -9.127 339 H GLU 41 HN GLU 41 -3.656 7.240 -5.859 340 HA GLU 41 HA GLU 41 -5.868 9.153 -5.501 341 HB2 GLU 41 HB2 GLU 41 -3.649 8.562 -3.558 342 HB3 GLU 41 HB1 GLU 41 -5.106 9.483 -3.248 343 HG2 GLU 41 HG2 GLU 41 -4.849 6.522 -3.668 344 HG3 GLU 41 HG1 GLU 41 -5.327 7.368 -2.201 345 HA PRO 42 HA PRO 42 -2.448 11.416 -7.651 346 HB2 PRO 42 HB2 PRO 42 -4.699 13.159 -8.442 347 HB3 PRO 42 HB1 PRO 42 -3.469 12.385 -9.444 348 HG2 PRO 42 HG2 PRO 42 -5.985 11.502 -9.444 349 HG3 PRO 42 HG1 PRO 42 -4.617 10.376 -9.537 350 HD2 PRO 42 HD2 PRO 42 -6.320 11.093 -7.176 351 HD3 PRO 42 HD1 PRO 42 -5.731 9.500 -7.698 352 H SER 43 HN SER 43 -4.667 12.319 -5.223 353 HA SER 43 HA SER 43 -3.956 15.048 -4.943 354 HB2 SER 43 HB2 SER 43 -5.061 13.153 -2.857 355 HB3 SER 43 HB1 SER 43 -5.094 14.915 -2.791 356 HG SER 43 HG SER 43 -7.063 13.860 -3.561 357 H LEU 44 HN LEU 44 -2.473 12.078 -3.923 358 HA LEU 44 HA LEU 44 -0.636 13.597 -2.203 359 HB2 LEU 44 HB2 LEU 44 -0.061 11.407 -1.180 360 HB3 LEU 44 HB1 LEU 44 -1.720 11.906 -0.935 361 HG LEU 44 HG LEU 44 -2.105 10.364 -3.069 362 HD11 LEU 44 HD11 LEU 44 0.306 9.867 -3.285 363 HD12 LEU 44 HD12 LEU 44 -0.685 8.427 -3.054 364 HD13 LEU 44 HD13 LEU 44 0.254 9.078 -1.709 365 HD21 LEU 44 HD21 LEU 44 -3.215 10.129 -0.919 366 HD22 LEU 44 HD22 LEU 44 -1.772 9.376 -0.241 367 HD23 LEU 44 HD23 LEU 44 -2.678 8.558 -1.512 368 H LYS 45 HN LYS 45 -0.693 12.914 -5.244 369 HA LYS 45 HA LYS 45 1.747 11.430 -5.560 370 HB2 LYS 45 HB2 LYS 45 1.470 11.635 -7.881 371 HB3 LYS 45 HB1 LYS 45 -0.163 11.529 -7.251 372 HG2 LYS 45 HG2 LYS 45 -0.363 13.971 -7.448 373 HG3 LYS 45 HG1 LYS 45 1.258 14.016 -8.152 374 HD2 LYS 45 HD2 LYS 45 0.320 12.267 -9.811 375 HD3 LYS 45 HD1 LYS 45 -1.257 12.851 -9.279 376 HE2 LYS 45 HE2 LYS 45 -0.687 15.099 -9.949 377 HE3 LYS 45 HE1 LYS 45 0.945 14.581 -10.371 378 HZ1 LYS 45 HZ1 LYS 45 -0.462 14.775 -12.326 379 HZ2 LYS 45 HZ2 LYS 45 -1.553 13.655 -11.685 380 HZ3 LYS 45 HZ3 LYS 45 0.013 13.168 -12.095 381 H ASN 46 HN ASN 46 1.144 14.445 -4.502 382 HA ASN 46 HA ASN 46 3.418 15.757 -5.728 383 HB2 ASN 46 HB2 ASN 46 1.504 16.632 -3.556 384 HB3 ASN 46 HB1 ASN 46 2.822 17.628 -4.163 385 HD21 ASN 46 HD21 ASN 46 -0.090 18.028 -4.217 386 HD22 ASN 46 HD22 ASN 46 -0.489 18.283 -5.880 387 H SER 47 HN SER 47 3.054 13.471 -3.419 388 HA SER 47 HA SER 47 5.001 14.423 -1.521 389 HB2 SER 47 HB2 SER 47 3.891 11.614 -1.885 390 HB3 SER 47 HB1 SER 47 4.749 12.244 -0.474 391 HG SER 47 HG SER 47 2.472 13.609 -1.325 392 H ASN 48 HN ASN 48 7.164 13.916 -1.451 393 HA ASN 48 HA ASN 48 8.532 13.149 -3.786 394 HB2 ASN 48 HB2 ASN 48 9.534 12.909 -0.930 395 HB3 ASN 48 HB1 ASN 48 10.528 12.977 -2.378 396 HD21 ASN 48 HD21 ASN 48 10.629 14.664 -0.076 397 HD22 ASN 48 HD22 ASN 48 10.342 16.275 -0.627 398 HA PRO 49 HA PRO 49 7.580 8.887 -3.917 399 HB2 PRO 49 HB2 PRO 49 9.865 8.020 -5.253 400 HB3 PRO 49 HB1 PRO 49 8.379 8.603 -6.000 401 HG2 PRO 49 HG2 PRO 49 10.951 10.010 -5.541 402 HG3 PRO 49 HG1 PRO 49 9.777 10.211 -6.850 403 HD2 PRO 49 HD2 PRO 49 10.041 11.982 -4.817 404 HD3 PRO 49 HD1 PRO 49 8.501 11.697 -5.646 405 H ASP 50 HN ASP 50 10.636 9.921 -2.546 406 HA ASP 50 HA ASP 50 11.161 7.333 -1.393 407 HB2 ASP 50 HB2 ASP 50 13.109 8.585 -1.861 408 HB3 ASP 50 HB1 ASP 50 12.473 10.029 -1.087 409 H GLU 51 HN GLU 51 9.603 10.291 -0.421 410 HA GLU 51 HA GLU 51 8.988 9.110 2.213 411 HB2 GLU 51 HB2 GLU 51 10.006 11.803 1.488 412 HB3 GLU 51 HB1 GLU 51 8.723 11.777 2.691 413 HG2 GLU 51 HG2 GLU 51 10.034 10.384 4.132 414 HG3 GLU 51 HG1 GLU 51 11.271 10.195 2.894 415 H ILE 52 HN ILE 52 7.108 8.305 0.839 416 HA ILE 52 HA ILE 52 5.398 10.333 -0.263 417 HB ILE 52 HB ILE 52 4.192 8.652 -1.316 418 HG12 ILE 52 HG12 ILE 52 5.342 6.477 0.353 419 HG13 ILE 52 HG11 ILE 52 3.927 7.371 0.914 420 HG21 ILE 52 HG21 ILE 52 6.857 7.315 -0.987 421 HG22 ILE 52 HG22 ILE 52 6.630 8.783 -1.948 422 HG23 ILE 52 HG23 ILE 52 5.791 7.299 -2.398 423 HD11 ILE 52 HD11 ILE 52 2.823 6.815 -1.236 424 HD12 ILE 52 HD12 ILE 52 3.173 5.417 -0.217 425 HD13 ILE 52 HD13 ILE 52 4.192 5.769 -1.612 426 H GLU 53 HN GLU 53 3.303 10.806 0.332 427 HA GLU 53 HA GLU 53 2.737 10.305 3.164 428 HB2 GLU 53 HB2 GLU 53 2.951 12.646 1.825 429 HB3 GLU 53 HB1 GLU 53 1.237 12.339 1.615 430 HG2 GLU 53 HG2 GLU 53 2.771 12.789 4.142 431 HG3 GLU 53 HG1 GLU 53 1.394 13.684 3.511 432 H ILE 54 HN ILE 54 1.380 8.601 3.372 433 HA ILE 54 HA ILE 54 -0.824 8.314 1.429 434 HB ILE 54 HB ILE 54 0.256 6.303 3.411 435 HG12 ILE 54 HG12 ILE 54 0.345 6.274 0.390 436 HG13 ILE 54 HG11 ILE 54 1.700 6.749 1.416 437 HG21 ILE 54 HG21 ILE 54 -1.250 4.736 2.173 438 HG22 ILE 54 HG22 ILE 54 -1.983 6.140 1.407 439 HG23 ILE 54 HG23 ILE 54 -2.085 5.935 3.156 440 HD11 ILE 54 HD11 ILE 54 1.749 4.401 0.555 441 HD12 ILE 54 HD12 ILE 54 0.364 4.067 1.590 442 HD13 ILE 54 HD13 ILE 54 1.897 4.568 2.297 443 H ASP 55 HN ASP 55 -2.906 8.586 2.064 444 HA ASP 55 HA ASP 55 -3.365 8.906 4.958 445 HB2 ASP 55 HB2 ASP 55 -3.654 11.028 3.636 446 HB3 ASP 55 HB1 ASP 55 -4.959 10.235 2.756 447 H PHE 56 HN PHE 56 -4.015 6.887 5.454 448 HA PHE 56 HA PHE 56 -5.318 5.201 3.622 449 HB2 PHE 56 HB2 PHE 56 -4.306 5.025 6.335 450 HB3 PHE 56 HB1 PHE 56 -5.746 4.040 6.081 451 HD1 PHE 56 HD1 PHE 56 -2.244 4.558 5.123 452 HD2 PHE 56 HD2 PHE 56 -5.734 2.211 4.555 453 HE1 PHE 56 HE1 PHE 56 -0.907 2.852 3.956 454 HE2 PHE 56 HE2 PHE 56 -4.423 0.512 3.399 455 HZ PHE 56 HZ PHE 56 -2.007 0.806 3.099 456 H GLU 57 HN GLU 57 -6.642 7.692 5.414 457 HA GLU 57 HA GLU 57 -9.229 6.390 5.677 458 HB2 GLU 57 HB2 GLU 57 -8.131 9.004 6.647 459 HB3 GLU 57 HB1 GLU 57 -9.832 8.581 6.801 460 HG2 GLU 57 HG2 GLU 57 -7.609 6.873 7.879 461 HG3 GLU 57 HG1 GLU 57 -8.390 8.146 8.815 462 H THR 58 HN THR 58 -7.618 8.007 3.303 463 HA THR 58 HA THR 58 -10.159 8.991 2.182 464 HB THR 58 HB THR 58 -8.831 10.677 0.913 465 HG1 THR 58 HG1 THR 58 -6.748 10.090 2.763 466 HG21 THR 58 HG21 THR 58 -8.666 10.766 3.919 467 HG22 THR 58 HG22 THR 58 -10.011 11.333 2.924 468 HG23 THR 58 HG23 THR 58 -8.454 12.162 2.861 469 H LEU 59 HN LEU 59 -7.494 6.911 1.757 470 HA LEU 59 HA LEU 59 -7.301 6.760 -1.041 471 HB2 LEU 59 HB2 LEU 59 -7.187 4.263 0.616 472 HB3 LEU 59 HB1 LEU 59 -6.255 4.695 -0.796 473 HG LEU 59 HG LEU 59 -5.881 5.768 1.991 474 HD11 LEU 59 HD11 LEU 59 -4.331 3.866 0.259 475 HD12 LEU 59 HD12 LEU 59 -4.974 3.613 1.881 476 HD13 LEU 59 HD13 LEU 59 -3.611 4.702 1.633 477 HD21 LEU 59 HD21 LEU 59 -4.634 6.581 -0.611 478 HD22 LEU 59 HD22 LEU 59 -3.828 6.837 0.928 479 HD23 LEU 59 HD23 LEU 59 -5.387 7.596 0.610 480 H LYS 60 HN LYS 60 -8.556 5.817 -2.574 481 HA LYS 60 HA LYS 60 -11.251 5.227 -2.113 482 HB2 LYS 60 HB2 LYS 60 -9.478 4.299 -4.385 483 HB3 LYS 60 HB1 LYS 60 -11.238 4.348 -4.412 484 HG2 LYS 60 HG2 LYS 60 -11.170 6.782 -4.214 485 HG3 LYS 60 HG1 LYS 60 -9.404 6.732 -4.166 486 HD2 LYS 60 HD2 LYS 60 -9.417 5.685 -6.408 487 HD3 LYS 60 HD1 LYS 60 -11.170 5.883 -6.459 488 HE2 LYS 60 HE2 LYS 60 -10.041 7.687 -7.654 489 HE3 LYS 60 HE1 LYS 60 -10.913 8.298 -6.250 490 HZ1 LYS 60 HZ1 LYS 60 -7.985 7.841 -6.467 491 HZ2 LYS 60 HZ2 LYS 60 -8.775 8.254 -5.028 492 HZ3 LYS 60 HZ3 LYS 60 -8.781 9.331 -6.334 493 HA PRO 61 HA PRO 61 -11.434 1.134 -0.451 494 HB2 PRO 61 HB2 PRO 61 -13.482 0.569 -2.524 495 HB3 PRO 61 HB1 PRO 61 -13.599 0.432 -0.771 496 HG2 PRO 61 HG2 PRO 61 -14.787 2.422 -2.156 497 HG3 PRO 61 HG1 PRO 61 -14.187 2.644 -0.507 498 HD2 PRO 61 HD2 PRO 61 -13.076 3.632 -3.071 499 HD3 PRO 61 HD1 PRO 61 -12.920 4.299 -1.436 500 H SER 62 HN SER 62 -11.444 1.528 -3.949 501 HA SER 62 HA SER 62 -10.566 -1.111 -4.541 502 HB2 SER 62 HB2 SER 62 -9.967 -0.053 -6.778 503 HB3 SER 62 HB1 SER 62 -11.658 0.057 -6.295 504 HG SER 62 HG SER 62 -11.475 2.140 -6.345 505 H THR 63 HN THR 63 -8.956 1.953 -3.944 506 HA THR 63 HA THR 63 -6.354 1.203 -4.669 507 HB THR 63 HB THR 63 -6.991 3.110 -2.398 508 HG1 THR 63 HG1 THR 63 -7.094 4.683 -4.235 509 HG21 THR 63 HG21 THR 63 -4.610 2.518 -2.959 510 HG22 THR 63 HG22 THR 63 -4.999 4.230 -3.054 511 HG23 THR 63 HG23 THR 63 -4.860 3.275 -4.525 512 H LEU 64 HN LEU 64 -8.037 1.093 -1.543 513 HA LEU 64 HA LEU 64 -5.999 -0.096 -0.047 514 HB2 LEU 64 HB2 LEU 64 -8.998 -0.313 0.211 515 HB3 LEU 64 HB1 LEU 64 -7.876 -0.932 1.407 516 HG LEU 64 HG LEU 64 -8.045 1.967 0.599 517 HD11 LEU 64 HD11 LEU 64 -10.107 1.251 1.722 518 HD12 LEU 64 HD12 LEU 64 -9.153 2.330 2.733 519 HD13 LEU 64 HD13 LEU 64 -9.144 0.596 3.045 520 HD21 LEU 64 HD21 LEU 64 -5.877 1.411 1.437 521 HD22 LEU 64 HD22 LEU 64 -6.581 0.534 2.790 522 HD23 LEU 64 HD23 LEU 64 -6.758 2.284 2.686 523 H ARG 65 HN ARG 65 -8.455 -1.560 -2.109 524 HA ARG 65 HA ARG 65 -7.763 -4.225 -1.270 525 HB2 ARG 65 HB2 ARG 65 -9.819 -2.989 -2.914 526 HB3 ARG 65 HB1 ARG 65 -9.260 -4.508 -3.571 527 HG2 ARG 65 HG2 ARG 65 -10.409 -4.043 -0.829 528 HG3 ARG 65 HG1 ARG 65 -11.199 -4.888 -2.165 529 HD2 ARG 65 HD2 ARG 65 -9.231 -6.521 -2.046 530 HD3 ARG 65 HD1 ARG 65 -8.852 -5.770 -0.498 531 HE ARG 65 HE ARG 65 -11.565 -6.471 -0.521 532 HH11 ARG 65 HH11 ARG 65 -8.403 -7.960 -0.317 533 HH12 ARG 65 HH12 ARG 65 -8.998 -9.406 0.424 534 HH21 ARG 65 HH21 ARG 65 -12.340 -8.365 0.481 535 HH22 ARG 65 HH22 ARG 65 -11.229 -9.631 0.893 536 H GLU 66 HN GLU 66 -6.545 -2.020 -3.574 537 HA GLU 66 HA GLU 66 -5.303 -4.112 -5.148 538 HB2 GLU 66 HB2 GLU 66 -6.034 -2.145 -6.324 539 HB3 GLU 66 HB1 GLU 66 -5.125 -1.098 -5.241 540 HG2 GLU 66 HG2 GLU 66 -3.972 -1.250 -7.320 541 HG3 GLU 66 HG1 GLU 66 -3.033 -2.114 -6.100 542 H LEU 67 HN LEU 67 -4.516 -1.766 -2.658 543 HA LEU 67 HA LEU 67 -1.722 -2.192 -2.619 544 HB2 LEU 67 HB2 LEU 67 -3.552 -1.337 -0.367 545 HB3 LEU 67 HB1 LEU 67 -1.817 -1.081 -0.418 546 HG LEU 67 HG LEU 67 -3.893 0.221 -2.193 547 HD11 LEU 67 HD11 LEU 67 -2.048 1.395 -0.124 548 HD12 LEU 67 HD12 LEU 67 -3.760 1.048 0.129 549 HD13 LEU 67 HD13 LEU 67 -3.271 2.253 -1.063 550 HD21 LEU 67 HD21 LEU 67 -1.702 -0.321 -3.313 551 HD22 LEU 67 HD22 LEU 67 -0.949 0.787 -2.166 552 HD23 LEU 67 HD23 LEU 67 -2.168 1.377 -3.290 553 H GLU 68 HN GLU 68 -4.436 -3.454 -0.734 554 HA GLU 68 HA GLU 68 -2.871 -5.131 0.934 555 HB2 GLU 68 HB2 GLU 68 -5.165 -4.322 1.497 556 HB3 GLU 68 HB1 GLU 68 -5.809 -5.418 0.282 557 HG2 GLU 68 HG2 GLU 68 -4.359 -7.154 1.696 558 HG3 GLU 68 HG1 GLU 68 -4.719 -5.985 2.966 559 H ARG 69 HN ARG 69 -5.017 -5.910 -1.833 560 HA ARG 69 HA ARG 69 -4.560 -8.640 -1.942 561 HB2 ARG 69 HB2 ARG 69 -6.222 -7.435 -3.325 562 HB3 ARG 69 HB1 ARG 69 -4.913 -6.840 -4.337 563 HG2 ARG 69 HG2 ARG 69 -4.324 -9.318 -4.657 564 HG3 ARG 69 HG1 ARG 69 -5.948 -9.627 -4.045 565 HD2 ARG 69 HD2 ARG 69 -5.858 -9.535 -6.510 566 HD3 ARG 69 HD1 ARG 69 -6.934 -8.330 -5.806 567 HE ARG 69 HE ARG 69 -4.815 -6.833 -6.099 568 HH11 ARG 69 HH11 ARG 69 -5.965 -9.303 -8.298 569 HH12 ARG 69 HH12 ARG 69 -5.351 -8.504 -9.710 570 HH21 ARG 69 HH21 ARG 69 -4.024 -5.765 -7.957 571 HH22 ARG 69 HH22 ARG 69 -4.251 -6.504 -9.520 572 H TYR 70 HN TYR 70 -2.540 -6.046 -3.122 573 HA TYR 70 HA TYR 70 -0.794 -7.785 -4.579 574 HB2 TYR 70 HB2 TYR 70 -0.913 -5.546 -5.355 575 HB3 TYR 70 HB1 TYR 70 -0.604 -4.891 -3.751 576 HD1 TYR 70 HD2 TYR 70 0.969 -6.762 -6.544 577 HD2 TYR 70 HD1 TYR 70 1.561 -4.478 -3.013 578 HE1 TYR 70 HE2 TYR 70 3.372 -6.658 -7.036 579 HE2 TYR 70 HE1 TYR 70 3.973 -4.350 -3.499 580 HH TYR 70 HH TYR 70 5.650 -5.311 -4.746 581 H VAL 71 HN VAL 71 -0.555 -6.099 -1.423 582 HA VAL 71 HA VAL 71 2.063 -7.099 -0.933 583 HB VAL 71 HB VAL 71 1.797 -6.347 1.361 584 HG11 VAL 71 HG11 VAL 71 0.609 -4.013 0.278 585 HG12 VAL 71 HG12 VAL 71 1.588 -4.769 -0.968 586 HG13 VAL 71 HG13 VAL 71 2.308 -4.340 0.583 587 HG21 VAL 71 HG21 VAL 71 -0.401 -6.894 1.954 588 HG22 VAL 71 HG22 VAL 71 -1.081 -5.974 0.615 589 HG23 VAL 71 HG23 VAL 71 -0.334 -5.133 1.975 590 H THR 72 HN THR 72 -1.152 -8.197 0.057 591 HA THR 72 HA THR 72 -0.310 -10.253 1.751 592 HB THR 72 HB THR 72 -2.674 -9.352 1.475 593 HG1 THR 72 HG1 THR 72 -2.391 -11.098 2.812 594 HG21 THR 72 HG21 THR 72 -2.754 -9.715 -0.986 595 HG22 THR 72 HG22 THR 72 -4.124 -10.396 -0.111 596 HG23 THR 72 HG23 THR 72 -2.831 -11.449 -0.682 597 H SER 73 HN SER 73 -0.450 -10.074 -1.725 598 HA SER 73 HA SER 73 -0.153 -12.833 -2.261 599 HB2 SER 73 HB2 SER 73 0.172 -12.229 -4.492 600 HB3 SER 73 HB1 SER 73 -0.716 -10.837 -3.871 601 HG SER 73 HG SER 73 1.186 -9.687 -3.737 602 H CYS 74 HN CYS 74 2.022 -10.346 -1.273 603 HA CYS 74 HA CYS 74 4.400 -11.887 -1.904 604 HB2 CYS 74 HB2 CYS 74 4.389 -9.461 -2.304 605 HB3 CYS 74 HB1 CYS 74 4.097 -9.169 -0.590 606 HG CYS 74 HG CYS 74 6.601 -10.368 0.139 607 H LEU 75 HN LEU 75 2.806 -10.562 0.986 608 HA LEU 75 HA LEU 75 4.561 -11.560 2.911 609 HB2 LEU 75 HB2 LEU 75 1.641 -11.457 3.492 610 HB3 LEU 75 HB1 LEU 75 2.991 -10.951 4.484 611 HG LEU 75 HG LEU 75 2.109 -9.473 2.028 612 HD11 LEU 75 HD11 LEU 75 1.562 -8.642 4.841 613 HD12 LEU 75 HD12 LEU 75 0.440 -9.672 3.956 614 HD13 LEU 75 HD13 LEU 75 0.833 -8.072 3.341 615 HD21 LEU 75 HD21 LEU 75 4.452 -9.213 2.802 616 HD22 LEU 75 HD22 LEU 75 3.831 -8.614 4.337 617 HD23 LEU 75 HD23 LEU 75 3.509 -7.725 2.849 618 H ARG 76 HN ARG 76 1.825 -13.095 1.315 619 HA ARG 76 HA ARG 76 1.892 -15.398 3.041 620 HB2 ARG 76 HB2 ARG 76 0.334 -14.758 0.547 621 HB3 ARG 76 HB1 ARG 76 0.197 -16.296 1.395 622 HG2 ARG 76 HG2 ARG 76 -0.643 -15.230 3.344 623 HG3 ARG 76 HG1 ARG 76 -0.279 -13.631 2.696 624 HD2 ARG 76 HD2 ARG 76 -2.647 -14.097 2.504 625 HD3 ARG 76 HD1 ARG 76 -1.909 -14.002 0.906 626 HE ARG 76 HE ARG 76 -1.827 -16.632 1.383 627 HH11 ARG 76 HH11 ARG 76 -4.431 -14.312 1.711 628 HH12 ARG 76 HH12 ARG 76 -5.675 -15.476 1.395 629 HH21 ARG 76 HH21 ARG 76 -3.466 -18.162 0.956 630 HH22 ARG 76 HH22 ARG 76 -5.128 -17.664 0.967 631 H LYS 77 HN LYS 77 3.999 -14.430 0.887 632 HA LYS 77 HA LYS 77 4.774 -17.171 0.213 633 HB2 LYS 77 HB2 LYS 77 4.816 -14.772 -1.608 634 HB3 LYS 77 HB1 LYS 77 5.784 -16.211 -1.914 635 HG2 LYS 77 HG2 LYS 77 3.858 -17.565 -2.137 636 HG3 LYS 77 HG1 LYS 77 2.815 -16.282 -1.536 637 HD2 LYS 77 HD2 LYS 77 3.472 -14.930 -3.542 638 HD3 LYS 77 HD1 LYS 77 4.323 -16.352 -4.149 639 HE2 LYS 77 HE2 LYS 77 1.374 -16.162 -3.545 640 HE3 LYS 77 HE1 LYS 77 2.106 -16.163 -5.147 641 HZ1 LYS 77 HZ1 LYS 77 2.913 -18.397 -4.750 642 HZ2 LYS 77 HZ2 LYS 77 1.235 -18.337 -4.546 643 HZ3 LYS 77 HZ3 LYS 77 2.247 -18.396 -3.194 644 H LYS 78 HN LYS 78 7.292 -16.793 -0.727 645 HA LYS 78 HA LYS 78 8.595 -15.522 1.535 646 HB2 LYS 78 HB2 LYS 78 9.361 -17.579 -0.420 647 HB3 LYS 78 HB1 LYS 78 10.652 -16.482 0.032 648 HG2 LYS 78 HG2 LYS 78 10.689 -18.427 1.453 649 HG3 LYS 78 HG1 LYS 78 10.264 -17.001 2.395 650 HD2 LYS 78 HD2 LYS 78 8.844 -18.789 3.091 651 HD3 LYS 78 HD1 LYS 78 7.864 -17.657 2.159 652 HE2 LYS 78 HE2 LYS 78 8.073 -19.099 0.195 653 HE3 LYS 78 HE1 LYS 78 9.054 -20.228 1.126 654 HZ1 LYS 78 HZ1 LYS 78 6.229 -19.518 1.698 655 HZ2 LYS 78 HZ2 LYS 78 7.172 -20.600 2.590 656 HZ3 LYS 78 HZ3 LYS 78 6.762 -20.959 0.990 657 H ARG 79 HN ARG 79 10.052 -15.562 -1.667 658 HA ARG 79 HA ARG 79 10.891 -13.902 -2.981 659 HB2 ARG 79 HB2 ARG 79 8.233 -12.738 -2.188 660 HB3 ARG 79 HB1 ARG 79 9.316 -11.904 -3.290 661 HG2 ARG 79 HG2 ARG 79 7.716 -13.059 -4.598 662 HG3 ARG 79 HG1 ARG 79 9.243 -13.919 -4.764 663 HD2 ARG 79 HD2 ARG 79 8.518 -15.654 -3.318 664 HD3 ARG 79 HD1 ARG 79 7.107 -14.730 -2.805 665 HE ARG 79 HE ARG 79 6.316 -14.976 -5.160 666 HH11 ARG 79 HH11 ARG 79 8.556 -17.308 -3.804 667 HH12 ARG 79 HH12 ARG 79 8.052 -18.583 -4.861 668 HH21 ARG 79 HH21 ARG 79 5.650 -16.650 -6.527 669 HH22 ARG 79 HH22 ARG 79 6.391 -18.214 -6.404 670 H LYS 80 HN LYS 80 12.688 -13.465 -1.567 671 HA LYS 80 HA LYS 80 12.618 -10.764 -0.483 672 HB2 LYS 80 HB2 LYS 80 13.499 -13.156 1.149 673 HB3 LYS 80 HB1 LYS 80 13.750 -11.481 1.614 674 HG2 LYS 80 HG2 LYS 80 11.344 -11.140 1.736 675 HG3 LYS 80 HG1 LYS 80 11.072 -12.807 1.226 676 HD2 LYS 80 HD2 LYS 80 12.293 -13.574 3.240 677 HD3 LYS 80 HD1 LYS 80 12.439 -11.894 3.759 678 HE2 LYS 80 HE2 LYS 80 9.850 -13.376 3.298 679 HE3 LYS 80 HE1 LYS 80 10.578 -13.053 4.870 680 HZ1 LYS 80 HZ1 LYS 80 9.668 -10.982 2.947 681 HZ2 LYS 80 HZ2 LYS 80 10.323 -10.692 4.476 682 HZ3 LYS 80 HZ3 LYS 80 8.827 -11.467 4.330 683 HA PRO 81 HA PRO 81 16.411 -12.093 -2.915 684 HB2 PRO 81 HB2 PRO 81 16.408 -9.944 -4.598 685 HB3 PRO 81 HB1 PRO 81 15.549 -11.451 -4.938 686 HG2 PRO 81 HG2 PRO 81 14.499 -8.880 -3.833 687 HG3 PRO 81 HG1 PRO 81 13.781 -9.949 -5.054 688 HD2 PRO 81 HD2 PRO 81 12.956 -9.944 -2.486 689 HD3 PRO 81 HD1 PRO 81 12.977 -11.426 -3.464 690 H GLN 82 HN GLN 82 15.421 -8.870 -1.868 691 HA GLN 82 HA GLN 82 18.066 -8.507 -0.662 692 HB2 GLN 82 HB2 GLN 82 18.114 -7.274 -2.770 693 HB3 GLN 82 HB1 GLN 82 16.619 -6.456 -2.350 694 HG2 GLN 82 HG2 GLN 82 17.702 -5.308 -0.532 695 HG3 GLN 82 HG1 GLN 82 19.192 -6.204 -0.813 696 HE21 GLN 82 HE21 GLN 82 17.249 -5.100 -3.469 697 HE22 GLN 82 HE22 GLN 82 18.319 -3.846 -3.990 698 H ALA 83 HN ALA 83 17.132 -8.987 1.303 699 HA ALA 83 HA ALA 83 15.612 -6.816 2.505 700 HB1 ALA 83 HB1 ALA 83 13.905 -8.410 1.744 701 HB2 ALA 83 HB2 ALA 83 13.977 -8.319 3.504 702 HB3 ALA 83 HB3 ALA 83 14.700 -9.690 2.662 703 H1 GLU 201 HT1 GLU 201 -6.949 9.403 13.062 704 H2 GLU 201 HT2 GLU 201 -5.581 8.549 13.567 705 H3 GLU 201 HT3 GLU 201 -6.851 7.738 12.804 706 HA GLU 201 HA GLU 201 -6.439 8.826 10.755 707 HB2 GLU 201 HB2 GLU 201 -4.563 10.393 10.510 708 HB3 GLU 201 HB1 GLU 201 -5.750 10.994 11.656 709 HG2 GLU 201 HG2 GLU 201 -4.310 10.197 13.501 710 HG3 GLU 201 HG1 GLU 201 -3.104 9.719 12.309 711 H ILE 202 HN ILE 202 -5.170 7.750 9.286 712 HA ILE 202 HA ILE 202 -2.969 6.126 10.378 713 HB ILE 202 HB ILE 202 -5.022 5.207 8.353 714 HG12 ILE 202 HG12 ILE 202 -5.808 5.211 10.723 715 HG13 ILE 202 HG11 ILE 202 -5.741 3.603 10.011 716 HG21 ILE 202 HG21 ILE 202 -3.846 3.053 8.420 717 HG22 ILE 202 HG22 ILE 202 -2.623 3.759 9.476 718 HG23 ILE 202 HG23 ILE 202 -2.807 4.348 7.824 719 HD11 ILE 202 HD11 ILE 202 -3.661 3.154 11.184 720 HD12 ILE 202 HD12 ILE 202 -4.933 3.625 12.312 721 HD13 ILE 202 HD13 ILE 202 -3.681 4.782 11.861 722 H LYS 203 HN LYS 203 -1.208 7.034 9.527 723 HA LYS 203 HA LYS 203 -1.253 7.754 6.668 724 HB2 LYS 203 HB2 LYS 203 0.491 9.122 8.707 725 HB3 LYS 203 HB1 LYS 203 0.082 9.659 7.085 726 HG2 LYS 203 HG2 LYS 203 -2.270 9.965 7.861 727 HG3 LYS 203 HG1 LYS 203 -1.717 9.604 9.494 728 HD2 LYS 203 HD2 LYS 203 -1.783 11.972 9.274 729 HD3 LYS 203 HD1 LYS 203 -0.086 11.493 9.258 730 HE2 LYS 203 HE2 LYS 203 -0.099 11.620 6.801 731 HE3 LYS 203 HE1 LYS 203 -1.780 12.145 6.850 732 HZ1 LYS 203 HZ1 LYS 203 0.522 13.595 8.032 733 HZ2 LYS 203 HZ2 LYS 203 -1.089 14.106 8.083 734 HZ3 LYS 203 HZ3 LYS 203 -0.280 14.010 6.604 735 H LEU 204 HN LEU 204 0.282 6.794 5.451 736 HA LEU 204 HA LEU 204 2.416 5.344 6.882 737 HB2 LEU 204 HB2 LEU 204 0.523 4.264 5.246 738 HB3 LEU 204 HB1 LEU 204 1.817 4.570 4.107 739 HG LEU 204 HG LEU 204 1.896 2.783 6.534 740 HD11 LEU 204 HD11 LEU 204 2.417 2.176 3.633 741 HD12 LEU 204 HD12 LEU 204 0.876 1.915 4.447 742 HD13 LEU 204 HD13 LEU 204 2.308 1.028 4.967 743 HD21 LEU 204 HD21 LEU 204 4.221 3.293 4.699 744 HD22 LEU 204 HD22 LEU 204 4.196 2.392 6.214 745 HD23 LEU 204 HD23 LEU 204 4.011 4.146 6.227 746 H LYS 205 HN LYS 205 4.089 6.745 6.810 747 HA LYS 205 HA LYS 205 4.875 8.014 4.327 748 HB2 LYS 205 HB2 LYS 205 6.057 7.933 7.098 749 HB3 LYS 205 HB1 LYS 205 6.931 8.630 5.744 750 HG2 LYS 205 HG2 LYS 205 4.235 9.551 6.714 751 HG3 LYS 205 HG1 LYS 205 5.778 10.306 7.118 752 HD2 LYS 205 HD2 LYS 205 6.108 10.473 4.567 753 HD3 LYS 205 HD1 LYS 205 4.370 10.180 4.475 754 HE2 LYS 205 HE2 LYS 205 5.781 12.445 5.866 755 HE3 LYS 205 HE1 LYS 205 4.742 12.543 4.447 756 HZ1 LYS 205 HZ1 LYS 205 3.929 11.888 7.224 757 HZ2 LYS 205 HZ2 LYS 205 2.900 11.703 5.889 758 HZ3 LYS 205 HZ3 LYS 205 3.478 13.239 6.310 759 H ILE 206 HN ILE 206 4.986 5.799 3.242 760 HA ILE 206 HA ILE 206 6.976 3.947 4.018 761 HB ILE 206 HB ILE 206 6.435 4.238 1.095 762 HG12 ILE 206 HG12 ILE 206 4.469 2.846 2.904 763 HG13 ILE 206 HG11 ILE 206 4.172 4.460 2.249 764 HG21 ILE 206 HG21 ILE 206 6.113 1.634 2.288 765 HG22 ILE 206 HG22 ILE 206 7.620 2.402 2.825 766 HG23 ILE 206 HG23 ILE 206 7.303 2.201 1.102 767 HD11 ILE 206 HD11 ILE 206 4.893 2.882 0.059 768 HD12 ILE 206 HD12 ILE 206 3.277 3.438 0.485 769 HD13 ILE 206 HD13 ILE 206 3.837 1.867 1.040 770 H THR 207 HN THR 207 9.124 4.145 3.947 771 HA THR 207 HA THR 207 10.269 6.230 2.224 772 HB THR 207 HB THR 207 12.315 5.769 3.795 773 HG1 THR 207 HG1 THR 207 11.800 4.243 5.191 774 HG21 THR 207 HG21 THR 207 9.839 7.200 4.768 775 HG22 THR 207 HG22 THR 207 11.079 7.878 3.711 776 HG23 THR 207 HG23 THR 207 11.477 7.450 5.376 777 H LYS 208 HN LYS 208 11.233 5.556 0.416 778 HA LYS 208 HA LYS 208 13.152 3.578 0.270 779 HB2 LYS 208 HB2 LYS 208 12.150 1.685 -0.734 780 HB3 LYS 208 HB1 LYS 208 11.176 2.061 0.671 781 HG2 LYS 208 HG2 LYS 208 10.467 2.733 -2.181 782 HG3 LYS 208 HG1 LYS 208 9.836 1.376 -1.258 783 HD2 LYS 208 HD2 LYS 208 8.141 2.820 -0.863 784 HD3 LYS 208 HD1 LYS 208 9.223 3.411 0.400 785 HE2 LYS 208 HE2 LYS 208 10.127 5.054 -1.200 786 HE3 LYS 208 HE1 LYS 208 8.951 4.504 -2.390 787 HZ1 LYS 208 HZ1 LYS 208 8.214 6.484 -1.285 788 HZ2 LYS 208 HZ2 LYS 208 8.323 5.738 0.234 789 HZ3 LYS 208 HZ3 LYS 208 7.187 5.196 -0.900 790 H THR 209 HN THR 209 12.633 2.625 -2.391 791 HA THR 209 HA THR 209 13.137 3.166 -4.510 792 HB THR 209 HB THR 209 11.988 5.127 -5.556 793 HG1 THR 209 HG1 THR 209 11.792 6.025 -3.125 794 HG21 THR 209 HG21 THR 209 10.137 3.406 -3.926 795 HG22 THR 209 HG22 THR 209 10.977 2.851 -5.373 796 HG23 THR 209 HG23 THR 209 9.802 4.162 -5.482 797 H ILE 210 HN ILE 210 15.045 3.852 -2.638 798 HA ILE 210 HA ILE 210 16.213 6.296 -3.780 799 HB ILE 210 HB ILE 210 17.835 6.165 -1.883 800 HG12 ILE 210 HG12 ILE 210 15.947 4.022 -0.876 801 HG13 ILE 210 HG11 ILE 210 17.604 3.760 -1.406 802 HG21 ILE 210 HG21 ILE 210 15.910 7.645 -1.798 803 HG22 ILE 210 HG22 ILE 210 16.273 7.002 -0.198 804 HG23 ILE 210 HG23 ILE 210 14.924 6.347 -1.127 805 HD11 ILE 210 HD11 ILE 210 18.395 5.182 0.428 806 HD12 ILE 210 HD12 ILE 210 17.479 3.789 1.003 807 HD13 ILE 210 HD13 ILE 210 16.729 5.386 0.968 808 H GLN 211 HN GLN 211 16.286 2.963 -3.913 809 HA GLN 211 HA GLN 211 18.829 3.017 -5.378 810 HB2 GLN 211 HB2 GLN 211 17.973 1.006 -3.292 811 HB3 GLN 211 HB1 GLN 211 19.260 0.694 -4.448 812 HG2 GLN 211 HG2 GLN 211 19.263 3.008 -2.530 813 HG3 GLN 211 HG1 GLN 211 20.013 1.449 -2.193 814 HE21 GLN 211 HE21 GLN 211 20.147 4.341 -4.130 815 HE22 GLN 211 HE22 GLN 211 21.764 4.111 -4.707 816 H ASN 212 HN ASN 212 16.051 3.145 -6.208 817 HA ASN 212 HA ASN 212 16.025 0.846 -8.002 818 HB2 ASN 212 HB2 ASN 212 14.571 0.212 -6.089 819 HB3 ASN 212 HB1 ASN 212 13.596 1.647 -6.378 820 HD21 ASN 212 HD21 ASN 212 12.221 1.706 -8.146 821 HD22 ASN 212 HD22 ASN 212 11.814 0.291 -9.050 Start of MODEL 3 1 H1 SER 1 HT1 SER 1 -12.346 -7.755 -13.000 2 H2 SER 1 HT2 SER 1 -13.949 -7.234 -13.090 3 H3 SER 1 HT3 SER 1 -13.268 -7.599 -11.592 4 HA SER 1 HA SER 1 -11.685 -5.790 -11.863 5 HB2 SER 1 HB2 SER 1 -13.379 -5.123 -14.282 6 HB3 SER 1 HB1 SER 1 -12.020 -4.184 -13.666 7 HG SER 1 HG SER 1 -10.803 -5.402 -14.849 8 H GLU 2 HN GLU 2 -15.162 -5.836 -12.550 9 HA GLU 2 HA GLU 2 -15.768 -3.307 -11.518 10 HB2 GLU 2 HB2 GLU 2 -17.531 -5.755 -11.687 11 HB3 GLU 2 HB1 GLU 2 -18.095 -4.124 -11.370 12 HG2 GLU 2 HG2 GLU 2 -17.336 -3.387 -13.537 13 HG3 GLU 2 HG1 GLU 2 -16.650 -4.977 -13.862 14 H GLU 3 HN GLU 3 -15.382 -6.386 -9.855 15 HA GLU 3 HA GLU 3 -16.632 -5.357 -7.470 16 HB2 GLU 3 HB2 GLU 3 -15.420 -7.981 -8.216 17 HB3 GLU 3 HB1 GLU 3 -15.732 -7.607 -6.526 18 HG2 GLU 3 HG2 GLU 3 -17.759 -7.632 -8.749 19 HG3 GLU 3 HG1 GLU 3 -17.577 -8.841 -7.477 20 H GLU 4 HN GLU 4 -13.384 -5.522 -8.692 21 HA GLU 4 HA GLU 4 -12.322 -5.023 -6.031 22 HB2 GLU 4 HB2 GLU 4 -10.107 -5.030 -7.048 23 HB3 GLU 4 HB1 GLU 4 -11.009 -6.469 -7.497 24 HG2 GLU 4 HG2 GLU 4 -11.486 -5.486 -9.682 25 HG3 GLU 4 HG1 GLU 4 -10.570 -4.048 -9.228 26 H ASP 5 HN ASP 5 -12.926 -3.259 -9.030 27 HA ASP 5 HA ASP 5 -11.700 -0.862 -7.993 28 HB2 ASP 5 HB2 ASP 5 -13.305 -1.364 -10.510 29 HB3 ASP 5 HB1 ASP 5 -12.673 0.224 -10.068 30 H LYS 6 HN LYS 6 -14.735 -2.355 -7.673 31 HA LYS 6 HA LYS 6 -15.801 0.131 -6.527 32 HB2 LYS 6 HB2 LYS 6 -16.943 -0.477 -8.667 33 HB3 LYS 6 HB1 LYS 6 -17.440 -1.991 -7.931 34 HG2 LYS 6 HG2 LYS 6 -19.284 -0.462 -7.880 35 HG3 LYS 6 HG1 LYS 6 -18.709 -0.681 -6.228 36 HD2 LYS 6 HD2 LYS 6 -17.569 1.576 -7.780 37 HD3 LYS 6 HD1 LYS 6 -19.247 1.718 -7.261 38 HE2 LYS 6 HE2 LYS 6 -18.588 1.353 -4.953 39 HE3 LYS 6 HE1 LYS 6 -16.914 1.122 -5.442 40 HZ1 LYS 6 HZ1 LYS 6 -18.434 3.626 -5.899 41 HZ2 LYS 6 HZ2 LYS 6 -16.774 3.382 -6.125 42 HZ3 LYS 6 HZ3 LYS 6 -17.428 3.365 -4.565 43 H CYS 7 HN CYS 7 -14.243 -1.852 -5.307 44 HA CYS 7 HA CYS 7 -15.845 -3.700 -3.837 45 HB2 CYS 7 HB2 CYS 7 -13.357 -3.882 -4.344 46 HB3 CYS 7 HB1 CYS 7 -13.104 -2.695 -3.065 47 HG CYS 7 HG CYS 7 -13.579 -5.957 -2.828 48 H LYS 8 HN LYS 8 -15.804 -3.678 -1.408 49 HA LYS 8 HA LYS 8 -16.832 -1.112 -0.506 50 HB2 LYS 8 HB2 LYS 8 -17.052 -3.939 0.448 51 HB3 LYS 8 HB1 LYS 8 -17.333 -2.631 1.586 52 HG2 LYS 8 HG2 LYS 8 -19.412 -3.464 0.604 53 HG3 LYS 8 HG1 LYS 8 -19.126 -1.771 0.209 54 HD2 LYS 8 HD2 LYS 8 -18.328 -2.405 -2.003 55 HD3 LYS 8 HD1 LYS 8 -18.546 -4.111 -1.607 56 HE2 LYS 8 HE2 LYS 8 -20.767 -2.073 -1.619 57 HE3 LYS 8 HE1 LYS 8 -20.385 -3.128 -2.978 58 HZ1 LYS 8 HZ1 LYS 8 -22.178 -4.024 -1.634 59 HZ2 LYS 8 HZ2 LYS 8 -21.187 -4.031 -0.266 60 HZ3 LYS 8 HZ3 LYS 8 -20.826 -5.041 -1.573 61 HA PRO 9 HA PRO 9 -13.211 0.059 1.704 62 HB2 PRO 9 HB2 PRO 9 -14.936 1.014 3.872 63 HB3 PRO 9 HB1 PRO 9 -13.807 1.909 2.850 64 HG2 PRO 9 HG2 PRO 9 -16.485 2.143 2.591 65 HG3 PRO 9 HG1 PRO 9 -15.373 2.301 1.221 66 HD2 PRO 9 HD2 PRO 9 -17.149 0.032 1.972 67 HD3 PRO 9 HD1 PRO 9 -16.658 0.601 0.366 68 H MET 10 HN MET 10 -11.893 -0.957 3.038 69 HA MET 10 HA MET 10 -12.883 -3.013 4.791 70 HB2 MET 10 HB2 MET 10 -10.488 -3.440 5.240 71 HB3 MET 10 HB1 MET 10 -10.863 -3.443 3.527 72 HG2 MET 10 HG2 MET 10 -9.996 -1.172 3.332 73 HG3 MET 10 HG1 MET 10 -9.596 -1.195 5.045 74 HE1 MET 10 HE1 MET 10 -8.998 -2.971 1.609 75 HE2 MET 10 HE2 MET 10 -9.216 -4.349 2.689 76 HE3 MET 10 HE3 MET 10 -7.636 -4.029 1.976 77 H SER 11 HN SER 11 -12.310 -3.123 7.032 78 HA SER 11 HA SER 11 -13.141 -0.766 8.370 79 HB2 SER 11 HB2 SER 11 -12.882 -2.154 10.430 80 HB3 SER 11 HB1 SER 11 -13.851 -2.926 9.177 81 HG SER 11 HG SER 11 -11.980 -4.133 8.583 82 H TYR 12 HN TYR 12 -11.962 -0.313 10.601 83 HA TYR 12 HA TYR 12 -9.623 1.128 9.942 84 HB2 TYR 12 HB2 TYR 12 -11.284 1.628 11.785 85 HB3 TYR 12 HB1 TYR 12 -10.523 0.342 12.722 86 HD1 TYR 12 HD1 TYR 12 -8.059 0.599 13.306 87 HD2 TYR 12 HD2 TYR 12 -10.394 3.781 11.739 88 HE1 TYR 12 HE1 TYR 12 -6.422 2.218 14.176 89 HE2 TYR 12 HE2 TYR 12 -8.765 5.407 12.586 90 HH TYR 12 HH TYR 12 -7.053 5.649 14.142 91 H GLU 13 HN GLU 13 -10.129 -1.960 11.576 92 HA GLU 13 HA GLU 13 -7.500 -2.479 12.372 93 HB2 GLU 13 HB2 GLU 13 -9.517 -3.797 13.047 94 HB3 GLU 13 HB1 GLU 13 -9.541 -4.512 11.440 95 HG2 GLU 13 HG2 GLU 13 -7.233 -5.367 11.884 96 HG3 GLU 13 HG1 GLU 13 -7.422 -4.817 13.547 97 H GLU 14 HN GLU 14 -9.157 -3.022 9.331 98 HA GLU 14 HA GLU 14 -7.061 -4.580 8.156 99 HB2 GLU 14 HB2 GLU 14 -9.492 -3.228 6.985 100 HB3 GLU 14 HB1 GLU 14 -8.393 -4.229 6.048 101 HG2 GLU 14 HG2 GLU 14 -8.974 -6.174 7.266 102 HG3 GLU 14 HG1 GLU 14 -9.830 -5.230 8.490 103 H LYS 15 HN LYS 15 -8.206 -1.231 7.716 104 HA LYS 15 HA LYS 15 -6.297 -0.410 5.867 105 HB2 LYS 15 HB2 LYS 15 -7.778 1.096 8.016 106 HB3 LYS 15 HB1 LYS 15 -6.685 1.892 6.897 107 HG2 LYS 15 HG2 LYS 15 -8.035 1.359 5.031 108 HG3 LYS 15 HG1 LYS 15 -8.995 0.226 5.988 109 HD2 LYS 15 HD2 LYS 15 -10.195 1.877 7.013 110 HD3 LYS 15 HD1 LYS 15 -8.903 3.068 6.866 111 HE2 LYS 15 HE2 LYS 15 -9.348 3.339 4.525 112 HE3 LYS 15 HE1 LYS 15 -10.515 2.018 4.541 113 HZ1 LYS 15 HZ1 LYS 15 -11.920 3.341 6.004 114 HZ2 LYS 15 HZ2 LYS 15 -11.592 4.184 4.575 115 HZ3 LYS 15 HZ3 LYS 15 -10.784 4.595 6.003 116 H ARG 16 HN ARG 16 -6.166 -0.375 9.409 117 HA ARG 16 HA ARG 16 -3.591 0.710 9.685 118 HB2 ARG 16 HB2 ARG 16 -5.172 0.410 11.564 119 HB3 ARG 16 HB1 ARG 16 -4.954 -1.336 11.452 120 HG2 ARG 16 HG2 ARG 16 -2.410 -0.675 11.756 121 HG3 ARG 16 HG1 ARG 16 -3.127 0.746 12.521 122 HD2 ARG 16 HD2 ARG 16 -2.731 -0.887 14.221 123 HD3 ARG 16 HD1 ARG 16 -4.471 -0.793 13.949 124 HE ARG 16 HE ARG 16 -2.914 -2.881 12.600 125 HH11 ARG 16 HH11 ARG 16 -5.362 -1.974 14.934 126 HH12 ARG 16 HH12 ARG 16 -5.931 -3.598 15.155 127 HH21 ARG 16 HH21 ARG 16 -3.666 -5.019 12.868 128 HH22 ARG 16 HH22 ARG 16 -4.972 -5.332 13.974 129 H GLN 17 HN GLN 17 -4.681 -2.651 9.407 130 HA GLN 17 HA GLN 17 -2.150 -3.816 9.731 131 HB2 GLN 17 HB2 GLN 17 -4.477 -4.886 9.953 132 HB3 GLN 17 HB1 GLN 17 -4.408 -5.076 8.206 133 HG2 GLN 17 HG2 GLN 17 -3.719 -7.109 9.327 134 HG3 GLN 17 HG1 GLN 17 -2.379 -6.403 8.423 135 HE21 GLN 17 HE21 GLN 17 -0.829 -7.435 9.676 136 HE22 GLN 17 HE22 GLN 17 -0.494 -6.963 11.306 137 H LEU 18 HN LEU 18 -3.785 -2.477 7.016 138 HA LEU 18 HA LEU 18 -2.178 -3.665 4.974 139 HB2 LEU 18 HB2 LEU 18 -4.516 -2.259 5.041 140 HB3 LEU 18 HB1 LEU 18 -3.408 -1.026 4.484 141 HG LEU 18 HG LEU 18 -3.735 -3.693 3.116 142 HD11 LEU 18 HD11 LEU 18 -5.022 -1.053 2.478 143 HD12 LEU 18 HD12 LEU 18 -5.846 -2.493 3.074 144 HD13 LEU 18 HD13 LEU 18 -5.097 -2.498 1.476 145 HD21 LEU 18 HD21 LEU 18 -1.680 -2.753 2.471 146 HD22 LEU 18 HD22 LEU 18 -2.349 -1.130 2.400 147 HD23 LEU 18 HD23 LEU 18 -2.804 -2.326 1.190 148 H SER 19 HN SER 19 -2.110 -0.634 6.766 149 HA SER 19 HA SER 19 0.164 0.471 5.542 150 HB2 SER 19 HB2 SER 19 -1.343 1.703 7.101 151 HB3 SER 19 HB1 SER 19 -0.745 0.718 8.432 152 HG SER 19 HG SER 19 0.264 2.970 7.483 153 H LEU 20 HN LEU 20 -0.292 -2.009 7.898 154 HA LEU 20 HA LEU 20 2.466 -2.174 8.675 155 HB2 LEU 20 HB2 LEU 20 0.047 -3.841 9.257 156 HB3 LEU 20 HB1 LEU 20 1.636 -4.232 9.878 157 HG LEU 20 HG LEU 20 0.062 -1.726 10.450 158 HD11 LEU 20 HD11 LEU 20 -0.632 -3.875 11.513 159 HD12 LEU 20 HD12 LEU 20 -0.204 -2.583 12.633 160 HD13 LEU 20 HD13 LEU 20 0.929 -3.903 12.327 161 HD21 LEU 20 HD21 LEU 20 2.879 -2.518 11.100 162 HD22 LEU 20 HD22 LEU 20 1.973 -1.431 12.153 163 HD23 LEU 20 HD23 LEU 20 2.267 -0.987 10.474 164 H ASP 21 HN ASP 21 0.352 -3.801 6.371 165 HA ASP 21 HA ASP 21 2.172 -5.992 5.989 166 HB2 ASP 21 HB2 ASP 21 0.634 -6.750 4.242 167 HB3 ASP 21 HB1 ASP 21 -0.190 -6.410 5.752 168 H ILE 22 HN ILE 22 1.545 -2.941 4.348 169 HA ILE 22 HA ILE 22 3.324 -3.497 2.174 170 HB ILE 22 HB ILE 22 2.355 -0.861 3.282 171 HG12 ILE 22 HG12 ILE 22 1.520 -2.238 0.730 172 HG13 ILE 22 HG11 ILE 22 0.698 -2.542 2.265 173 HG21 ILE 22 HG21 ILE 22 4.365 -0.387 2.117 174 HG22 ILE 22 HG22 ILE 22 3.028 0.029 1.039 175 HG23 ILE 22 HG23 ILE 22 3.923 -1.470 0.795 176 HD11 ILE 22 HD11 ILE 22 0.204 -0.177 2.418 177 HD12 ILE 22 HD12 ILE 22 -0.492 -0.902 0.981 178 HD13 ILE 22 HD13 ILE 22 0.958 0.099 0.858 179 H ASN 23 HN ASN 23 3.625 -2.112 5.356 180 HA ASN 23 HA ASN 23 6.248 -1.188 5.309 181 HB2 ASN 23 HB2 ASN 23 4.758 -0.753 7.154 182 HB3 ASN 23 HB1 ASN 23 4.591 -2.469 7.483 183 HD21 ASN 23 HD21 ASN 23 6.484 0.355 7.917 184 HD22 ASN 23 HD22 ASN 23 7.646 -0.321 9.002 185 H LYS 24 HN LYS 24 4.981 -4.389 5.185 186 HA LYS 24 HA LYS 24 7.351 -5.711 6.171 187 HB2 LYS 24 HB2 LYS 24 4.780 -6.704 4.955 188 HB3 LYS 24 HB1 LYS 24 6.086 -7.782 5.436 189 HG2 LYS 24 HG2 LYS 24 5.894 -6.999 7.732 190 HG3 LYS 24 HG1 LYS 24 4.631 -5.866 7.252 191 HD2 LYS 24 HD2 LYS 24 3.253 -7.793 6.518 192 HD3 LYS 24 HD1 LYS 24 4.498 -8.877 7.146 193 HE2 LYS 24 HE2 LYS 24 2.910 -6.865 8.736 194 HE3 LYS 24 HE1 LYS 24 2.699 -8.614 8.764 195 HZ1 LYS 24 HZ1 LYS 24 4.949 -8.822 9.647 196 HZ2 LYS 24 HZ2 LYS 24 3.985 -7.870 10.657 197 HZ3 LYS 24 HZ3 LYS 24 5.124 -7.140 9.643 198 H LEU 25 HN LEU 25 6.032 -4.818 3.067 199 HA LEU 25 HA LEU 25 7.420 -6.659 1.454 200 HB2 LEU 25 HB2 LEU 25 6.539 -3.871 0.792 201 HB3 LEU 25 HB1 LEU 25 7.002 -5.075 -0.376 202 HG LEU 25 HG LEU 25 4.560 -5.011 1.352 203 HD11 LEU 25 HD11 LEU 25 5.064 -5.149 -1.599 204 HD12 LEU 25 HD12 LEU 25 4.422 -3.779 -0.700 205 HD13 LEU 25 HD13 LEU 25 3.474 -5.258 -0.854 206 HD21 LEU 25 HD21 LEU 25 5.690 -7.282 -0.213 207 HD22 LEU 25 HD22 LEU 25 4.021 -7.214 0.335 208 HD23 LEU 25 HD23 LEU 25 5.339 -7.257 1.508 209 HA PRO 26 HA PRO 26 11.647 -5.065 1.599 210 HB2 PRO 26 HB2 PRO 26 11.767 -6.654 -0.916 211 HB3 PRO 26 HB1 PRO 26 12.835 -6.698 0.496 212 HG2 PRO 26 HG2 PRO 26 11.090 -8.658 0.060 213 HG3 PRO 26 HG1 PRO 26 11.387 -8.060 1.705 214 HD2 PRO 26 HD2 PRO 26 9.084 -7.504 -0.132 215 HD3 PRO 26 HD1 PRO 26 9.086 -7.795 1.622 216 H GLY 27 HN GLY 27 12.835 -3.577 0.330 217 HA2 GLY 27 HA2 GLY 27 11.489 -1.482 -0.704 218 HA3 GLY 27 HA1 GLY 27 13.138 -1.847 -1.156 219 H GLU 28 HN GLU 28 12.799 -4.102 -2.756 220 HA GLU 28 HA GLU 28 12.113 -3.028 -5.228 221 HB2 GLU 28 HB2 GLU 28 13.490 -5.041 -5.029 222 HB3 GLU 28 HB1 GLU 28 12.133 -5.932 -4.372 223 HG2 GLU 28 HG2 GLU 28 11.080 -5.104 -6.710 224 HG3 GLU 28 HG1 GLU 28 12.780 -5.266 -7.137 225 H LYS 29 HN LYS 29 10.244 -5.273 -3.240 226 HA LYS 29 HA LYS 29 7.939 -5.293 -4.891 227 HB2 LYS 29 HB2 LYS 29 8.432 -6.073 -2.016 228 HB3 LYS 29 HB1 LYS 29 6.909 -6.366 -2.850 229 HG2 LYS 29 HG2 LYS 29 9.565 -7.451 -3.752 230 HG3 LYS 29 HG1 LYS 29 8.425 -8.332 -2.738 231 HD2 LYS 29 HD2 LYS 29 6.716 -8.004 -4.544 232 HD3 LYS 29 HD1 LYS 29 8.007 -7.383 -5.570 233 HE2 LYS 29 HE2 LYS 29 7.651 -9.703 -6.079 234 HE3 LYS 29 HE1 LYS 29 9.212 -9.530 -5.282 235 HZ1 LYS 29 HZ1 LYS 29 7.918 -11.427 -4.457 236 HZ2 LYS 29 HZ2 LYS 29 6.706 -10.374 -3.933 237 HZ3 LYS 29 HZ3 LYS 29 8.239 -10.308 -3.232 238 H LEU 30 HN LEU 30 8.986 -3.452 -2.163 239 HA LEU 30 HA LEU 30 6.567 -2.213 -1.414 240 HB2 LEU 30 HB2 LEU 30 8.571 -2.317 -0.024 241 HB3 LEU 30 HB1 LEU 30 9.443 -1.319 -1.166 242 HG LEU 30 HG LEU 30 8.291 0.611 -0.536 243 HD11 LEU 30 HD11 LEU 30 6.369 -0.766 1.255 244 HD12 LEU 30 HD12 LEU 30 6.044 -0.766 -0.471 245 HD13 LEU 30 HD13 LEU 30 6.214 0.756 0.392 246 HD21 LEU 30 HD21 LEU 30 8.530 0.636 1.928 247 HD22 LEU 30 HD22 LEU 30 9.909 -0.095 1.107 248 HD23 LEU 30 HD23 LEU 30 8.708 -1.118 1.897 249 H GLY 31 HN GLY 31 9.063 -1.220 -3.747 250 HA2 GLY 31 HA2 GLY 31 8.226 1.397 -4.193 251 HA3 GLY 31 HA1 GLY 31 9.041 0.404 -5.384 252 H ARG 32 HN ARG 32 6.783 -1.567 -5.352 253 HA ARG 32 HA ARG 32 5.215 -0.441 -7.419 254 HB2 ARG 32 HB2 ARG 32 5.538 -2.843 -7.259 255 HB3 ARG 32 HB1 ARG 32 4.740 -2.868 -5.696 256 HG2 ARG 32 HG2 ARG 32 3.231 -3.695 -7.396 257 HG3 ARG 32 HG1 ARG 32 2.647 -2.158 -6.772 258 HD2 ARG 32 HD2 ARG 32 2.446 -2.244 -9.213 259 HD3 ARG 32 HD1 ARG 32 3.568 -0.987 -8.699 260 HE ARG 32 HE ARG 32 4.950 -3.403 -9.250 261 HH11 ARG 32 HH11 ARG 32 3.351 -0.725 -10.835 262 HH12 ARG 32 HH12 ARG 32 4.341 -0.812 -12.257 263 HH21 ARG 32 HH21 ARG 32 6.252 -3.526 -11.131 264 HH22 ARG 32 HH22 ARG 32 5.984 -2.401 -12.426 265 H VAL 33 HN VAL 33 4.530 -1.019 -3.974 266 HA VAL 33 HA VAL 33 1.790 -0.261 -4.147 267 HB VAL 33 HB VAL 33 3.047 0.190 -1.528 268 HG11 VAL 33 HG11 VAL 33 0.794 -1.528 -2.561 269 HG12 VAL 33 HG12 VAL 33 0.670 0.060 -1.801 270 HG13 VAL 33 HG13 VAL 33 1.207 -1.324 -0.859 271 HG21 VAL 33 HG21 VAL 33 4.561 -1.536 -2.144 272 HG22 VAL 33 HG22 VAL 33 3.276 -2.486 -2.889 273 HG23 VAL 33 HG23 VAL 33 3.317 -2.279 -1.139 274 H VAL 34 HN VAL 34 4.656 1.488 -2.987 275 HA VAL 34 HA VAL 34 3.474 3.934 -2.419 276 HB VAL 34 HB VAL 34 5.634 4.353 -1.961 277 HG11 VAL 34 HG11 VAL 34 6.080 1.992 -2.243 278 HG12 VAL 34 HG12 VAL 34 7.460 2.980 -2.725 279 HG13 VAL 34 HG13 VAL 34 6.419 2.258 -3.951 280 HG21 VAL 34 HG21 VAL 34 5.466 5.819 -3.937 281 HG22 VAL 34 HG22 VAL 34 6.097 4.518 -4.937 282 HG23 VAL 34 HG23 VAL 34 7.104 5.230 -3.677 283 H HIS 35 HN HIS 35 4.425 2.570 -5.494 284 HA HIS 35 HA HIS 35 3.760 4.826 -7.082 285 HB2 HIS 35 HB2 HIS 35 5.281 2.887 -7.702 286 HB3 HIS 35 HB1 HIS 35 3.818 1.961 -8.007 287 HD1 HIS 35 HD1 HIS 35 5.981 4.627 -9.416 288 HD2 HIS 35 HD2 HIS 35 2.352 2.804 -10.304 289 HE1 HIS 35 HE1 HIS 35 5.442 5.303 -11.777 290 HE2 HIS 35 HE2 HIS 35 3.157 4.344 -12.218 291 H ILE 36 HN ILE 36 1.990 1.889 -6.158 292 HA ILE 36 HA ILE 36 -0.255 2.242 -7.783 293 HB ILE 36 HB ILE 36 -0.235 0.961 -5.036 294 HG12 ILE 36 HG12 ILE 36 0.252 -0.174 -7.794 295 HG13 ILE 36 HG11 ILE 36 1.358 -0.175 -6.432 296 HG21 ILE 36 HG21 ILE 36 -2.423 0.593 -5.319 297 HG22 ILE 36 HG22 ILE 36 -2.122 -0.145 -6.892 298 HG23 ILE 36 HG23 ILE 36 -2.367 1.596 -6.769 299 HD11 ILE 36 HD11 ILE 36 -0.219 -1.681 -5.234 300 HD12 ILE 36 HD12 ILE 36 0.474 -2.372 -6.698 301 HD13 ILE 36 HD13 ILE 36 -1.178 -1.762 -6.711 302 H ILE 37 HN ILE 37 0.207 3.279 -4.380 303 HA ILE 37 HA ILE 37 -2.342 4.441 -4.127 304 HB ILE 37 HB ILE 37 0.155 5.253 -2.634 305 HG12 ILE 37 HG12 ILE 37 -1.593 3.804 -0.981 306 HG13 ILE 37 HG11 ILE 37 -1.519 2.896 -2.486 307 HG21 ILE 37 HG21 ILE 37 -2.052 6.696 -2.758 308 HG22 ILE 37 HG22 ILE 37 -1.151 6.516 -1.252 309 HG23 ILE 37 HG23 ILE 37 -2.593 5.540 -1.540 310 HD11 ILE 37 HD11 ILE 37 0.847 2.696 -2.322 311 HD12 ILE 37 HD12 ILE 37 0.132 2.194 -0.790 312 HD13 ILE 37 HD13 ILE 37 0.887 3.779 -0.937 313 H GLN 38 HN GLN 38 0.782 5.961 -4.836 314 HA GLN 38 HA GLN 38 -0.079 8.580 -5.183 315 HB2 GLN 38 HB2 GLN 38 2.174 7.026 -6.439 316 HB3 GLN 38 HB1 GLN 38 1.933 8.728 -6.791 317 HG2 GLN 38 HG2 GLN 38 1.894 8.672 -4.037 318 HG3 GLN 38 HG1 GLN 38 3.064 7.423 -4.436 319 HE21 GLN 38 HE21 GLN 38 4.753 8.655 -3.601 320 HE22 GLN 38 HE22 GLN 38 5.389 10.031 -4.437 321 H SER 39 HN SER 39 -0.237 5.866 -7.397 322 HA SER 39 HA SER 39 -0.924 7.476 -9.669 323 HB2 SER 39 HB2 SER 39 0.275 5.379 -9.977 324 HB3 SER 39 HB1 SER 39 -1.052 4.483 -9.238 325 HG SER 39 HG SER 39 -1.060 5.903 -11.695 326 H ARG 40 HN ARG 40 -2.718 5.564 -7.285 327 HA ARG 40 HA ARG 40 -5.187 5.896 -8.757 328 HB2 ARG 40 HB2 ARG 40 -4.822 4.802 -5.978 329 HB3 ARG 40 HB1 ARG 40 -6.253 4.649 -6.983 330 HG2 ARG 40 HG2 ARG 40 -4.502 3.497 -8.623 331 HG3 ARG 40 HG1 ARG 40 -3.693 3.175 -7.089 332 HD2 ARG 40 HD2 ARG 40 -5.081 1.320 -7.535 333 HD3 ARG 40 HD1 ARG 40 -5.812 2.257 -6.240 334 HE ARG 40 HE ARG 40 -7.106 3.237 -8.347 335 HH11 ARG 40 HH11 ARG 40 -6.409 -0.070 -7.442 336 HH12 ARG 40 HH12 ARG 40 -7.778 -0.732 -8.269 337 HH21 ARG 40 HH21 ARG 40 -8.937 2.367 -9.436 338 HH22 ARG 40 HH22 ARG 40 -9.226 0.652 -9.407 339 H GLU 41 HN GLU 41 -3.654 7.268 -5.911 340 HA GLU 41 HA GLU 41 -5.975 9.015 -5.497 341 HB2 GLU 41 HB2 GLU 41 -3.591 8.592 -3.718 342 HB3 GLU 41 HB1 GLU 41 -5.028 9.518 -3.323 343 HG2 GLU 41 HG2 GLU 41 -4.822 6.546 -3.720 344 HG3 GLU 41 HG1 GLU 41 -5.143 7.412 -2.222 345 HA PRO 42 HA PRO 42 -3.261 12.019 -7.635 346 HB2 PRO 42 HB2 PRO 42 -5.703 13.596 -7.852 347 HB3 PRO 42 HB1 PRO 42 -4.678 12.948 -9.132 348 HG2 PRO 42 HG2 PRO 42 -7.175 12.018 -8.591 349 HG3 PRO 42 HG1 PRO 42 -5.896 11.030 -9.312 350 HD2 PRO 42 HD2 PRO 42 -6.921 11.068 -6.518 351 HD3 PRO 42 HD1 PRO 42 -6.317 9.712 -7.492 352 H SER 43 HN SER 43 -4.776 12.001 -4.710 353 HA SER 43 HA SER 43 -4.434 14.848 -4.162 354 HB2 SER 43 HB2 SER 43 -6.470 13.985 -3.250 355 HB3 SER 43 HB1 SER 43 -5.640 12.601 -2.531 356 HG SER 43 HG SER 43 -4.451 14.587 -1.450 357 H LEU 44 HN LEU 44 -2.436 12.179 -4.108 358 HA LEU 44 HA LEU 44 -0.691 13.561 -2.201 359 HB2 LEU 44 HB2 LEU 44 -0.010 11.445 -1.166 360 HB3 LEU 44 HB1 LEU 44 -1.696 11.824 -0.889 361 HG LEU 44 HG LEU 44 -1.854 10.220 -3.094 362 HD11 LEU 44 HD11 LEU 44 0.538 9.733 -3.009 363 HD12 LEU 44 HD12 LEU 44 -0.438 8.296 -2.717 364 HD13 LEU 44 HD13 LEU 44 0.349 9.115 -1.368 365 HD21 LEU 44 HD21 LEU 44 -3.255 10.077 -1.125 366 HD22 LEU 44 HD22 LEU 44 -1.910 9.424 -0.189 367 HD23 LEU 44 HD23 LEU 44 -2.597 8.489 -1.517 368 H LYS 45 HN LYS 45 -0.843 12.986 -5.238 369 HA LYS 45 HA LYS 45 1.513 11.422 -5.722 370 HB2 LYS 45 HB2 LYS 45 1.220 11.813 -7.994 371 HB3 LYS 45 HB1 LYS 45 -0.417 11.799 -7.381 372 HG2 LYS 45 HG2 LYS 45 1.200 14.252 -8.001 373 HG3 LYS 45 HG1 LYS 45 0.023 13.515 -9.080 374 HD2 LYS 45 HD2 LYS 45 -1.752 13.963 -7.502 375 HD3 LYS 45 HD1 LYS 45 -0.590 14.617 -6.342 376 HE2 LYS 45 HE2 LYS 45 -1.571 16.475 -7.455 377 HE3 LYS 45 HE1 LYS 45 0.067 16.268 -8.083 378 HZ1 LYS 45 HZ1 LYS 45 -0.786 15.251 -10.046 379 HZ2 LYS 45 HZ2 LYS 45 -1.613 16.708 -9.822 380 HZ3 LYS 45 HZ3 LYS 45 -2.365 15.243 -9.439 381 H ASN 46 HN ASN 46 1.095 14.460 -4.520 382 HA ASN 46 HA ASN 46 3.434 15.676 -5.708 383 HB2 ASN 46 HB2 ASN 46 2.959 17.530 -4.137 384 HB3 ASN 46 HB1 ASN 46 1.546 17.095 -5.097 385 HD21 ASN 46 HD21 ASN 46 3.001 17.013 -1.950 386 HD22 ASN 46 HD22 ASN 46 1.560 16.631 -1.073 387 H SER 47 HN SER 47 2.850 13.427 -3.314 388 HA SER 47 HA SER 47 4.800 14.198 -1.390 389 HB2 SER 47 HB2 SER 47 3.762 11.394 -1.910 390 HB3 SER 47 HB1 SER 47 4.420 12.042 -0.405 391 HG SER 47 HG SER 47 1.905 12.371 -1.546 392 H ASN 48 HN ASN 48 6.971 13.821 -1.376 393 HA ASN 48 HA ASN 48 8.379 13.083 -3.682 394 HB2 ASN 48 HB2 ASN 48 9.352 12.796 -0.822 395 HB3 ASN 48 HB1 ASN 48 10.357 12.935 -2.259 396 HD21 ASN 48 HD21 ASN 48 10.291 14.535 0.146 397 HD22 ASN 48 HD22 ASN 48 9.993 16.161 -0.372 398 HA PRO 49 HA PRO 49 7.514 8.785 -3.868 399 HB2 PRO 49 HB2 PRO 49 9.781 7.988 -5.246 400 HB3 PRO 49 HB1 PRO 49 8.308 8.620 -5.979 401 HG2 PRO 49 HG2 PRO 49 10.880 10.000 -5.392 402 HG3 PRO 49 HG1 PRO 49 9.774 10.217 -6.759 403 HD2 PRO 49 HD2 PRO 49 9.903 11.969 -4.716 404 HD3 PRO 49 HD1 PRO 49 8.391 11.637 -5.579 405 H ASP 50 HN ASP 50 10.538 9.936 -2.572 406 HA ASP 50 HA ASP 50 11.278 7.386 -1.468 407 HB2 ASP 50 HB2 ASP 50 12.394 10.155 -1.033 408 HB3 ASP 50 HB1 ASP 50 13.074 8.697 -0.328 409 H GLU 51 HN GLU 51 9.453 10.142 -0.465 410 HA GLU 51 HA GLU 51 9.121 9.005 2.230 411 HB2 GLU 51 HB2 GLU 51 10.299 11.569 1.523 412 HB3 GLU 51 HB1 GLU 51 8.854 11.790 2.503 413 HG2 GLU 51 HG2 GLU 51 9.778 10.341 4.218 414 HG3 GLU 51 HG1 GLU 51 11.206 10.074 3.225 415 H ILE 52 HN ILE 52 7.282 8.306 0.597 416 HA ILE 52 HA ILE 52 5.438 10.303 -0.223 417 HB ILE 52 HB ILE 52 4.185 8.618 -1.210 418 HG12 ILE 52 HG12 ILE 52 5.412 6.498 0.498 419 HG13 ILE 52 HG11 ILE 52 3.968 7.367 1.016 420 HG21 ILE 52 HG21 ILE 52 6.831 7.217 -1.008 421 HG22 ILE 52 HG22 ILE 52 6.620 8.712 -1.933 422 HG23 ILE 52 HG23 ILE 52 5.712 7.267 -2.378 423 HD11 ILE 52 HD11 ILE 52 2.846 6.649 -1.048 424 HD12 ILE 52 HD12 ILE 52 3.349 5.292 -0.036 425 HD13 ILE 52 HD13 ILE 52 4.277 5.713 -1.475 426 H GLU 53 HN GLU 53 3.233 10.544 0.451 427 HA GLU 53 HA GLU 53 2.820 9.807 3.266 428 HB2 GLU 53 HB2 GLU 53 3.033 12.290 2.685 429 HB3 GLU 53 HB1 GLU 53 1.508 12.118 1.837 430 HG2 GLU 53 HG2 GLU 53 1.418 13.021 4.178 431 HG3 GLU 53 HG1 GLU 53 0.302 11.710 3.824 432 H ILE 54 HN ILE 54 1.304 8.288 3.494 433 HA ILE 54 HA ILE 54 -0.821 8.104 1.451 434 HB ILE 54 HB ILE 54 0.108 5.976 3.387 435 HG12 ILE 54 HG12 ILE 54 0.412 6.087 0.383 436 HG13 ILE 54 HG11 ILE 54 1.698 6.507 1.515 437 HG21 ILE 54 HG21 ILE 54 -1.345 4.513 1.988 438 HG22 ILE 54 HG22 ILE 54 -1.965 5.960 1.202 439 HG23 ILE 54 HG23 ILE 54 -2.226 5.711 2.929 440 HD11 ILE 54 HD11 ILE 54 1.827 4.215 0.574 441 HD12 ILE 54 HD12 ILE 54 0.340 3.829 1.437 442 HD13 ILE 54 HD13 ILE 54 1.791 4.276 2.329 443 H ASP 55 HN ASP 55 -2.914 8.377 2.050 444 HA ASP 55 HA ASP 55 -3.383 8.767 4.937 445 HB2 ASP 55 HB2 ASP 55 -3.619 10.774 3.289 446 HB3 ASP 55 HB1 ASP 55 -5.127 9.993 2.822 447 H PHE 56 HN PHE 56 -4.025 6.730 5.423 448 HA PHE 56 HA PHE 56 -5.355 5.052 3.607 449 HB2 PHE 56 HB2 PHE 56 -4.331 4.865 6.325 450 HB3 PHE 56 HB1 PHE 56 -5.753 3.859 6.043 451 HD1 PHE 56 HD1 PHE 56 -2.262 4.466 5.096 452 HD2 PHE 56 HD2 PHE 56 -5.703 2.053 4.498 453 HE1 PHE 56 HE1 PHE 56 -0.900 2.812 3.886 454 HE2 PHE 56 HE2 PHE 56 -4.361 0.408 3.300 455 HZ PHE 56 HZ PHE 56 -1.955 0.764 2.994 456 H GLU 57 HN GLU 57 -6.673 7.535 5.423 457 HA GLU 57 HA GLU 57 -9.236 6.228 5.782 458 HB2 GLU 57 HB2 GLU 57 -8.303 9.010 6.429 459 HB3 GLU 57 HB1 GLU 57 -9.872 8.345 6.874 460 HG2 GLU 57 HG2 GLU 57 -7.216 7.255 7.775 461 HG3 GLU 57 HG1 GLU 57 -8.226 8.345 8.717 462 H THR 58 HN THR 58 -7.622 7.986 3.415 463 HA THR 58 HA THR 58 -10.166 8.895 2.240 464 HB THR 58 HB THR 58 -8.861 10.708 1.137 465 HG1 THR 58 HG1 THR 58 -6.815 10.193 3.020 466 HG21 THR 58 HG21 THR 58 -8.766 10.591 4.141 467 HG22 THR 58 HG22 THR 58 -10.119 11.164 3.162 468 HG23 THR 58 HG23 THR 58 -8.601 12.064 3.185 469 H LEU 59 HN LEU 59 -7.721 6.695 1.852 470 HA LEU 59 HA LEU 59 -7.411 6.760 -0.993 471 HB2 LEU 59 HB2 LEU 59 -7.285 4.180 0.534 472 HB3 LEU 59 HB1 LEU 59 -6.364 4.686 -0.856 473 HG LEU 59 HG LEU 59 -5.969 5.631 1.975 474 HD11 LEU 59 HD11 LEU 59 -4.406 3.805 0.165 475 HD12 LEU 59 HD12 LEU 59 -5.110 3.446 1.742 476 HD13 LEU 59 HD13 LEU 59 -3.734 4.539 1.621 477 HD21 LEU 59 HD21 LEU 59 -4.755 6.529 -0.610 478 HD22 LEU 59 HD22 LEU 59 -3.893 6.688 0.912 479 HD23 LEU 59 HD23 LEU 59 -5.438 7.502 0.685 480 H LYS 60 HN LYS 60 -8.570 5.698 -2.572 481 HA LYS 60 HA LYS 60 -11.298 5.120 -2.165 482 HB2 LYS 60 HB2 LYS 60 -9.466 4.158 -4.373 483 HB3 LYS 60 HB1 LYS 60 -11.223 4.204 -4.444 484 HG2 LYS 60 HG2 LYS 60 -11.143 6.651 -4.277 485 HG3 LYS 60 HG1 LYS 60 -9.379 6.580 -4.244 486 HD2 LYS 60 HD2 LYS 60 -9.423 5.479 -6.458 487 HD3 LYS 60 HD1 LYS 60 -11.176 5.685 -6.496 488 HE2 LYS 60 HE2 LYS 60 -10.091 7.452 -7.754 489 HE3 LYS 60 HE1 LYS 60 -10.881 8.114 -6.326 490 HZ1 LYS 60 HZ1 LYS 60 -8.681 8.054 -5.210 491 HZ2 LYS 60 HZ2 LYS 60 -8.742 9.101 -6.535 492 HZ3 LYS 60 HZ3 LYS 60 -7.977 7.601 -6.684 493 HA PRO 61 HA PRO 61 -11.328 1.024 -0.458 494 HB2 PRO 61 HB2 PRO 61 -13.516 0.414 -2.353 495 HB3 PRO 61 HB1 PRO 61 -13.510 0.352 -0.591 496 HG2 PRO 61 HG2 PRO 61 -14.797 2.282 -1.975 497 HG3 PRO 61 HG1 PRO 61 -14.085 2.569 -0.379 498 HD2 PRO 61 HD2 PRO 61 -13.126 3.418 -3.063 499 HD3 PRO 61 HD1 PRO 61 -12.917 4.201 -1.485 500 H SER 62 HN SER 62 -11.344 1.560 -3.903 501 HA SER 62 HA SER 62 -10.624 -1.112 -4.632 502 HB2 SER 62 HB2 SER 62 -10.070 0.020 -6.846 503 HB3 SER 62 HB1 SER 62 -11.736 0.198 -6.294 504 HG SER 62 HG SER 62 -11.271 2.243 -6.670 505 H THR 63 HN THR 63 -8.917 1.934 -4.125 506 HA THR 63 HA THR 63 -6.336 1.122 -4.788 507 HB THR 63 HB THR 63 -6.891 3.013 -2.483 508 HG1 THR 63 HG1 THR 63 -7.238 4.633 -4.069 509 HG21 THR 63 HG21 THR 63 -4.548 2.426 -3.075 510 HG22 THR 63 HG22 THR 63 -4.911 4.135 -3.282 511 HG23 THR 63 HG23 THR 63 -4.822 3.076 -4.688 512 H LEU 64 HN LEU 64 -8.006 1.060 -1.654 513 HA LEU 64 HA LEU 64 -5.982 -0.099 -0.134 514 HB2 LEU 64 HB2 LEU 64 -8.982 -0.286 0.097 515 HB3 LEU 64 HB1 LEU 64 -7.896 -0.965 1.294 516 HG LEU 64 HG LEU 64 -7.970 1.957 0.550 517 HD11 LEU 64 HD11 LEU 64 -10.070 1.267 1.636 518 HD12 LEU 64 HD12 LEU 64 -9.098 2.303 2.675 519 HD13 LEU 64 HD13 LEU 64 -9.137 0.565 2.954 520 HD21 LEU 64 HD21 LEU 64 -5.834 1.322 1.400 521 HD22 LEU 64 HD22 LEU 64 -6.575 0.420 2.716 522 HD23 LEU 64 HD23 LEU 64 -6.707 2.177 2.667 523 H ARG 65 HN ARG 65 -8.432 -1.664 -2.142 524 HA ARG 65 HA ARG 65 -7.653 -4.276 -1.229 525 HB2 ARG 65 HB2 ARG 65 -9.714 -3.177 -3.000 526 HB3 ARG 65 HB1 ARG 65 -9.153 -4.765 -3.452 527 HG2 ARG 65 HG2 ARG 65 -10.304 -3.976 -0.790 528 HG3 ARG 65 HG1 ARG 65 -11.123 -4.946 -2.025 529 HD2 ARG 65 HD2 ARG 65 -9.434 -6.694 -1.746 530 HD3 ARG 65 HD1 ARG 65 -8.615 -5.724 -0.521 531 HE ARG 65 HE ARG 65 -11.121 -5.911 0.451 532 HH11 ARG 65 HH11 ARG 65 -8.874 -8.314 -0.733 533 HH12 ARG 65 HH12 ARG 65 -9.434 -9.555 0.337 534 HH21 ARG 65 HH21 ARG 65 -11.871 -7.543 1.863 535 HH22 ARG 65 HH22 ARG 65 -11.141 -9.115 1.815 536 H GLU 66 HN GLU 66 -6.603 -2.110 -3.677 537 HA GLU 66 HA GLU 66 -5.344 -4.159 -5.252 538 HB2 GLU 66 HB2 GLU 66 -6.085 -2.112 -6.319 539 HB3 GLU 66 HB1 GLU 66 -5.084 -1.149 -5.244 540 HG2 GLU 66 HG2 GLU 66 -4.028 -1.261 -7.375 541 HG3 GLU 66 HG1 GLU 66 -3.075 -2.233 -6.246 542 H LEU 67 HN LEU 67 -4.528 -1.886 -2.721 543 HA LEU 67 HA LEU 67 -1.735 -2.333 -2.685 544 HB2 LEU 67 HB2 LEU 67 -3.564 -1.476 -0.428 545 HB3 LEU 67 HB1 LEU 67 -1.831 -1.211 -0.497 546 HG LEU 67 HG LEU 67 -3.909 0.067 -2.283 547 HD11 LEU 67 HD11 LEU 67 -2.135 1.286 -0.172 548 HD12 LEU 67 HD12 LEU 67 -3.840 0.893 0.047 549 HD13 LEU 67 HD13 LEU 67 -3.360 2.110 -1.136 550 HD21 LEU 67 HD21 LEU 67 -1.675 -0.436 -3.343 551 HD22 LEU 67 HD22 LEU 67 -0.983 0.702 -2.189 552 HD23 LEU 67 HD23 LEU 67 -2.189 1.249 -3.347 553 H GLU 68 HN GLU 68 -4.447 -3.518 -0.737 554 HA GLU 68 HA GLU 68 -2.958 -5.219 0.939 555 HB2 GLU 68 HB2 GLU 68 -5.285 -4.448 1.403 556 HB3 GLU 68 HB1 GLU 68 -5.862 -5.539 0.150 557 HG2 GLU 68 HG2 GLU 68 -4.414 -7.245 1.634 558 HG3 GLU 68 HG1 GLU 68 -4.927 -6.108 2.875 559 H ARG 69 HN ARG 69 -4.968 -6.023 -1.920 560 HA ARG 69 HA ARG 69 -4.442 -8.756 -1.956 561 HB2 ARG 69 HB2 ARG 69 -6.110 -7.793 -3.427 562 HB3 ARG 69 HB1 ARG 69 -4.868 -6.938 -4.332 563 HG2 ARG 69 HG2 ARG 69 -3.929 -9.062 -5.073 564 HG3 ARG 69 HG1 ARG 69 -5.156 -9.935 -4.168 565 HD2 ARG 69 HD2 ARG 69 -5.765 -9.737 -6.536 566 HD3 ARG 69 HD1 ARG 69 -6.877 -8.829 -5.517 567 HE ARG 69 HE ARG 69 -4.759 -7.187 -6.457 568 HH11 ARG 69 HH11 ARG 69 -7.763 -8.667 -7.464 569 HH12 ARG 69 HH12 ARG 69 -8.181 -7.384 -8.563 570 HH21 ARG 69 HH21 ARG 69 -5.308 -5.476 -7.888 571 HH22 ARG 69 HH22 ARG 69 -6.805 -5.561 -8.781 572 H TYR 70 HN TYR 70 -2.494 -6.130 -3.186 573 HA TYR 70 HA TYR 70 -0.731 -7.828 -4.664 574 HB2 TYR 70 HB2 TYR 70 -0.879 -5.596 -5.435 575 HB3 TYR 70 HB1 TYR 70 -0.617 -4.936 -3.822 576 HD1 TYR 70 HD2 TYR 70 1.058 -6.721 -6.616 577 HD2 TYR 70 HD1 TYR 70 1.509 -4.488 -3.033 578 HE1 TYR 70 HE2 TYR 70 3.469 -6.542 -7.051 579 HE2 TYR 70 HE1 TYR 70 3.923 -4.287 -3.456 580 HH TYR 70 HH TYR 70 5.651 -5.135 -4.681 581 H VAL 71 HN VAL 71 -0.584 -6.230 -1.496 582 HA VAL 71 HA VAL 71 2.060 -7.138 -0.977 583 HB VAL 71 HB VAL 71 1.712 -6.418 1.308 584 HG11 VAL 71 HG11 VAL 71 0.535 -4.082 0.385 585 HG12 VAL 71 HG12 VAL 71 1.320 -4.779 -1.026 586 HG13 VAL 71 HG13 VAL 71 2.254 -4.450 0.433 587 HG21 VAL 71 HG21 VAL 71 -0.393 -6.936 1.992 588 HG22 VAL 71 HG22 VAL 71 -1.139 -6.381 0.491 589 HG23 VAL 71 HG23 VAL 71 -0.575 -5.208 1.681 590 H THR 72 HN THR 72 -1.147 -8.304 0.023 591 HA THR 72 HA THR 72 -0.250 -10.382 1.664 592 HB THR 72 HB THR 72 -2.628 -9.523 1.484 593 HG1 THR 72 HG1 THR 72 -2.804 -11.263 2.679 594 HG21 THR 72 HG21 THR 72 -2.742 -9.764 -0.998 595 HG22 THR 72 HG22 THR 72 -4.108 -10.462 -0.129 596 HG23 THR 72 HG23 THR 72 -2.839 -11.509 -0.767 597 H SER 73 HN SER 73 -0.593 -10.168 -1.822 598 HA SER 73 HA SER 73 -0.165 -12.885 -2.418 599 HB2 SER 73 HB2 SER 73 0.080 -12.225 -4.632 600 HB3 SER 73 HB1 SER 73 -0.807 -10.856 -3.964 601 HG SER 73 HG SER 73 1.121 -9.708 -3.822 602 H CYS 74 HN CYS 74 1.964 -10.346 -1.430 603 HA CYS 74 HA CYS 74 4.372 -11.791 -2.181 604 HB2 CYS 74 HB2 CYS 74 4.262 -9.364 -2.532 605 HB3 CYS 74 HB1 CYS 74 4.005 -9.119 -0.808 606 HG CYS 74 HG CYS 74 6.703 -10.836 -0.920 607 H LEU 75 HN LEU 75 2.926 -10.486 0.819 608 HA LEU 75 HA LEU 75 4.701 -11.490 2.674 609 HB2 LEU 75 HB2 LEU 75 1.764 -11.584 3.230 610 HB3 LEU 75 HB1 LEU 75 3.070 -11.118 4.292 611 HG LEU 75 HG LEU 75 2.196 -9.458 1.949 612 HD11 LEU 75 HD11 LEU 75 1.545 -8.866 4.796 613 HD12 LEU 75 HD12 LEU 75 0.496 -9.914 3.846 614 HD13 LEU 75 HD13 LEU 75 0.791 -8.260 3.322 615 HD21 LEU 75 HD21 LEU 75 4.499 -9.169 2.827 616 HD22 LEU 75 HD22 LEU 75 3.807 -8.763 4.396 617 HD23 LEU 75 HD23 LEU 75 3.488 -7.736 2.996 618 H ARG 76 HN ARG 76 2.178 -13.169 0.927 619 HA ARG 76 HA ARG 76 2.543 -15.552 2.580 620 HB2 ARG 76 HB2 ARG 76 0.413 -14.753 0.611 621 HB3 ARG 76 HB1 ARG 76 0.494 -16.350 1.347 622 HG2 ARG 76 HG2 ARG 76 -0.035 -15.551 3.447 623 HG3 ARG 76 HG1 ARG 76 0.489 -13.908 3.060 624 HD2 ARG 76 HD2 ARG 76 -1.958 -14.134 3.218 625 HD3 ARG 76 HD1 ARG 76 -1.407 -13.579 1.639 626 HE ARG 76 HE ARG 76 -1.844 -16.431 1.872 627 HH11 ARG 76 HH11 ARG 76 -3.198 -13.321 1.022 628 HH12 ARG 76 HH12 ARG 76 -4.412 -13.993 -0.023 629 HH21 ARG 76 HH21 ARG 76 -3.434 -17.321 0.505 630 HH22 ARG 76 HH22 ARG 76 -4.563 -16.277 -0.299 631 H LYS 77 HN LYS 77 4.035 -14.370 0.013 632 HA LYS 77 HA LYS 77 4.706 -17.054 -0.950 633 HB2 LYS 77 HB2 LYS 77 3.816 -14.761 -2.660 634 HB3 LYS 77 HB1 LYS 77 4.920 -15.972 -3.296 635 HG2 LYS 77 HG2 LYS 77 3.324 -17.704 -2.987 636 HG3 LYS 77 HG1 LYS 77 2.258 -16.631 -2.081 637 HD2 LYS 77 HD2 LYS 77 1.885 -15.286 -4.072 638 HD3 LYS 77 HD1 LYS 77 3.028 -16.276 -4.979 639 HE2 LYS 77 HE2 LYS 77 0.435 -17.235 -3.774 640 HE3 LYS 77 HE1 LYS 77 0.704 -16.870 -5.476 641 HZ1 LYS 77 HZ1 LYS 77 1.955 -19.039 -3.888 642 HZ2 LYS 77 HZ2 LYS 77 2.463 -18.614 -5.442 643 HZ3 LYS 77 HZ3 LYS 77 0.897 -19.201 -5.199 644 H LYS 78 HN LYS 78 6.826 -17.220 -0.376 645 HA LYS 78 HA LYS 78 8.403 -14.819 -0.171 646 HB2 LYS 78 HB2 LYS 78 8.857 -17.670 0.577 647 HB3 LYS 78 HB1 LYS 78 10.241 -16.598 0.399 648 HG2 LYS 78 HG2 LYS 78 9.570 -16.684 2.702 649 HG3 LYS 78 HG1 LYS 78 9.253 -15.076 2.051 650 HD2 LYS 78 HD2 LYS 78 6.882 -15.720 1.738 651 HD3 LYS 78 HD1 LYS 78 7.234 -17.275 2.494 652 HE2 LYS 78 HE2 LYS 78 7.538 -14.564 3.781 653 HE3 LYS 78 HE1 LYS 78 6.242 -15.718 4.091 654 HZ1 LYS 78 HZ1 LYS 78 7.915 -17.280 4.918 655 HZ2 LYS 78 HZ2 LYS 78 7.908 -15.844 5.806 656 HZ3 LYS 78 HZ3 LYS 78 9.128 -16.126 4.672 657 H ARG 79 HN ARG 79 9.807 -14.070 -1.506 658 HA ARG 79 HA ARG 79 11.150 -15.692 -3.465 659 HB2 ARG 79 HB2 ARG 79 9.086 -15.231 -4.680 660 HB3 ARG 79 HB1 ARG 79 9.212 -13.519 -4.320 661 HG2 ARG 79 HG2 ARG 79 11.421 -14.820 -5.834 662 HG3 ARG 79 HG1 ARG 79 9.901 -14.476 -6.663 663 HD2 ARG 79 HD2 ARG 79 10.077 -12.125 -5.973 664 HD3 ARG 79 HD1 ARG 79 11.606 -12.480 -5.175 665 HE ARG 79 HE ARG 79 11.828 -13.266 -7.847 666 HH11 ARG 79 HH11 ARG 79 11.440 -10.369 -5.953 667 HH12 ARG 79 HH12 ARG 79 12.227 -9.325 -7.095 668 HH21 ARG 79 HH21 ARG 79 12.874 -11.914 -9.391 669 HH22 ARG 79 HH22 ARG 79 13.036 -10.217 -9.071 670 H LYS 80 HN LYS 80 13.136 -15.066 -3.108 671 HA LYS 80 HA LYS 80 14.080 -12.882 -1.784 672 HB2 LYS 80 HB2 LYS 80 16.248 -13.171 -2.912 673 HB3 LYS 80 HB1 LYS 80 15.559 -14.694 -2.375 674 HG2 LYS 80 HG2 LYS 80 15.163 -13.784 -5.196 675 HG3 LYS 80 HG1 LYS 80 16.682 -14.526 -4.707 676 HD2 LYS 80 HD2 LYS 80 13.953 -15.774 -4.392 677 HD3 LYS 80 HD1 LYS 80 15.100 -16.148 -5.677 678 HE2 LYS 80 HE2 LYS 80 15.518 -16.582 -2.719 679 HE3 LYS 80 HE1 LYS 80 15.198 -17.825 -3.923 680 HZ1 LYS 80 HZ1 LYS 80 17.534 -17.746 -3.430 681 HZ2 LYS 80 HZ2 LYS 80 17.607 -16.095 -3.787 682 HZ3 LYS 80 HZ3 LYS 80 17.290 -17.211 -5.014 683 HA PRO 81 HA PRO 81 13.051 -9.512 -4.691 684 HB2 PRO 81 HB2 PRO 81 13.966 -7.495 -3.107 685 HB3 PRO 81 HB1 PRO 81 12.367 -8.224 -2.919 686 HG2 PRO 81 HG2 PRO 81 14.894 -8.800 -1.413 687 HG3 PRO 81 HG1 PRO 81 13.254 -8.554 -0.785 688 HD2 PRO 81 HD2 PRO 81 14.271 -11.000 -1.064 689 HD3 PRO 81 HD1 PRO 81 12.553 -10.670 -1.411 690 H GLN 82 HN GLN 82 14.845 -10.594 -5.904 691 HA GLN 82 HA GLN 82 17.523 -9.575 -5.516 692 HB2 GLN 82 HB2 GLN 82 17.116 -11.894 -6.242 693 HB3 GLN 82 HB1 GLN 82 16.350 -11.300 -7.708 694 HG2 GLN 82 HG2 GLN 82 18.498 -10.247 -8.348 695 HG3 GLN 82 HG1 GLN 82 19.238 -10.989 -6.928 696 HE21 GLN 82 HE21 GLN 82 19.748 -11.347 -9.804 697 HE22 GLN 82 HE22 GLN 82 19.579 -13.043 -10.098 698 H ALA 83 HN ALA 83 16.904 -7.330 -5.752 699 HA ALA 83 HA ALA 83 17.157 -6.514 -8.552 700 HB1 ALA 83 HB1 ALA 83 15.240 -5.235 -6.602 701 HB2 ALA 83 HB2 ALA 83 14.788 -6.252 -7.969 702 HB3 ALA 83 HB3 ALA 83 15.562 -4.693 -8.248 703 H1 GLU 201 HT1 GLU 201 -8.383 8.413 11.472 704 H2 GLU 201 HT2 GLU 201 -7.567 7.213 12.340 705 H3 GLU 201 HT3 GLU 201 -7.738 7.074 10.657 706 HA GLU 201 HA GLU 201 -6.404 9.066 10.360 707 HB2 GLU 201 HB2 GLU 201 -5.111 9.921 12.299 708 HB3 GLU 201 HB1 GLU 201 -6.836 10.189 12.451 709 HG2 GLU 201 HG2 GLU 201 -5.367 7.937 13.804 710 HG3 GLU 201 HG1 GLU 201 -5.662 9.505 14.547 711 H ILE 202 HN ILE 202 -5.593 7.321 9.135 712 HA ILE 202 HA ILE 202 -3.302 5.955 10.389 713 HB ILE 202 HB ILE 202 -5.185 4.786 8.326 714 HG12 ILE 202 HG12 ILE 202 -6.094 4.796 10.627 715 HG13 ILE 202 HG11 ILE 202 -5.787 3.165 10.038 716 HG21 ILE 202 HG21 ILE 202 -2.886 4.101 7.914 717 HG22 ILE 202 HG22 ILE 202 -3.839 2.745 8.515 718 HG23 ILE 202 HG23 ILE 202 -2.724 3.584 9.592 719 HD11 ILE 202 HD11 ILE 202 -3.676 3.140 11.312 720 HD12 ILE 202 HD12 ILE 202 -5.100 3.345 12.332 721 HD13 ILE 202 HD13 ILE 202 -4.080 4.732 11.956 722 H LYS 203 HN LYS 203 -1.427 6.382 9.389 723 HA LYS 203 HA LYS 203 -1.532 7.224 6.567 724 HB2 LYS 203 HB2 LYS 203 0.381 8.291 8.649 725 HB3 LYS 203 HB1 LYS 203 0.267 8.799 6.971 726 HG2 LYS 203 HG2 LYS 203 -2.295 9.148 8.043 727 HG3 LYS 203 HG1 LYS 203 -1.173 9.742 9.261 728 HD2 LYS 203 HD2 LYS 203 -0.060 11.085 7.473 729 HD3 LYS 203 HD1 LYS 203 -1.360 10.602 6.382 730 HE2 LYS 203 HE2 LYS 203 -1.666 12.137 8.959 731 HE3 LYS 203 HE1 LYS 203 -1.794 12.801 7.333 732 HZ1 LYS 203 HZ1 LYS 203 -3.595 10.746 8.499 733 HZ2 LYS 203 HZ2 LYS 203 -3.727 11.410 6.943 734 HZ3 LYS 203 HZ3 LYS 203 -3.962 12.385 8.305 735 H LEU 204 HN LEU 204 0.959 7.245 5.783 736 HA LEU 204 HA LEU 204 2.628 5.211 6.887 737 HB2 LEU 204 HB2 LEU 204 0.664 4.153 5.346 738 HB3 LEU 204 HB1 LEU 204 1.876 4.479 4.128 739 HG LEU 204 HG LEU 204 2.054 2.613 6.477 740 HD11 LEU 204 HD11 LEU 204 2.606 2.152 3.558 741 HD12 LEU 204 HD12 LEU 204 1.053 1.852 4.333 742 HD13 LEU 204 HD13 LEU 204 2.478 0.943 4.835 743 HD21 LEU 204 HD21 LEU 204 4.348 3.483 4.726 744 HD22 LEU 204 HD22 LEU 204 4.390 2.204 5.938 745 HD23 LEU 204 HD23 LEU 204 4.145 3.879 6.430 746 H LYS 205 HN LYS 205 4.274 6.706 6.767 747 HA LYS 205 HA LYS 205 4.958 7.878 4.207 748 HB2 LYS 205 HB2 LYS 205 6.457 7.927 6.832 749 HB3 LYS 205 HB1 LYS 205 6.910 8.821 5.391 750 HG2 LYS 205 HG2 LYS 205 4.413 9.708 5.672 751 HG3 LYS 205 HG1 LYS 205 4.773 9.326 7.349 752 HD2 LYS 205 HD2 LYS 205 5.337 11.634 6.911 753 HD3 LYS 205 HD1 LYS 205 6.807 10.706 7.214 754 HE2 LYS 205 HE2 LYS 205 7.043 12.276 5.325 755 HE3 LYS 205 HE1 LYS 205 7.274 10.599 4.842 756 HZ1 LYS 205 HZ1 LYS 205 4.779 12.166 4.471 757 HZ2 LYS 205 HZ2 LYS 205 5.018 10.565 3.984 758 HZ3 LYS 205 HZ3 LYS 205 5.902 11.811 3.257 759 H ILE 206 HN ILE 206 5.139 5.716 3.168 760 HA ILE 206 HA ILE 206 7.171 3.923 3.971 761 HB ILE 206 HB ILE 206 6.606 4.080 1.053 762 HG12 ILE 206 HG12 ILE 206 4.587 2.871 2.938 763 HG13 ILE 206 HG11 ILE 206 4.338 4.427 2.139 764 HG21 ILE 206 HG21 ILE 206 6.196 1.546 2.316 765 HG22 ILE 206 HG22 ILE 206 7.682 2.295 2.937 766 HG23 ILE 206 HG23 ILE 206 7.476 2.059 1.203 767 HD11 ILE 206 HD11 ILE 206 4.936 2.867 0.023 768 HD12 ILE 206 HD12 ILE 206 3.298 3.109 0.627 769 HD13 ILE 206 HD13 ILE 206 4.203 1.676 1.097 770 H THR 207 HN THR 207 9.309 4.105 3.808 771 HA THR 207 HA THR 207 10.384 6.179 2.023 772 HB THR 207 HB THR 207 12.474 5.901 3.476 773 HG1 THR 207 HG1 THR 207 11.483 3.883 4.443 774 HG21 THR 207 HG21 THR 207 9.946 6.965 4.742 775 HG22 THR 207 HG22 THR 207 11.000 7.845 3.633 776 HG23 THR 207 HG23 THR 207 11.592 7.376 5.228 777 H LYS 208 HN LYS 208 11.247 5.463 0.187 778 HA LYS 208 HA LYS 208 13.192 3.511 0.006 779 HB2 LYS 208 HB2 LYS 208 12.158 1.585 -0.911 780 HB3 LYS 208 HB1 LYS 208 11.254 1.984 0.532 781 HG2 LYS 208 HG2 LYS 208 10.394 2.588 -2.293 782 HG3 LYS 208 HG1 LYS 208 9.826 1.244 -1.312 783 HD2 LYS 208 HD2 LYS 208 8.135 2.685 -0.874 784 HD3 LYS 208 HD1 LYS 208 9.265 3.294 0.337 785 HE2 LYS 208 HE2 LYS 208 10.079 4.946 -1.284 786 HE3 LYS 208 HE1 LYS 208 8.902 4.362 -2.452 787 HZ1 LYS 208 HZ1 LYS 208 8.138 6.335 -1.354 788 HZ2 LYS 208 HZ2 LYS 208 8.278 5.597 0.166 789 HZ3 LYS 208 HZ3 LYS 208 7.141 5.026 -0.952 790 H THR 209 HN THR 209 12.315 2.508 -2.645 791 HA THR 209 HA THR 209 12.627 2.984 -4.808 792 HB THR 209 HB THR 209 11.636 5.056 -5.774 793 HG1 THR 209 HG1 THR 209 11.863 6.023 -3.362 794 HG21 THR 209 HG21 THR 209 9.848 3.563 -3.866 795 HG22 THR 209 HG22 THR 209 10.316 3.013 -5.475 796 HG23 THR 209 HG23 THR 209 9.326 4.462 -5.291 797 H ILE 210 HN ILE 210 14.864 3.117 -3.582 798 HA ILE 210 HA ILE 210 16.263 5.586 -3.823 799 HB ILE 210 HB ILE 210 18.295 4.249 -3.439 800 HG12 ILE 210 HG12 ILE 210 16.423 1.866 -3.452 801 HG13 ILE 210 HG11 ILE 210 17.595 2.234 -4.711 802 HG21 ILE 210 HG21 ILE 210 17.696 3.440 -1.199 803 HG22 ILE 210 HG22 ILE 210 15.988 3.560 -1.622 804 HG23 ILE 210 HG23 ILE 210 16.981 5.015 -1.545 805 HD11 ILE 210 HD11 ILE 210 18.230 1.585 -1.844 806 HD12 ILE 210 HD12 ILE 210 19.409 1.958 -3.101 807 HD13 ILE 210 HD13 ILE 210 18.417 0.505 -3.226 808 H GLN 211 HN GLN 211 17.591 6.310 -5.437 809 HA GLN 211 HA GLN 211 17.599 4.737 -7.930 810 HB2 GLN 211 HB2 GLN 211 17.504 7.752 -7.716 811 HB3 GLN 211 HB1 GLN 211 17.460 6.807 -9.197 812 HG2 GLN 211 HG2 GLN 211 15.312 5.833 -8.466 813 HG3 GLN 211 HG1 GLN 211 15.350 6.888 -7.053 814 HE21 GLN 211 HE21 GLN 211 14.874 6.691 -10.468 815 HE22 GLN 211 HE22 GLN 211 14.253 8.289 -10.685 816 H ASN 212 HN ASN 212 19.601 4.104 -6.532 817 HA ASN 212 HA ASN 212 21.853 3.997 -6.336 818 HB2 ASN 212 HB2 ASN 212 21.716 5.693 -8.833 819 HB3 ASN 212 HB1 ASN 212 23.229 5.109 -8.154 820 HD21 ASN 212 HD21 ASN 212 23.690 3.926 -9.992 821 HD22 ASN 212 HD22 ASN 212 22.859 2.458 -10.376 Start of MODEL 4 1 H1 SER 1 HT1 SER 1 -13.069 -8.228 -13.170 2 H2 SER 1 HT2 SER 1 -12.330 -8.174 -11.655 3 H3 SER 1 HT3 SER 1 -11.557 -8.946 -12.939 4 HA SER 1 HA SER 1 -10.545 -6.831 -12.531 5 HB2 SER 1 HB2 SER 1 -12.204 -6.768 -15.061 6 HB3 SER 1 HB1 SER 1 -10.648 -5.983 -14.795 7 HG SER 1 HG SER 1 -11.095 -8.430 -15.693 8 H GLU 2 HN GLU 2 -14.016 -6.756 -12.595 9 HA GLU 2 HA GLU 2 -14.018 -3.835 -12.406 10 HB2 GLU 2 HB2 GLU 2 -16.328 -5.755 -12.750 11 HB3 GLU 2 HB1 GLU 2 -16.461 -4.003 -12.695 12 HG2 GLU 2 HG2 GLU 2 -14.929 -5.571 -14.754 13 HG3 GLU 2 HG1 GLU 2 -16.522 -4.854 -14.979 14 H GLU 3 HN GLU 3 -14.871 -6.698 -10.552 15 HA GLU 3 HA GLU 3 -16.341 -5.450 -8.519 16 HB2 GLU 3 HB2 GLU 3 -14.690 -7.970 -8.495 17 HB3 GLU 3 HB1 GLU 3 -15.692 -7.459 -7.147 18 HG2 GLU 3 HG2 GLU 3 -17.673 -7.599 -8.524 19 HG3 GLU 3 HG1 GLU 3 -16.692 -8.029 -9.925 20 H GLU 4 HN GLU 4 -12.908 -5.700 -9.029 21 HA GLU 4 HA GLU 4 -12.175 -4.995 -6.357 22 HB2 GLU 4 HB2 GLU 4 -9.899 -4.556 -7.360 23 HB3 GLU 4 HB1 GLU 4 -10.535 -6.175 -7.643 24 HG2 GLU 4 HG2 GLU 4 -11.179 -5.559 -9.897 25 HG3 GLU 4 HG1 GLU 4 -10.617 -3.910 -9.625 26 H ASP 5 HN ASP 5 -12.994 -3.174 -9.221 27 HA ASP 5 HA ASP 5 -12.108 -0.685 -8.004 28 HB2 ASP 5 HB2 ASP 5 -13.330 -1.294 -10.700 29 HB3 ASP 5 HB1 ASP 5 -13.059 0.356 -10.133 30 H LYS 6 HN LYS 6 -14.860 -2.629 -8.017 31 HA LYS 6 HA LYS 6 -16.519 -0.372 -7.099 32 HB2 LYS 6 HB2 LYS 6 -17.288 -1.615 -9.165 33 HB3 LYS 6 HB1 LYS 6 -17.519 -3.027 -8.145 34 HG2 LYS 6 HG2 LYS 6 -19.638 -1.996 -8.395 35 HG3 LYS 6 HG1 LYS 6 -19.095 -1.637 -6.758 36 HD2 LYS 6 HD2 LYS 6 -20.075 0.335 -7.764 37 HD3 LYS 6 HD1 LYS 6 -18.348 0.581 -7.513 38 HE2 LYS 6 HE2 LYS 6 -19.139 1.413 -9.701 39 HE3 LYS 6 HE1 LYS 6 -17.901 0.166 -9.844 40 HZ1 LYS 6 HZ1 LYS 6 -19.678 -0.204 -11.414 41 HZ2 LYS 6 HZ2 LYS 6 -20.825 -0.235 -10.174 42 HZ3 LYS 6 HZ3 LYS 6 -19.655 -1.451 -10.275 43 H CYS 7 HN CYS 7 -14.603 -1.679 -5.524 44 HA CYS 7 HA CYS 7 -15.920 -3.735 -3.957 45 HB2 CYS 7 HB2 CYS 7 -13.441 -3.687 -4.689 46 HB3 CYS 7 HB1 CYS 7 -13.228 -2.539 -3.372 47 HG CYS 7 HG CYS 7 -14.011 -4.311 -1.369 48 H LYS 8 HN LYS 8 -16.169 -3.635 -1.700 49 HA LYS 8 HA LYS 8 -16.959 -1.038 -0.719 50 HB2 LYS 8 HB2 LYS 8 -17.208 -3.861 0.269 51 HB3 LYS 8 HB1 LYS 8 -17.491 -2.523 1.368 52 HG2 LYS 8 HG2 LYS 8 -19.554 -3.442 0.358 53 HG3 LYS 8 HG1 LYS 8 -19.314 -1.725 0.031 54 HD2 LYS 8 HD2 LYS 8 -18.571 -2.195 -2.202 55 HD3 LYS 8 HD1 LYS 8 -18.561 -3.929 -1.882 56 HE2 LYS 8 HE2 LYS 8 -21.034 -2.219 -1.759 57 HE3 LYS 8 HE1 LYS 8 -20.525 -3.098 -3.198 58 HZ1 LYS 8 HZ1 LYS 8 -20.655 -5.157 -1.917 59 HZ2 LYS 8 HZ2 LYS 8 -22.145 -4.363 -1.964 60 HZ3 LYS 8 HZ3 LYS 8 -21.196 -4.296 -0.568 61 HA PRO 9 HA PRO 9 -13.289 -0.055 1.531 62 HB2 PRO 9 HB2 PRO 9 -14.900 0.797 3.824 63 HB3 PRO 9 HB1 PRO 9 -13.840 1.744 2.775 64 HG2 PRO 9 HG2 PRO 9 -16.533 1.968 2.699 65 HG3 PRO 9 HG1 PRO 9 -15.508 2.209 1.273 66 HD2 PRO 9 HD2 PRO 9 -17.198 -0.131 2.025 67 HD3 PRO 9 HD1 PRO 9 -16.856 0.548 0.423 68 H MET 10 HN MET 10 -11.939 -0.866 3.058 69 HA MET 10 HA MET 10 -12.893 -3.115 4.626 70 HB2 MET 10 HB2 MET 10 -10.501 -3.496 5.119 71 HB3 MET 10 HB1 MET 10 -10.831 -3.443 3.400 72 HG2 MET 10 HG2 MET 10 -10.000 -1.161 3.296 73 HG3 MET 10 HG1 MET 10 -9.669 -1.213 5.024 74 HE1 MET 10 HE1 MET 10 -8.887 -2.911 1.580 75 HE2 MET 10 HE2 MET 10 -9.144 -4.304 2.630 76 HE3 MET 10 HE3 MET 10 -7.536 -3.965 1.997 77 H SER 11 HN SER 11 -12.240 -3.305 6.892 78 HA SER 11 HA SER 11 -13.175 -1.027 8.312 79 HB2 SER 11 HB2 SER 11 -12.784 -2.451 10.333 80 HB3 SER 11 HB1 SER 11 -13.770 -3.224 9.093 81 HG SER 11 HG SER 11 -11.862 -4.322 8.391 82 H TYR 12 HN TYR 12 -12.003 -0.347 10.416 83 HA TYR 12 HA TYR 12 -9.677 1.067 9.725 84 HB2 TYR 12 HB2 TYR 12 -11.253 1.654 11.572 85 HB3 TYR 12 HB1 TYR 12 -10.608 0.311 12.513 86 HD1 TYR 12 HD1 TYR 12 -8.022 0.382 12.941 87 HD2 TYR 12 HD2 TYR 12 -10.352 3.759 11.832 88 HE1 TYR 12 HE1 TYR 12 -6.308 1.868 13.898 89 HE2 TYR 12 HE2 TYR 12 -8.647 5.250 12.775 90 HH TYR 12 HH TYR 12 -6.865 5.184 14.434 91 H GLU 13 HN GLU 13 -10.103 -1.981 11.455 92 HA GLU 13 HA GLU 13 -7.474 -2.467 12.234 93 HB2 GLU 13 HB2 GLU 13 -9.445 -3.814 12.928 94 HB3 GLU 13 HB1 GLU 13 -9.512 -4.509 11.313 95 HG2 GLU 13 HG2 GLU 13 -7.274 -5.452 11.641 96 HG3 GLU 13 HG1 GLU 13 -7.256 -4.799 13.278 97 H GLU 14 HN GLU 14 -9.108 -3.081 9.182 98 HA GLU 14 HA GLU 14 -6.961 -4.592 8.042 99 HB2 GLU 14 HB2 GLU 14 -9.419 -3.324 6.832 100 HB3 GLU 14 HB1 GLU 14 -8.280 -4.299 5.914 101 HG2 GLU 14 HG2 GLU 14 -8.811 -6.249 7.147 102 HG3 GLU 14 HG1 GLU 14 -9.710 -5.320 8.351 103 H LYS 15 HN LYS 15 -8.166 -1.267 7.597 104 HA LYS 15 HA LYS 15 -6.270 -0.397 5.755 105 HB2 LYS 15 HB2 LYS 15 -7.749 1.068 7.932 106 HB3 LYS 15 HB1 LYS 15 -6.674 1.884 6.812 107 HG2 LYS 15 HG2 LYS 15 -8.045 1.365 4.954 108 HG3 LYS 15 HG1 LYS 15 -8.999 0.228 5.916 109 HD2 LYS 15 HD2 LYS 15 -10.236 1.853 6.872 110 HD3 LYS 15 HD1 LYS 15 -8.890 2.989 6.946 111 HE2 LYS 15 HE2 LYS 15 -9.130 3.448 4.572 112 HE3 LYS 15 HE1 LYS 15 -10.436 2.268 4.455 113 HZ1 LYS 15 HZ1 LYS 15 -10.508 4.695 6.176 114 HZ2 LYS 15 HZ2 LYS 15 -11.787 3.625 5.877 115 HZ3 LYS 15 HZ3 LYS 15 -11.198 4.602 4.630 116 H ARG 16 HN ARG 16 -6.151 -0.399 9.291 117 HA ARG 16 HA ARG 16 -3.599 0.740 9.585 118 HB2 ARG 16 HB2 ARG 16 -5.204 0.445 11.447 119 HB3 ARG 16 HB1 ARG 16 -4.947 -1.297 11.371 120 HG2 ARG 16 HG2 ARG 16 -2.407 -0.493 11.663 121 HG3 ARG 16 HG1 ARG 16 -3.232 0.831 12.488 122 HD2 ARG 16 HD2 ARG 16 -2.722 -0.842 14.114 123 HD3 ARG 16 HD1 ARG 16 -4.461 -0.870 13.834 124 HE ARG 16 HE ARG 16 -2.757 -2.767 12.386 125 HH11 ARG 16 HH11 ARG 16 -5.187 -2.172 14.834 126 HH12 ARG 16 HH12 ARG 16 -5.634 -3.843 14.973 127 HH21 ARG 16 HH21 ARG 16 -3.343 -4.970 12.562 128 HH22 ARG 16 HH22 ARG 16 -4.593 -5.432 13.679 129 H GLN 17 HN GLN 17 -4.623 -2.657 9.379 130 HA GLN 17 HA GLN 17 -2.038 -3.725 9.706 131 HB2 GLN 17 HB2 GLN 17 -4.249 -4.914 10.062 132 HB3 GLN 17 HB1 GLN 17 -4.345 -5.071 8.314 133 HG2 GLN 17 HG2 GLN 17 -3.492 -7.102 9.299 134 HG3 GLN 17 HG1 GLN 17 -2.252 -6.326 8.318 135 HE21 GLN 17 HE21 GLN 17 -0.576 -7.346 9.394 136 HE22 GLN 17 HE22 GLN 17 -0.123 -6.927 11.012 137 H LEU 18 HN LEU 18 -3.706 -2.407 7.023 138 HA LEU 18 HA LEU 18 -2.138 -3.617 4.960 139 HB2 LEU 18 HB2 LEU 18 -4.454 -2.159 5.062 140 HB3 LEU 18 HB1 LEU 18 -3.325 -0.967 4.461 141 HG LEU 18 HG LEU 18 -3.745 -3.652 3.156 142 HD11 LEU 18 HD11 LEU 18 -5.009 -1.000 2.514 143 HD12 LEU 18 HD12 LEU 18 -5.833 -2.443 3.096 144 HD13 LEU 18 HD13 LEU 18 -5.089 -2.434 1.498 145 HD21 LEU 18 HD21 LEU 18 -1.670 -2.752 2.487 146 HD22 LEU 18 HD22 LEU 18 -2.337 -1.131 2.331 147 HD23 LEU 18 HD23 LEU 18 -2.800 -2.391 1.190 148 H SER 19 HN SER 19 -2.043 -0.543 6.711 149 HA SER 19 HA SER 19 0.274 0.494 5.542 150 HB2 SER 19 HB2 SER 19 -1.071 1.843 7.061 151 HB3 SER 19 HB1 SER 19 -0.756 0.728 8.388 152 HG SER 19 HG SER 19 1.599 1.419 7.583 153 H LEU 20 HN LEU 20 -0.220 -1.979 7.928 154 HA LEU 20 HA LEU 20 2.545 -2.174 8.649 155 HB2 LEU 20 HB2 LEU 20 0.156 -3.876 9.297 156 HB3 LEU 20 HB1 LEU 20 1.757 -4.159 9.941 157 HG LEU 20 HG LEU 20 0.199 -1.617 10.379 158 HD11 LEU 20 HD11 LEU 20 -0.666 -3.841 11.358 159 HD12 LEU 20 HD12 LEU 20 -0.509 -2.442 12.418 160 HD13 LEU 20 HD13 LEU 20 0.716 -3.713 12.445 161 HD21 LEU 20 HD21 LEU 20 2.719 -1.539 10.488 162 HD22 LEU 20 HD22 LEU 20 2.614 -2.657 11.846 163 HD23 LEU 20 HD23 LEU 20 1.878 -1.060 11.959 164 H ASP 21 HN ASP 21 0.388 -3.781 6.391 165 HA ASP 21 HA ASP 21 2.192 -5.980 5.986 166 HB2 ASP 21 HB2 ASP 21 0.614 -6.752 4.281 167 HB3 ASP 21 HB1 ASP 21 -0.172 -6.400 5.807 168 H ILE 22 HN ILE 22 1.574 -2.922 4.365 169 HA ILE 22 HA ILE 22 3.293 -3.511 2.151 170 HB ILE 22 HB ILE 22 2.380 -0.865 3.275 171 HG12 ILE 22 HG12 ILE 22 1.520 -2.199 0.711 172 HG13 ILE 22 HG11 ILE 22 0.715 -2.545 2.245 173 HG21 ILE 22 HG21 ILE 22 4.400 -0.423 2.099 174 HG22 ILE 22 HG22 ILE 22 3.063 0.035 1.041 175 HG23 ILE 22 HG23 ILE 22 3.922 -1.480 0.769 176 HD11 ILE 22 HD11 ILE 22 0.155 -0.232 2.470 177 HD12 ILE 22 HD12 ILE 22 -0.459 -0.860 0.950 178 HD13 ILE 22 HD13 ILE 22 0.981 0.163 0.974 179 H ASN 23 HN ASN 23 3.687 -2.124 5.325 180 HA ASN 23 HA ASN 23 6.324 -1.235 5.148 181 HB2 ASN 23 HB2 ASN 23 5.097 -0.621 7.064 182 HB3 ASN 23 HB1 ASN 23 4.641 -2.281 7.408 183 HD21 ASN 23 HD21 ASN 23 7.188 0.082 7.573 184 HD22 ASN 23 HD22 ASN 23 8.170 -0.765 8.718 185 H LYS 24 HN LYS 24 4.991 -4.429 5.339 186 HA LYS 24 HA LYS 24 7.368 -5.763 6.217 187 HB2 LYS 24 HB2 LYS 24 4.814 -6.735 4.942 188 HB3 LYS 24 HB1 LYS 24 6.108 -7.820 5.445 189 HG2 LYS 24 HG2 LYS 24 5.843 -7.081 7.743 190 HG3 LYS 24 HG1 LYS 24 4.601 -5.932 7.248 191 HD2 LYS 24 HD2 LYS 24 3.235 -7.830 6.430 192 HD3 LYS 24 HD1 LYS 24 4.457 -8.939 7.056 193 HE2 LYS 24 HE2 LYS 24 2.806 -6.986 8.658 194 HE3 LYS 24 HE1 LYS 24 2.633 -8.739 8.637 195 HZ1 LYS 24 HZ1 LYS 24 4.823 -8.942 9.608 196 HZ2 LYS 24 HZ2 LYS 24 3.850 -7.957 10.578 197 HZ3 LYS 24 HZ3 LYS 24 5.026 -7.264 9.584 198 H LEU 25 HN LEU 25 6.019 -4.853 3.133 199 HA LEU 25 HA LEU 25 7.359 -6.670 1.476 200 HB2 LEU 25 HB2 LEU 25 6.434 -3.877 0.907 201 HB3 LEU 25 HB1 LEU 25 6.912 -5.018 -0.317 202 HG LEU 25 HG LEU 25 4.503 -5.091 1.453 203 HD11 LEU 25 HD11 LEU 25 4.983 -5.075 -1.501 204 HD12 LEU 25 HD12 LEU 25 4.235 -3.817 -0.529 205 HD13 LEU 25 HD13 LEU 25 3.408 -5.354 -0.771 206 HD21 LEU 25 HD21 LEU 25 5.699 -7.293 -0.162 207 HD22 LEU 25 HD22 LEU 25 4.017 -7.284 0.354 208 HD23 LEU 25 HD23 LEU 25 5.312 -7.314 1.552 209 HA PRO 26 HA PRO 26 11.605 -5.161 1.486 210 HB2 PRO 26 HB2 PRO 26 11.613 -6.676 -1.074 211 HB3 PRO 26 HB1 PRO 26 12.706 -6.805 0.315 212 HG2 PRO 26 HG2 PRO 26 10.888 -8.680 -0.152 213 HG3 PRO 26 HG1 PRO 26 11.225 -8.150 1.507 214 HD2 PRO 26 HD2 PRO 26 8.934 -7.442 -0.292 215 HD3 PRO 26 HD1 PRO 26 8.931 -7.820 1.445 216 H GLY 27 HN GLY 27 12.796 -3.653 0.238 217 HA2 GLY 27 HA2 GLY 27 11.478 -1.543 -0.808 218 HA3 GLY 27 HA1 GLY 27 13.119 -1.940 -1.270 219 H GLU 28 HN GLU 28 12.699 -4.234 -2.778 220 HA GLU 28 HA GLU 28 12.067 -3.244 -5.294 221 HB2 GLU 28 HB2 GLU 28 13.387 -5.235 -5.154 222 HB3 GLU 28 HB1 GLU 28 12.188 -6.044 -4.175 223 HG2 GLU 28 HG2 GLU 28 10.679 -5.895 -6.240 224 HG3 GLU 28 HG1 GLU 28 12.175 -5.565 -7.103 225 H LYS 29 HN LYS 29 10.120 -5.471 -3.336 226 HA LYS 29 HA LYS 29 7.815 -5.356 -4.951 227 HB2 LYS 29 HB2 LYS 29 8.351 -6.185 -2.107 228 HB3 LYS 29 HB1 LYS 29 6.744 -6.306 -2.822 229 HG2 LYS 29 HG2 LYS 29 9.209 -7.667 -3.901 230 HG3 LYS 29 HG1 LYS 29 7.998 -8.435 -2.868 231 HD2 LYS 29 HD2 LYS 29 6.293 -7.761 -4.618 232 HD3 LYS 29 HD1 LYS 29 7.653 -7.381 -5.670 233 HE2 LYS 29 HE2 LYS 29 6.918 -9.577 -6.214 234 HE3 LYS 29 HE1 LYS 29 8.448 -9.730 -5.354 235 HZ1 LYS 29 HZ1 LYS 29 5.777 -10.060 -4.106 236 HZ2 LYS 29 HZ2 LYS 29 7.276 -10.345 -3.370 237 HZ3 LYS 29 HZ3 LYS 29 6.748 -11.338 -4.635 238 H LEU 30 HN LEU 30 8.921 -3.537 -2.225 239 HA LEU 30 HA LEU 30 6.556 -2.224 -1.468 240 HB2 LEU 30 HB2 LEU 30 8.584 -2.318 -0.112 241 HB3 LEU 30 HB1 LEU 30 9.444 -1.355 -1.292 242 HG LEU 30 HG LEU 30 8.346 0.608 -0.675 243 HD11 LEU 30 HD11 LEU 30 6.390 -0.723 1.124 244 HD12 LEU 30 HD12 LEU 30 6.064 -0.684 -0.602 245 HD13 LEU 30 HD13 LEU 30 6.283 0.818 0.285 246 HD21 LEU 30 HD21 LEU 30 8.549 0.649 1.803 247 HD22 LEU 30 HD22 LEU 30 9.936 -0.068 0.985 248 HD23 LEU 30 HD23 LEU 30 8.744 -1.103 1.770 249 H GLY 31 HN GLY 31 9.000 -1.336 -3.897 250 HA2 GLY 31 HA2 GLY 31 8.193 1.289 -4.383 251 HA3 GLY 31 HA1 GLY 31 8.954 0.252 -5.569 252 H ARG 32 HN ARG 32 6.708 -1.700 -5.455 253 HA ARG 32 HA ARG 32 5.091 -0.622 -7.499 254 HB2 ARG 32 HB2 ARG 32 5.354 -3.015 -7.309 255 HB3 ARG 32 HB1 ARG 32 4.663 -2.999 -5.696 256 HG2 ARG 32 HG2 ARG 32 3.045 -3.846 -7.296 257 HG3 ARG 32 HG1 ARG 32 2.503 -2.308 -6.636 258 HD2 ARG 32 HD2 ARG 32 2.093 -2.335 -9.011 259 HD3 ARG 32 HD1 ARG 32 3.357 -1.164 -8.648 260 HE ARG 32 HE ARG 32 4.649 -3.529 -9.271 261 HH11 ARG 32 HH11 ARG 32 2.464 -1.301 -10.854 262 HH12 ARG 32 HH12 ARG 32 3.088 -1.609 -12.443 263 HH21 ARG 32 HH21 ARG 32 5.493 -3.925 -11.374 264 HH22 ARG 32 HH22 ARG 32 4.813 -3.097 -12.737 265 H VAL 33 HN VAL 33 4.541 -1.035 -4.021 266 HA VAL 33 HA VAL 33 1.790 -0.271 -4.141 267 HB VAL 33 HB VAL 33 3.131 0.135 -1.555 268 HG11 VAL 33 HG11 VAL 33 0.810 -1.550 -2.488 269 HG12 VAL 33 HG12 VAL 33 0.722 0.094 -1.850 270 HG13 VAL 33 HG13 VAL 33 1.246 -1.222 -0.811 271 HG21 VAL 33 HG21 VAL 33 4.555 -1.648 -2.219 272 HG22 VAL 33 HG22 VAL 33 3.218 -2.529 -2.957 273 HG23 VAL 33 HG23 VAL 33 3.300 -2.357 -1.206 274 H VAL 34 HN VAL 34 4.708 1.453 -3.024 275 HA VAL 34 HA VAL 34 3.568 3.918 -2.467 276 HB VAL 34 HB VAL 34 5.743 4.323 -2.056 277 HG11 VAL 34 HG11 VAL 34 6.257 2.006 -2.298 278 HG12 VAL 34 HG12 VAL 34 7.572 2.978 -2.955 279 HG13 VAL 34 HG13 VAL 34 6.427 2.190 -4.041 280 HG21 VAL 34 HG21 VAL 34 5.466 5.770 -4.059 281 HG22 VAL 34 HG22 VAL 34 6.178 4.487 -5.031 282 HG23 VAL 34 HG23 VAL 34 7.129 5.269 -3.770 283 H HIS 35 HN HIS 35 4.489 2.521 -5.541 284 HA HIS 35 HA HIS 35 3.782 4.748 -7.145 285 HB2 HIS 35 HB2 HIS 35 5.281 2.891 -7.859 286 HB3 HIS 35 HB1 HIS 35 3.880 1.834 -7.928 287 HD1 HIS 35 HD1 HIS 35 5.418 4.794 -9.659 288 HD2 HIS 35 HD2 HIS 35 2.389 2.014 -10.254 289 HE1 HIS 35 HE1 HIS 35 4.678 5.099 -12.039 290 HE2 HIS 35 HE2 HIS 35 2.966 3.296 -12.420 291 H ILE 36 HN ILE 36 2.002 1.787 -6.237 292 HA ILE 36 HA ILE 36 -0.269 2.177 -7.792 293 HB ILE 36 HB ILE 36 -0.242 0.958 -5.018 294 HG12 ILE 36 HG12 ILE 36 0.164 -0.268 -7.749 295 HG13 ILE 36 HG11 ILE 36 1.306 -0.246 -6.419 296 HG21 ILE 36 HG21 ILE 36 -2.427 0.519 -5.284 297 HG22 ILE 36 HG22 ILE 36 -2.175 -0.065 -6.927 298 HG23 ILE 36 HG23 ILE 36 -2.392 1.657 -6.628 299 HD11 ILE 36 HD11 ILE 36 -0.266 -1.677 -5.131 300 HD12 ILE 36 HD12 ILE 36 0.374 -2.430 -6.590 301 HD13 ILE 36 HD13 ILE 36 -1.266 -1.787 -6.578 302 H ILE 37 HN ILE 37 0.239 3.190 -4.405 303 HA ILE 37 HA ILE 37 -2.272 4.404 -4.130 304 HB ILE 37 HB ILE 37 0.266 5.144 -2.663 305 HG12 ILE 37 HG12 ILE 37 -1.599 3.708 -1.060 306 HG13 ILE 37 HG11 ILE 37 -1.375 2.801 -2.551 307 HG21 ILE 37 HG21 ILE 37 -1.927 6.630 -2.766 308 HG22 ILE 37 HG22 ILE 37 -0.977 6.462 -1.287 309 HG23 ILE 37 HG23 ILE 37 -2.441 5.502 -1.510 310 HD11 ILE 37 HD11 ILE 37 0.994 2.694 -2.179 311 HD12 ILE 37 HD12 ILE 37 0.141 2.113 -0.748 312 HD13 ILE 37 HD13 ILE 37 0.843 3.726 -0.759 313 H GLN 38 HN GLN 38 0.858 5.841 -4.966 314 HA GLN 38 HA GLN 38 -0.018 8.477 -5.232 315 HB2 GLN 38 HB2 GLN 38 2.274 6.997 -6.504 316 HB3 GLN 38 HB1 GLN 38 2.001 8.709 -6.810 317 HG2 GLN 38 HG2 GLN 38 1.967 8.729 -4.116 318 HG3 GLN 38 HG1 GLN 38 2.985 7.320 -4.388 319 HE21 GLN 38 HE21 GLN 38 4.698 8.514 -3.432 320 HE22 GLN 38 HE22 GLN 38 5.572 9.688 -4.352 321 H SER 39 HN SER 39 -0.032 5.839 -7.607 322 HA SER 39 HA SER 39 -0.803 7.501 -9.763 323 HB2 SER 39 HB2 SER 39 -0.833 4.504 -9.379 324 HB3 SER 39 HB1 SER 39 -1.113 5.325 -10.898 325 HG SER 39 HG SER 39 0.949 6.011 -10.962 326 H ARG 40 HN ARG 40 -2.561 5.482 -7.428 327 HA ARG 40 HA ARG 40 -5.071 5.845 -8.826 328 HB2 ARG 40 HB2 ARG 40 -4.669 4.763 -6.048 329 HB3 ARG 40 HB1 ARG 40 -6.094 4.588 -7.054 330 HG2 ARG 40 HG2 ARG 40 -4.383 3.418 -8.684 331 HG3 ARG 40 HG1 ARG 40 -3.494 3.164 -7.178 332 HD2 ARG 40 HD2 ARG 40 -4.910 1.274 -7.624 333 HD3 ARG 40 HD1 ARG 40 -5.448 2.142 -6.194 334 HE ARG 40 HE ARG 40 -7.075 3.225 -7.900 335 HH11 ARG 40 HH11 ARG 40 -6.015 -0.101 -7.860 336 HH12 ARG 40 HH12 ARG 40 -7.460 -0.708 -8.600 337 HH21 ARG 40 HH21 ARG 40 -8.978 2.449 -8.872 338 HH22 ARG 40 HH22 ARG 40 -9.158 0.748 -9.196 339 H GLU 41 HN GLU 41 -3.495 7.173 -5.966 340 HA GLU 41 HA GLU 41 -5.781 8.986 -5.596 341 HB2 GLU 41 HB2 GLU 41 -3.533 8.422 -3.676 342 HB3 GLU 41 HB1 GLU 41 -4.993 9.337 -3.341 343 HG2 GLU 41 HG2 GLU 41 -4.707 6.384 -3.786 344 HG3 GLU 41 HG1 GLU 41 -5.262 7.224 -2.340 345 HA PRO 42 HA PRO 42 -2.733 11.804 -7.568 346 HB2 PRO 42 HB2 PRO 42 -5.175 13.441 -7.851 347 HB3 PRO 42 HB1 PRO 42 -3.993 12.962 -9.073 348 HG2 PRO 42 HG2 PRO 42 -6.439 11.878 -8.997 349 HG3 PRO 42 HG1 PRO 42 -5.015 10.930 -9.460 350 HD2 PRO 42 HD2 PRO 42 -6.507 10.971 -6.869 351 HD3 PRO 42 HD1 PRO 42 -5.791 9.597 -7.741 352 H SER 43 HN SER 43 -4.912 12.107 -4.942 353 HA SER 43 HA SER 43 -4.461 14.788 -4.209 354 HB2 SER 43 HB2 SER 43 -5.247 12.496 -2.402 355 HB3 SER 43 HB1 SER 43 -5.580 14.210 -2.159 356 HG SER 43 HG SER 43 -7.149 14.142 -3.600 357 H LEU 44 HN LEU 44 -2.494 11.994 -3.902 358 HA LEU 44 HA LEU 44 -0.778 13.452 -2.011 359 HB2 LEU 44 HB2 LEU 44 -0.065 11.257 -1.092 360 HB3 LEU 44 HB1 LEU 44 -1.729 11.675 -0.761 361 HG LEU 44 HG LEU 44 -2.138 10.199 -2.939 362 HD11 LEU 44 HD11 LEU 44 0.258 9.777 -3.292 363 HD12 LEU 44 HD12 LEU 44 -0.650 8.293 -3.005 364 HD13 LEU 44 HD13 LEU 44 0.336 8.986 -1.717 365 HD21 LEU 44 HD21 LEU 44 -3.163 9.848 -0.768 366 HD22 LEU 44 HD22 LEU 44 -1.673 9.126 -0.162 367 HD23 LEU 44 HD23 LEU 44 -2.590 8.320 -1.434 368 H LYS 45 HN LYS 45 -0.911 12.841 -5.072 369 HA LYS 45 HA LYS 45 1.543 11.442 -5.568 370 HB2 LYS 45 HB2 LYS 45 1.215 11.917 -7.870 371 HB3 LYS 45 HB1 LYS 45 -0.382 11.618 -7.205 372 HG2 LYS 45 HG2 LYS 45 -0.701 14.082 -7.068 373 HG3 LYS 45 HG1 LYS 45 0.846 14.269 -7.912 374 HD2 LYS 45 HD2 LYS 45 -0.165 12.670 -9.646 375 HD3 LYS 45 HD1 LYS 45 -1.714 13.084 -8.913 376 HE2 LYS 45 HE2 LYS 45 -1.315 15.434 -9.354 377 HE3 LYS 45 HE1 LYS 45 0.272 15.047 -10.019 378 HZ1 LYS 45 HZ1 LYS 45 -2.342 14.182 -11.133 379 HZ2 LYS 45 HZ2 LYS 45 -0.832 13.759 -11.758 380 HZ3 LYS 45 HZ3 LYS 45 -1.331 15.375 -11.778 381 H ASN 46 HN ASN 46 0.823 14.521 -4.489 382 HA ASN 46 HA ASN 46 3.141 15.847 -5.585 383 HB2 ASN 46 HB2 ASN 46 2.417 17.649 -3.904 384 HB3 ASN 46 HB1 ASN 46 1.311 17.287 -5.224 385 HD21 ASN 46 HD21 ASN 46 1.853 17.096 -1.813 386 HD22 ASN 46 HD22 ASN 46 0.259 16.580 -1.392 387 H SER 47 HN SER 47 2.766 13.536 -3.317 388 HA SER 47 HA SER 47 4.720 14.470 -1.406 389 HB2 SER 47 HB2 SER 47 3.786 11.609 -1.813 390 HB3 SER 47 HB1 SER 47 4.446 12.343 -0.348 391 HG SER 47 HG SER 47 1.885 12.431 -1.383 392 H ASN 48 HN ASN 48 6.911 14.070 -1.493 393 HA ASN 48 HA ASN 48 8.148 13.380 -3.910 394 HB2 ASN 48 HB2 ASN 48 9.352 13.044 -1.147 395 HB3 ASN 48 HB1 ASN 48 10.232 13.206 -2.662 396 HD21 ASN 48 HD21 ASN 48 10.466 14.772 -0.287 397 HD22 ASN 48 HD22 ASN 48 10.098 16.406 -0.725 398 HA PRO 49 HA PRO 49 7.282 9.079 -4.029 399 HB2 PRO 49 HB2 PRO 49 9.316 8.326 -5.727 400 HB3 PRO 49 HB1 PRO 49 7.754 8.965 -6.232 401 HG2 PRO 49 HG2 PRO 49 10.385 10.334 -6.007 402 HG3 PRO 49 HG1 PRO 49 9.089 10.584 -7.186 403 HD2 PRO 49 HD2 PRO 49 9.545 12.280 -5.126 404 HD3 PRO 49 HD1 PRO 49 7.924 11.997 -5.793 405 H ASP 50 HN ASP 50 10.165 10.331 -2.732 406 HA ASP 50 HA ASP 50 11.103 7.698 -1.919 407 HB2 ASP 50 HB2 ASP 50 12.343 10.423 -1.496 408 HB3 ASP 50 HB1 ASP 50 13.062 8.891 -1.009 409 H GLU 51 HN GLU 51 9.465 10.463 -0.729 410 HA GLU 51 HA GLU 51 9.363 9.341 1.995 411 HB2 GLU 51 HB2 GLU 51 10.367 11.935 1.121 412 HB3 GLU 51 HB1 GLU 51 9.012 12.120 2.229 413 HG2 GLU 51 HG2 GLU 51 10.132 10.893 3.928 414 HG3 GLU 51 HG1 GLU 51 11.402 10.407 2.813 415 H ILE 52 HN ILE 52 7.379 8.431 0.818 416 HA ILE 52 HA ILE 52 5.528 10.369 -0.204 417 HB ILE 52 HB ILE 52 4.454 8.656 -1.281 418 HG12 ILE 52 HG12 ILE 52 5.508 6.540 0.530 419 HG13 ILE 52 HG11 ILE 52 4.043 7.433 0.946 420 HG21 ILE 52 HG21 ILE 52 7.087 7.292 -0.789 421 HG22 ILE 52 HG22 ILE 52 6.930 8.740 -1.796 422 HG23 ILE 52 HG23 ILE 52 6.091 7.256 -2.251 423 HD11 ILE 52 HD11 ILE 52 3.057 6.756 -1.190 424 HD12 ILE 52 HD12 ILE 52 3.481 5.372 -0.177 425 HD13 ILE 52 HD13 ILE 52 4.504 5.810 -1.542 426 H GLU 53 HN GLU 53 3.449 10.747 0.441 427 HA GLU 53 HA GLU 53 2.933 10.237 3.288 428 HB2 GLU 53 HB2 GLU 53 3.209 12.606 2.030 429 HB3 GLU 53 HB1 GLU 53 1.492 12.353 1.778 430 HG2 GLU 53 HG2 GLU 53 2.975 12.652 4.364 431 HG3 GLU 53 HG1 GLU 53 1.702 13.672 3.707 432 H ILE 54 HN ILE 54 1.488 8.601 3.493 433 HA ILE 54 HA ILE 54 -0.708 8.423 1.524 434 HB ILE 54 HB ILE 54 0.341 6.283 3.380 435 HG12 ILE 54 HG12 ILE 54 0.495 6.443 0.367 436 HG13 ILE 54 HG11 ILE 54 1.824 6.879 1.441 437 HG21 ILE 54 HG21 ILE 54 -1.143 4.808 2.020 438 HG22 ILE 54 HG22 ILE 54 -1.843 6.258 1.308 439 HG23 ILE 54 HG23 ILE 54 -2.000 5.960 3.040 440 HD11 ILE 54 HD11 ILE 54 1.930 4.589 0.451 441 HD12 ILE 54 HD12 ILE 54 0.527 4.171 1.432 442 HD13 ILE 54 HD13 ILE 54 2.037 4.653 2.202 443 H ASP 55 HN ASP 55 -2.802 8.607 2.187 444 HA ASP 55 HA ASP 55 -3.221 8.839 5.097 445 HB2 ASP 55 HB2 ASP 55 -3.448 11.016 3.796 446 HB3 ASP 55 HB1 ASP 55 -4.855 10.294 3.014 447 H PHE 56 HN PHE 56 -3.901 6.819 5.496 448 HA PHE 56 HA PHE 56 -5.174 5.216 3.596 449 HB2 PHE 56 HB2 PHE 56 -4.219 4.946 6.306 450 HB3 PHE 56 HB1 PHE 56 -5.677 3.994 6.022 451 HD1 PHE 56 HD1 PHE 56 -2.183 4.521 5.032 452 HD2 PHE 56 HD2 PHE 56 -5.679 2.176 4.498 453 HE1 PHE 56 HE1 PHE 56 -0.872 2.844 3.805 454 HE2 PHE 56 HE2 PHE 56 -4.388 0.502 3.282 455 HZ PHE 56 HZ PHE 56 -1.982 0.812 2.935 456 H GLU 57 HN GLU 57 -6.559 7.529 5.679 457 HA GLU 57 HA GLU 57 -9.137 6.231 5.752 458 HB2 GLU 57 HB2 GLU 57 -8.119 8.848 6.802 459 HB3 GLU 57 HB1 GLU 57 -9.814 8.390 6.900 460 HG2 GLU 57 HG2 GLU 57 -7.568 6.743 8.027 461 HG3 GLU 57 HG1 GLU 57 -8.471 7.938 8.955 462 H THR 58 HN THR 58 -7.527 7.976 3.450 463 HA THR 58 HA THR 58 -10.070 8.971 2.353 464 HB THR 58 HB THR 58 -8.755 10.744 1.190 465 HG1 THR 58 HG1 THR 58 -6.682 10.322 3.045 466 HG21 THR 58 HG21 THR 58 -8.602 10.670 4.193 467 HG22 THR 58 HG22 THR 58 -9.983 11.218 3.239 468 HG23 THR 58 HG23 THR 58 -8.472 12.128 3.208 469 H LEU 59 HN LEU 59 -7.474 6.861 1.859 470 HA LEU 59 HA LEU 59 -7.290 6.864 -0.964 471 HB2 LEU 59 HB2 LEU 59 -7.146 4.280 0.546 472 HB3 LEU 59 HB1 LEU 59 -6.220 4.807 -0.837 473 HG LEU 59 HG LEU 59 -5.852 5.698 2.014 474 HD11 LEU 59 HD11 LEU 59 -4.288 3.916 0.171 475 HD12 LEU 59 HD12 LEU 59 -4.909 3.578 1.786 476 HD13 LEU 59 HD13 LEU 59 -3.559 4.691 1.578 477 HD21 LEU 59 HD21 LEU 59 -4.630 6.720 -0.525 478 HD22 LEU 59 HD22 LEU 59 -3.797 6.845 1.016 479 HD23 LEU 59 HD23 LEU 59 -5.361 7.624 0.792 480 H LYS 60 HN LYS 60 -8.477 5.793 -2.524 481 HA LYS 60 HA LYS 60 -11.204 5.253 -2.039 482 HB2 LYS 60 HB2 LYS 60 -9.483 4.338 -4.352 483 HB3 LYS 60 HB1 LYS 60 -11.237 4.480 -4.358 484 HG2 LYS 60 HG2 LYS 60 -11.035 6.903 -4.089 485 HG3 LYS 60 HG1 LYS 60 -9.275 6.754 -4.080 486 HD2 LYS 60 HD2 LYS 60 -9.397 5.757 -6.347 487 HD3 LYS 60 HD1 LYS 60 -11.135 6.069 -6.355 488 HE2 LYS 60 HE2 LYS 60 -9.979 7.835 -7.535 489 HE3 LYS 60 HE1 LYS 60 -10.677 8.469 -6.047 490 HZ1 LYS 60 HZ1 LYS 60 -8.463 8.220 -5.008 491 HZ2 LYS 60 HZ2 LYS 60 -8.468 9.314 -6.301 492 HZ3 LYS 60 HZ3 LYS 60 -7.830 7.761 -6.510 493 HA PRO 61 HA PRO 61 -11.326 1.092 -0.461 494 HB2 PRO 61 HB2 PRO 61 -13.434 0.622 -2.501 495 HB3 PRO 61 HB1 PRO 61 -13.497 0.381 -0.757 496 HG2 PRO 61 HG2 PRO 61 -14.729 2.443 -1.979 497 HG3 PRO 61 HG1 PRO 61 -14.070 2.578 -0.343 498 HD2 PRO 61 HD2 PRO 61 -13.060 3.717 -2.888 499 HD3 PRO 61 HD1 PRO 61 -12.830 4.284 -1.223 500 H SER 62 HN SER 62 -11.449 1.614 -3.940 501 HA SER 62 HA SER 62 -10.645 -0.996 -4.691 502 HB2 SER 62 HB2 SER 62 -10.059 0.269 -6.883 503 HB3 SER 62 HB1 SER 62 -11.744 0.214 -6.366 504 HG SER 62 HG SER 62 -10.709 2.337 -7.011 505 H THR 63 HN THR 63 -8.922 1.993 -4.007 506 HA THR 63 HA THR 63 -6.344 1.171 -4.771 507 HB THR 63 HB THR 63 -6.851 3.035 -2.436 508 HG1 THR 63 HG1 THR 63 -6.967 4.625 -4.351 509 HG21 THR 63 HG21 THR 63 -4.523 2.483 -3.120 510 HG22 THR 63 HG22 THR 63 -4.914 4.191 -3.286 511 HG23 THR 63 HG23 THR 63 -4.862 3.156 -4.710 512 H LEU 64 HN LEU 64 -7.999 1.098 -1.632 513 HA LEU 64 HA LEU 64 -5.981 -0.114 -0.141 514 HB2 LEU 64 HB2 LEU 64 -8.980 -0.264 0.133 515 HB3 LEU 64 HB1 LEU 64 -7.868 -0.896 1.333 516 HG LEU 64 HG LEU 64 -7.987 1.999 0.493 517 HD11 LEU 64 HD11 LEU 64 -10.053 1.291 1.647 518 HD12 LEU 64 HD12 LEU 64 -9.093 2.411 2.607 519 HD13 LEU 64 HD13 LEU 64 -9.071 0.689 2.981 520 HD21 LEU 64 HD21 LEU 64 -5.825 1.432 1.313 521 HD22 LEU 64 HD22 LEU 64 -6.517 0.549 2.669 522 HD23 LEU 64 HD23 LEU 64 -6.682 2.302 2.582 523 H ARG 65 HN ARG 65 -8.486 -1.579 -2.151 524 HA ARG 65 HA ARG 65 -7.834 -4.241 -1.258 525 HB2 ARG 65 HB2 ARG 65 -9.836 -3.019 -3.026 526 HB3 ARG 65 HB1 ARG 65 -9.341 -4.626 -3.489 527 HG2 ARG 65 HG2 ARG 65 -10.474 -3.814 -0.829 528 HG3 ARG 65 HG1 ARG 65 -11.343 -4.708 -2.086 529 HD2 ARG 65 HD2 ARG 65 -9.526 -6.487 -1.807 530 HD3 ARG 65 HD1 ARG 65 -9.070 -5.628 -0.335 531 HE ARG 65 HE ARG 65 -11.812 -6.031 -0.225 532 HH11 ARG 65 HH11 ARG 65 -8.875 -7.945 -0.123 533 HH12 ARG 65 HH12 ARG 65 -9.654 -9.307 0.620 534 HH21 ARG 65 HH21 ARG 65 -12.812 -7.802 0.780 535 HH22 ARG 65 HH22 ARG 65 -11.880 -9.219 1.155 536 H GLU 66 HN GLU 66 -6.617 -2.100 -3.608 537 HA GLU 66 HA GLU 66 -5.393 -4.192 -5.185 538 HB2 GLU 66 HB2 GLU 66 -6.048 -2.189 -6.339 539 HB3 GLU 66 HB1 GLU 66 -5.179 -1.177 -5.196 540 HG2 GLU 66 HG2 GLU 66 -3.870 -1.203 -7.122 541 HG3 GLU 66 HG1 GLU 66 -3.071 -2.317 -6.016 542 H LEU 67 HN LEU 67 -4.556 -1.881 -2.674 543 HA LEU 67 HA LEU 67 -1.774 -2.390 -2.626 544 HB2 LEU 67 HB2 LEU 67 -3.576 -1.474 -0.376 545 HB3 LEU 67 HB1 LEU 67 -1.841 -1.226 -0.466 546 HG LEU 67 HG LEU 67 -3.923 0.034 -2.260 547 HD11 LEU 67 HD11 LEU 67 -2.129 1.307 -0.200 548 HD12 LEU 67 HD12 LEU 67 -3.820 0.885 0.072 549 HD13 LEU 67 HD13 LEU 67 -3.396 2.085 -1.149 550 HD21 LEU 67 HD21 LEU 67 -1.710 -0.493 -3.330 551 HD22 LEU 67 HD22 LEU 67 -0.988 0.634 -2.182 552 HD23 LEU 67 HD23 LEU 67 -2.191 1.202 -3.335 553 H GLU 68 HN GLU 68 -4.502 -3.482 -0.668 554 HA GLU 68 HA GLU 68 -3.084 -5.219 1.035 555 HB2 GLU 68 HB2 GLU 68 -5.316 -4.380 1.557 556 HB3 GLU 68 HB1 GLU 68 -5.993 -5.269 0.201 557 HG2 GLU 68 HG2 GLU 68 -4.703 -7.220 1.602 558 HG3 GLU 68 HG1 GLU 68 -5.298 -6.164 2.876 559 H ARG 69 HN ARG 69 -5.138 -5.994 -1.804 560 HA ARG 69 HA ARG 69 -4.677 -8.741 -1.851 561 HB2 ARG 69 HB2 ARG 69 -6.364 -7.589 -3.230 562 HB3 ARG 69 HB1 ARG 69 -5.074 -6.968 -4.254 563 HG2 ARG 69 HG2 ARG 69 -4.424 -9.392 -4.618 564 HG3 ARG 69 HG1 ARG 69 -5.988 -9.796 -3.915 565 HD2 ARG 69 HD2 ARG 69 -5.948 -9.645 -6.425 566 HD3 ARG 69 HD1 ARG 69 -7.180 -8.693 -5.603 567 HE ARG 69 HE ARG 69 -4.797 -7.195 -6.155 568 HH11 ARG 69 HH11 ARG 69 -7.792 -8.391 -7.481 569 HH12 ARG 69 HH12 ARG 69 -7.965 -7.105 -8.641 570 HH21 ARG 69 HH21 ARG 69 -5.005 -5.456 -7.664 571 HH22 ARG 69 HH22 ARG 69 -6.382 -5.433 -8.729 572 H TYR 70 HN TYR 70 -2.671 -6.160 -3.069 573 HA TYR 70 HA TYR 70 -0.967 -7.902 -4.575 574 HB2 TYR 70 HB2 TYR 70 -1.058 -5.678 -5.370 575 HB3 TYR 70 HB1 TYR 70 -0.782 -5.006 -3.765 576 HD1 TYR 70 HD2 TYR 70 0.863 -6.875 -6.523 577 HD2 TYR 70 HD1 TYR 70 1.366 -4.561 -2.993 578 HE1 TYR 70 HE2 TYR 70 3.278 -6.773 -6.950 579 HE2 TYR 70 HE1 TYR 70 3.788 -4.448 -3.407 580 HH TYR 70 HH TYR 70 5.189 -5.366 -6.375 581 H VAL 71 HN VAL 71 -0.665 -6.244 -1.428 582 HA VAL 71 HA VAL 71 1.979 -7.182 -0.977 583 HB VAL 71 HB VAL 71 1.694 -6.464 1.323 584 HG11 VAL 71 HG11 VAL 71 0.450 -4.153 0.447 585 HG12 VAL 71 HG12 VAL 71 1.198 -4.828 -0.993 586 HG13 VAL 71 HG13 VAL 71 2.174 -4.487 0.437 587 HG21 VAL 71 HG21 VAL 71 -0.398 -7.043 2.040 588 HG22 VAL 71 HG22 VAL 71 -1.186 -6.431 0.584 589 HG23 VAL 71 HG23 VAL 71 -0.583 -5.305 1.802 590 H THR 72 HN THR 72 -1.194 -8.379 0.041 591 HA THR 72 HA THR 72 -0.281 -10.421 1.717 592 HB THR 72 HB THR 72 -2.668 -9.551 1.474 593 HG1 THR 72 HG1 THR 72 -2.608 -11.218 2.828 594 HG21 THR 72 HG21 THR 72 -2.785 -9.936 -0.981 595 HG22 THR 72 HG22 THR 72 -4.128 -10.635 -0.077 596 HG23 THR 72 HG23 THR 72 -2.826 -11.669 -0.663 597 H SER 73 HN SER 73 -0.476 -10.226 -1.754 598 HA SER 73 HA SER 73 -0.093 -12.968 -2.320 599 HB2 SER 73 HB2 SER 73 0.194 -12.325 -4.539 600 HB3 SER 73 HB1 SER 73 -0.720 -10.960 -3.898 601 HG SER 73 HG SER 73 1.051 -9.721 -3.911 602 H CYS 74 HN CYS 74 2.027 -10.413 -1.333 603 HA CYS 74 HA CYS 74 4.429 -11.879 -2.043 604 HB2 CYS 74 HB2 CYS 74 4.369 -9.470 -2.437 605 HB3 CYS 74 HB1 CYS 74 4.063 -9.174 -0.726 606 HG CYS 74 HG CYS 74 6.550 -9.884 0.152 607 H LEU 75 HN LEU 75 2.958 -10.546 0.912 608 HA LEU 75 HA LEU 75 4.705 -11.524 2.806 609 HB2 LEU 75 HB2 LEU 75 1.761 -11.574 3.329 610 HB3 LEU 75 HB1 LEU 75 3.062 -11.086 4.391 611 HG LEU 75 HG LEU 75 2.234 -9.495 1.985 612 HD11 LEU 75 HD11 LEU 75 1.548 -8.821 4.805 613 HD12 LEU 75 HD12 LEU 75 0.493 -9.851 3.843 614 HD13 LEU 75 HD13 LEU 75 0.849 -8.214 3.305 615 HD21 LEU 75 HD21 LEU 75 4.524 -9.200 2.860 616 HD22 LEU 75 HD22 LEU 75 3.838 -8.752 4.422 617 HD23 LEU 75 HD23 LEU 75 3.528 -7.753 3.000 618 H ARG 76 HN ARG 76 2.099 -13.203 1.145 619 HA ARG 76 HA ARG 76 2.471 -15.560 2.834 620 HB2 ARG 76 HB2 ARG 76 0.359 -14.799 0.831 621 HB3 ARG 76 HB1 ARG 76 0.423 -16.375 1.610 622 HG2 ARG 76 HG2 ARG 76 -0.124 -15.520 3.679 623 HG3 ARG 76 HG1 ARG 76 0.438 -13.897 3.268 624 HD2 ARG 76 HD2 ARG 76 -2.006 -14.044 3.406 625 HD3 ARG 76 HD1 ARG 76 -1.438 -13.566 1.811 626 HE ARG 76 HE ARG 76 -1.896 -16.387 2.036 627 HH11 ARG 76 HH11 ARG 76 -3.392 -13.278 1.454 628 HH12 ARG 76 HH12 ARG 76 -4.715 -13.939 0.542 629 HH21 ARG 76 HH21 ARG 76 -3.628 -17.269 0.836 630 HH22 ARG 76 HH22 ARG 76 -4.853 -16.218 0.195 631 H LYS 77 HN LYS 77 4.249 -14.572 0.526 632 HA LYS 77 HA LYS 77 4.567 -17.244 -0.636 633 HB2 LYS 77 HB2 LYS 77 4.320 -14.663 -2.119 634 HB3 LYS 77 HB1 LYS 77 5.379 -15.916 -2.754 635 HG2 LYS 77 HG2 LYS 77 3.558 -17.462 -2.908 636 HG3 LYS 77 HG1 LYS 77 2.480 -16.337 -2.087 637 HD2 LYS 77 HD2 LYS 77 2.725 -14.759 -3.964 638 HD3 LYS 77 HD1 LYS 77 3.783 -15.911 -4.779 639 HE2 LYS 77 HE2 LYS 77 1.964 -17.526 -4.888 640 HE3 LYS 77 HE1 LYS 77 0.906 -16.411 -4.025 641 HZ1 LYS 77 HZ1 LYS 77 0.477 -16.319 -6.380 642 HZ2 LYS 77 HZ2 LYS 77 2.098 -15.974 -6.710 643 HZ3 LYS 77 HZ3 LYS 77 1.147 -14.849 -5.881 644 H LYS 78 HN LYS 78 6.796 -17.340 -1.777 645 HA LYS 78 HA LYS 78 8.738 -15.921 -0.110 646 HB2 LYS 78 HB2 LYS 78 8.761 -18.670 -1.275 647 HB3 LYS 78 HB1 LYS 78 10.290 -17.836 -1.031 648 HG2 LYS 78 HG2 LYS 78 9.868 -19.227 0.864 649 HG3 LYS 78 HG1 LYS 78 9.687 -17.545 1.360 650 HD2 LYS 78 HD2 LYS 78 7.828 -18.445 2.332 651 HD3 LYS 78 HD1 LYS 78 7.169 -17.991 0.759 652 HE2 LYS 78 HE2 LYS 78 8.164 -20.737 1.534 653 HE3 LYS 78 HE1 LYS 78 6.475 -20.250 1.448 654 HZ1 LYS 78 HZ1 LYS 78 8.383 -20.383 -0.823 655 HZ2 LYS 78 HZ2 LYS 78 6.794 -19.824 -0.933 656 HZ3 LYS 78 HZ3 LYS 78 7.094 -21.437 -0.533 657 H ARG 79 HN ARG 79 8.563 -14.116 -1.597 658 HA ARG 79 HA ARG 79 10.433 -14.457 -3.798 659 HB2 ARG 79 HB2 ARG 79 7.888 -14.601 -4.485 660 HB3 ARG 79 HB1 ARG 79 7.991 -12.850 -4.389 661 HG2 ARG 79 HG2 ARG 79 9.775 -14.592 -6.084 662 HG3 ARG 79 HG1 ARG 79 8.347 -13.742 -6.668 663 HD2 ARG 79 HD2 ARG 79 9.354 -11.611 -6.119 664 HD3 ARG 79 HD1 ARG 79 10.750 -12.424 -5.415 665 HE ARG 79 HE ARG 79 10.477 -13.268 -8.074 666 HH11 ARG 79 HH11 ARG 79 11.245 -10.380 -6.261 667 HH12 ARG 79 HH12 ARG 79 12.262 -9.710 -7.493 668 HH21 ARG 79 HH21 ARG 79 11.827 -12.407 -9.707 669 HH22 ARG 79 HH22 ARG 79 12.606 -10.879 -9.455 670 H LYS 80 HN LYS 80 11.657 -13.400 -2.103 671 HA LYS 80 HA LYS 80 11.568 -10.513 -2.416 672 HB2 LYS 80 HB2 LYS 80 11.911 -10.257 0.094 673 HB3 LYS 80 HB1 LYS 80 10.284 -10.659 -0.440 674 HG2 LYS 80 HG2 LYS 80 10.639 -12.981 0.169 675 HG3 LYS 80 HG1 LYS 80 12.297 -12.617 0.653 676 HD2 LYS 80 HD2 LYS 80 11.513 -11.174 2.416 677 HD3 LYS 80 HD1 LYS 80 9.844 -11.360 1.876 678 HE2 LYS 80 HE2 LYS 80 11.601 -13.581 2.911 679 HE3 LYS 80 HE1 LYS 80 10.363 -12.744 3.846 680 HZ1 LYS 80 HZ1 LYS 80 9.510 -14.810 3.001 681 HZ2 LYS 80 HZ2 LYS 80 9.918 -14.389 1.416 682 HZ3 LYS 80 HZ3 LYS 80 8.712 -13.529 2.235 683 HA PRO 81 HA PRO 81 15.841 -12.419 -2.188 684 HB2 PRO 81 HB2 PRO 81 16.612 -12.210 -4.736 685 HB3 PRO 81 HB1 PRO 81 15.583 -13.546 -4.196 686 HG2 PRO 81 HG2 PRO 81 14.817 -11.023 -5.615 687 HG3 PRO 81 HG1 PRO 81 14.268 -12.682 -5.914 688 HD2 PRO 81 HD2 PRO 81 12.848 -10.827 -4.466 689 HD3 PRO 81 HD1 PRO 81 12.691 -12.585 -4.254 690 H GLN 82 HN GLN 82 14.463 -9.458 -2.879 691 HA GLN 82 HA GLN 82 17.052 -8.115 -2.616 692 HB2 GLN 82 HB2 GLN 82 16.572 -8.078 -4.987 693 HB3 GLN 82 HB1 GLN 82 14.949 -7.478 -4.690 694 HG2 GLN 82 HG2 GLN 82 15.776 -5.366 -3.977 695 HG3 GLN 82 HG1 GLN 82 17.438 -5.958 -3.968 696 HE21 GLN 82 HE21 GLN 82 18.053 -4.298 -5.376 697 HE22 GLN 82 HE22 GLN 82 17.675 -4.357 -7.064 698 H ALA 83 HN ALA 83 16.888 -7.111 -0.742 699 HA ALA 83 HA ALA 83 14.496 -5.490 -0.216 700 HB1 ALA 83 HB1 ALA 83 15.863 -7.205 1.854 701 HB2 ALA 83 HB2 ALA 83 14.358 -7.626 1.041 702 HB3 ALA 83 HB3 ALA 83 14.429 -6.205 2.084 703 H1 GLU 201 HT1 GLU 201 -6.786 7.292 12.948 704 H2 GLU 201 HT2 GLU 201 -6.996 8.954 13.157 705 H3 GLU 201 HT3 GLU 201 -5.542 8.223 13.610 706 HA GLU 201 HA GLU 201 -6.562 8.294 10.844 707 HB2 GLU 201 HB2 GLU 201 -4.774 10.005 10.471 708 HB3 GLU 201 HB1 GLU 201 -6.109 10.562 11.467 709 HG2 GLU 201 HG2 GLU 201 -4.719 10.084 13.474 710 HG3 GLU 201 HG1 GLU 201 -3.373 9.738 12.389 711 H ILE 202 HN ILE 202 -5.206 7.382 9.340 712 HA ILE 202 HA ILE 202 -2.885 5.927 10.426 713 HB ILE 202 HB ILE 202 -4.847 4.963 8.338 714 HG12 ILE 202 HG12 ILE 202 -5.686 4.750 10.629 715 HG13 ILE 202 HG11 ILE 202 -5.337 3.168 9.940 716 HG21 ILE 202 HG21 ILE 202 -2.594 4.289 7.735 717 HG22 ILE 202 HG22 ILE 202 -3.522 2.895 8.289 718 HG23 ILE 202 HG23 ILE 202 -2.334 3.642 9.355 719 HD11 ILE 202 HD11 ILE 202 -3.192 3.158 11.167 720 HD12 ILE 202 HD12 ILE 202 -4.604 3.229 12.220 721 HD13 ILE 202 HD13 ILE 202 -3.654 4.685 11.920 722 H LYS 203 HN LYS 203 -1.082 6.716 9.606 723 HA LYS 203 HA LYS 203 -1.081 7.737 6.840 724 HB2 LYS 203 HB2 LYS 203 0.485 8.799 9.202 725 HB3 LYS 203 HB1 LYS 203 0.584 9.401 7.554 726 HG2 LYS 203 HG2 LYS 203 -1.682 10.188 7.652 727 HG3 LYS 203 HG1 LYS 203 -1.913 9.448 9.234 728 HD2 LYS 203 HD2 LYS 203 -1.543 11.841 9.444 729 HD3 LYS 203 HD1 LYS 203 -0.207 10.943 10.166 730 HE2 LYS 203 HE2 LYS 203 1.145 11.326 8.184 731 HE3 LYS 203 HE1 LYS 203 -0.199 12.162 7.406 732 HZ1 LYS 203 HZ1 LYS 203 1.361 13.735 8.330 733 HZ2 LYS 203 HZ2 LYS 203 1.213 13.041 9.864 734 HZ3 LYS 203 HZ3 LYS 203 -0.107 13.832 9.165 735 H LEU 204 HN LEU 204 0.288 6.671 5.542 736 HA LEU 204 HA LEU 204 2.416 5.093 6.822 737 HB2 LEU 204 HB2 LEU 204 0.486 4.213 5.101 738 HB3 LEU 204 HB1 LEU 204 1.806 4.548 4.000 739 HG LEU 204 HG LEU 204 1.749 2.577 6.275 740 HD11 LEU 204 HD11 LEU 204 2.444 2.179 3.379 741 HD12 LEU 204 HD12 LEU 204 0.835 1.930 4.051 742 HD13 LEU 204 HD13 LEU 204 2.185 0.943 4.607 743 HD21 LEU 204 HD21 LEU 204 4.170 3.358 4.658 744 HD22 LEU 204 HD22 LEU 204 4.084 2.092 5.882 745 HD23 LEU 204 HD23 LEU 204 3.894 3.782 6.347 746 H LYS 205 HN LYS 205 4.109 6.465 6.871 747 HA LYS 205 HA LYS 205 4.977 7.820 4.455 748 HB2 LYS 205 HB2 LYS 205 6.067 7.634 7.259 749 HB3 LYS 205 HB1 LYS 205 7.009 8.332 5.952 750 HG2 LYS 205 HG2 LYS 205 4.310 9.311 6.837 751 HG3 LYS 205 HG1 LYS 205 5.857 10.010 7.321 752 HD2 LYS 205 HD2 LYS 205 6.305 10.248 4.808 753 HD3 LYS 205 HD1 LYS 205 4.574 9.964 4.610 754 HE2 LYS 205 HE2 LYS 205 5.917 12.182 6.129 755 HE3 LYS 205 HE1 LYS 205 4.935 12.319 4.673 756 HZ1 LYS 205 HZ1 LYS 205 3.009 11.542 5.953 757 HZ2 LYS 205 HZ2 LYS 205 3.666 12.965 6.604 758 HZ3 LYS 205 HZ3 LYS 205 3.964 11.482 7.355 759 H ILE 206 HN ILE 206 5.222 5.841 3.154 760 HA ILE 206 HA ILE 206 7.100 3.877 4.047 761 HB ILE 206 HB ILE 206 6.637 4.128 1.112 762 HG12 ILE 206 HG12 ILE 206 4.581 2.837 2.889 763 HG13 ILE 206 HG11 ILE 206 4.344 4.443 2.193 764 HG21 ILE 206 HG21 ILE 206 6.190 1.552 2.246 765 HG22 ILE 206 HG22 ILE 206 7.639 2.266 2.981 766 HG23 ILE 206 HG23 ILE 206 7.528 2.110 1.228 767 HD11 ILE 206 HD11 ILE 206 5.028 2.896 0.019 768 HD12 ILE 206 HD12 ILE 206 3.387 3.329 0.503 769 HD13 ILE 206 HD13 ILE 206 4.078 1.793 1.016 770 H THR 207 HN THR 207 9.101 4.604 4.440 771 HA THR 207 HA THR 207 10.455 6.294 2.511 772 HB THR 207 HB THR 207 12.410 5.887 4.180 773 HG1 THR 207 HG1 THR 207 11.925 4.880 6.003 774 HG21 THR 207 HG21 THR 207 9.923 7.393 5.005 775 HG22 THR 207 HG22 THR 207 11.229 8.008 3.993 776 HG23 THR 207 HG23 THR 207 11.532 7.631 5.688 777 H LYS 208 HN LYS 208 11.301 5.376 0.767 778 HA LYS 208 HA LYS 208 12.913 3.040 0.912 779 HB2 LYS 208 HB2 LYS 208 11.613 1.519 -0.386 780 HB3 LYS 208 HB1 LYS 208 10.582 2.083 0.916 781 HG2 LYS 208 HG2 LYS 208 10.508 3.298 -1.822 782 HG3 LYS 208 HG1 LYS 208 9.552 1.887 -1.395 783 HD2 LYS 208 HD2 LYS 208 8.047 3.130 -0.324 784 HD3 LYS 208 HD1 LYS 208 9.293 4.020 0.552 785 HE2 LYS 208 HE2 LYS 208 8.482 4.549 -2.296 786 HE3 LYS 208 HE1 LYS 208 7.885 5.444 -0.902 787 HZ1 LYS 208 HZ1 LYS 208 9.735 6.539 -2.060 788 HZ2 LYS 208 HZ2 LYS 208 10.745 5.242 -1.674 789 HZ3 LYS 208 HZ3 LYS 208 10.090 6.204 -0.440 790 H THR 209 HN THR 209 12.472 2.338 -1.887 791 HA THR 209 HA THR 209 13.321 2.793 -3.909 792 HB THR 209 HB THR 209 12.822 5.077 -4.896 793 HG1 THR 209 HG1 THR 209 12.569 6.465 -3.246 794 HG21 THR 209 HG21 THR 209 10.513 3.515 -3.716 795 HG22 THR 209 HG22 THR 209 11.353 3.157 -5.227 796 HG23 THR 209 HG23 THR 209 10.419 4.643 -5.070 797 H ILE 210 HN ILE 210 15.372 2.470 -2.732 798 HA ILE 210 HA ILE 210 17.098 4.843 -3.043 799 HB ILE 210 HB ILE 210 18.581 3.845 -1.322 800 HG12 ILE 210 HG12 ILE 210 16.277 1.931 -0.888 801 HG13 ILE 210 HG11 ILE 210 17.840 1.504 -1.575 802 HG21 ILE 210 HG21 ILE 210 17.159 4.400 0.614 803 HG22 ILE 210 HG22 ILE 210 15.753 4.407 -0.450 804 HG23 ILE 210 HG23 ILE 210 17.041 5.588 -0.684 805 HD11 ILE 210 HD11 ILE 210 18.926 2.055 0.525 806 HD12 ILE 210 HD12 ILE 210 17.659 0.851 0.765 807 HD13 ILE 210 HD13 ILE 210 17.375 2.533 1.214 808 H GLN 211 HN GLN 211 16.317 2.454 -4.831 809 HA GLN 211 HA GLN 211 19.042 1.415 -5.271 810 HB2 GLN 211 HB2 GLN 211 16.438 -0.032 -5.781 811 HB3 GLN 211 HB1 GLN 211 18.053 -0.680 -6.033 812 HG2 GLN 211 HG2 GLN 211 18.493 -0.509 -3.633 813 HG3 GLN 211 HG1 GLN 211 16.867 0.126 -3.385 814 HE21 GLN 211 HE21 GLN 211 15.098 -1.246 -3.643 815 HE22 GLN 211 HE22 GLN 211 15.271 -2.966 -3.609 816 H ASN 212 HN ASN 212 17.271 3.658 -6.492 817 HA ASN 212 HA ASN 212 18.034 3.068 -9.243 818 HB2 ASN 212 HB2 ASN 212 15.724 2.324 -9.184 819 HB3 ASN 212 HB1 ASN 212 15.220 3.834 -8.438 820 HD21 ASN 212 HD21 ASN 212 14.912 5.622 -9.690 821 HD22 ASN 212 HD22 ASN 212 14.990 5.604 -11.418 Start of MODEL 5 1 H1 SER 1 HT1 SER 1 -14.011 -6.870 -12.733 2 H2 SER 1 HT2 SER 1 -14.679 -6.106 -14.088 3 H3 SER 1 HT3 SER 1 -14.480 -7.783 -14.079 4 HA SER 1 HA SER 1 -16.770 -7.129 -13.763 5 HB2 SER 1 HB2 SER 1 -15.284 -8.555 -11.542 6 HB3 SER 1 HB1 SER 1 -17.047 -8.472 -11.531 7 HG SER 1 HG SER 1 -15.485 -10.156 -12.855 8 H GLU 2 HN GLU 2 -17.868 -6.965 -11.082 9 HA GLU 2 HA GLU 2 -17.776 -4.070 -10.974 10 HB2 GLU 2 HB2 GLU 2 -19.741 -4.321 -9.437 11 HB3 GLU 2 HB1 GLU 2 -19.970 -4.965 -11.053 12 HG2 GLU 2 HG2 GLU 2 -19.186 -6.699 -8.733 13 HG3 GLU 2 HG1 GLU 2 -20.866 -6.330 -9.110 14 H GLU 3 HN GLU 3 -17.105 -6.772 -8.763 15 HA GLU 3 HA GLU 3 -17.031 -5.113 -6.457 16 HB2 GLU 3 HB2 GLU 3 -16.162 -7.948 -6.937 17 HB3 GLU 3 HB1 GLU 3 -15.931 -7.155 -5.388 18 HG2 GLU 3 HG2 GLU 3 -18.556 -7.664 -6.773 19 HG3 GLU 3 HG1 GLU 3 -17.937 -8.473 -5.337 20 H GLU 4 HN GLU 4 -14.742 -5.528 -8.901 21 HA GLU 4 HA GLU 4 -12.460 -5.048 -7.185 22 HB2 GLU 4 HB2 GLU 4 -11.147 -4.903 -9.270 23 HB3 GLU 4 HB1 GLU 4 -12.118 -6.369 -9.211 24 HG2 GLU 4 HG2 GLU 4 -13.774 -5.335 -10.683 25 HG3 GLU 4 HG1 GLU 4 -12.792 -3.872 -10.752 26 H ASP 5 HN ASP 5 -14.544 -3.179 -9.332 27 HA ASP 5 HA ASP 5 -13.046 -0.746 -8.758 28 HB2 ASP 5 HB2 ASP 5 -13.717 -0.798 -11.013 29 HB3 ASP 5 HB1 ASP 5 -15.335 -1.369 -10.639 30 H LYS 6 HN LYS 6 -15.838 -2.437 -7.659 31 HA LYS 6 HA LYS 6 -16.805 -0.025 -6.280 32 HB2 LYS 6 HB2 LYS 6 -18.245 -1.202 -8.069 33 HB3 LYS 6 HB1 LYS 6 -18.487 -2.449 -6.858 34 HG2 LYS 6 HG2 LYS 6 -20.344 -1.003 -6.717 35 HG3 LYS 6 HG1 LYS 6 -19.325 -0.626 -5.326 36 HD2 LYS 6 HD2 LYS 6 -20.108 1.429 -6.327 37 HD3 LYS 6 HD1 LYS 6 -18.369 1.275 -6.586 38 HE2 LYS 6 HE2 LYS 6 -18.727 0.547 -8.859 39 HE3 LYS 6 HE1 LYS 6 -20.472 0.533 -8.616 40 HZ1 LYS 6 HZ1 LYS 6 -19.642 2.520 -9.791 41 HZ2 LYS 6 HZ2 LYS 6 -18.784 2.964 -8.405 42 HZ3 LYS 6 HZ3 LYS 6 -20.471 2.892 -8.367 43 H CYS 7 HN CYS 7 -14.730 -1.828 -5.402 44 HA CYS 7 HA CYS 7 -15.646 -3.744 -3.553 45 HB2 CYS 7 HB2 CYS 7 -13.300 -3.579 -4.420 46 HB3 CYS 7 HB1 CYS 7 -13.062 -2.180 -3.376 47 HG CYS 7 HG CYS 7 -13.630 -5.397 -2.377 48 H LYS 8 HN LYS 8 -15.704 -3.667 -1.273 49 HA LYS 8 HA LYS 8 -16.814 -1.163 -0.348 50 HB2 LYS 8 HB2 LYS 8 -16.826 -3.963 0.756 51 HB3 LYS 8 HB1 LYS 8 -17.390 -2.588 1.690 52 HG2 LYS 8 HG2 LYS 8 -19.277 -3.647 0.684 53 HG3 LYS 8 HG1 LYS 8 -19.014 -2.085 -0.092 54 HD2 LYS 8 HD2 LYS 8 -17.728 -3.326 -1.872 55 HD3 LYS 8 HD1 LYS 8 -18.331 -4.822 -1.154 56 HE2 LYS 8 HE2 LYS 8 -19.800 -4.351 -2.922 57 HE3 LYS 8 HE1 LYS 8 -20.658 -3.845 -1.469 58 HZ1 LYS 8 HZ1 LYS 8 -19.172 -2.050 -3.311 59 HZ2 LYS 8 HZ2 LYS 8 -20.012 -1.564 -1.927 60 HZ3 LYS 8 HZ3 LYS 8 -20.855 -2.212 -3.241 61 HA PRO 9 HA PRO 9 -13.289 0.260 1.870 62 HB2 PRO 9 HB2 PRO 9 -15.146 0.961 4.047 63 HB3 PRO 9 HB1 PRO 9 -14.042 1.986 3.125 64 HG2 PRO 9 HG2 PRO 9 -16.717 2.046 2.747 65 HG3 PRO 9 HG1 PRO 9 -15.557 2.359 1.445 66 HD2 PRO 9 HD2 PRO 9 -17.239 -0.038 1.948 67 HD3 PRO 9 HD1 PRO 9 -16.628 0.623 0.421 68 H MET 10 HN MET 10 -11.909 -0.995 2.940 69 HA MET 10 HA MET 10 -12.765 -3.046 4.734 70 HB2 MET 10 HB2 MET 10 -10.364 -3.421 5.118 71 HB3 MET 10 HB1 MET 10 -10.743 -3.346 3.407 72 HG2 MET 10 HG2 MET 10 -9.910 -1.087 3.286 73 HG3 MET 10 HG1 MET 10 -9.591 -1.099 5.017 74 HE1 MET 10 HE1 MET 10 -8.752 -2.872 1.612 75 HE2 MET 10 HE2 MET 10 -9.014 -4.229 2.705 76 HE3 MET 10 HE3 MET 10 -7.400 -3.903 2.079 77 H SER 11 HN SER 11 -12.282 -3.167 6.961 78 HA SER 11 HA SER 11 -13.073 -0.852 8.354 79 HB2 SER 11 HB2 SER 11 -12.685 -2.249 10.392 80 HB3 SER 11 HB1 SER 11 -13.688 -3.031 9.174 81 HG SER 11 HG SER 11 -11.795 -4.169 8.478 82 H TYR 12 HN TYR 12 -11.922 0.014 10.306 83 HA TYR 12 HA TYR 12 -9.476 1.218 9.657 84 HB2 TYR 12 HB2 TYR 12 -11.057 2.055 11.371 85 HB3 TYR 12 HB1 TYR 12 -10.635 0.696 12.412 86 HD1 TYR 12 HD1 TYR 12 -8.159 0.511 13.105 87 HD2 TYR 12 HD2 TYR 12 -9.889 4.055 11.537 88 HE1 TYR 12 HE1 TYR 12 -6.356 1.832 14.135 89 HE2 TYR 12 HE2 TYR 12 -8.090 5.391 12.546 90 HH TYR 12 HH TYR 12 -6.478 5.252 14.335 91 H GLU 13 HN GLU 13 -10.192 -1.696 11.473 92 HA GLU 13 HA GLU 13 -7.669 -2.372 12.424 93 HB2 GLU 13 HB2 GLU 13 -9.806 -3.534 12.977 94 HB3 GLU 13 HB1 GLU 13 -9.800 -4.254 11.375 95 HG2 GLU 13 HG2 GLU 13 -7.693 -5.393 11.915 96 HG3 GLU 13 HG1 GLU 13 -7.768 -4.714 13.542 97 H GLU 14 HN GLU 14 -9.106 -2.842 9.260 98 HA GLU 14 HA GLU 14 -6.952 -4.522 8.323 99 HB2 GLU 14 HB2 GLU 14 -9.323 -3.301 6.905 100 HB3 GLU 14 HB1 GLU 14 -8.174 -4.396 6.148 101 HG2 GLU 14 HG2 GLU 14 -8.822 -6.193 7.557 102 HG3 GLU 14 HG1 GLU 14 -9.770 -5.118 8.589 103 H LYS 15 HN LYS 15 -8.082 -1.205 7.747 104 HA LYS 15 HA LYS 15 -6.161 -0.423 5.891 105 HB2 LYS 15 HB2 LYS 15 -7.585 1.132 8.045 106 HB3 LYS 15 HB1 LYS 15 -6.517 1.888 6.875 107 HG2 LYS 15 HG2 LYS 15 -7.934 1.385 5.073 108 HG3 LYS 15 HG1 LYS 15 -8.858 0.229 6.040 109 HD2 LYS 15 HD2 LYS 15 -10.139 1.823 6.970 110 HD3 LYS 15 HD1 LYS 15 -8.798 2.961 7.122 111 HE2 LYS 15 HE2 LYS 15 -8.959 3.440 4.722 112 HE3 LYS 15 HE1 LYS 15 -10.324 2.324 4.592 113 HZ1 LYS 15 HZ1 LYS 15 -10.257 4.764 6.305 114 HZ2 LYS 15 HZ2 LYS 15 -11.586 3.737 6.072 115 HZ3 LYS 15 HZ3 LYS 15 -11.004 4.666 4.787 116 H ARG 16 HN ARG 16 -6.044 -0.420 9.421 117 HA ARG 16 HA ARG 16 -3.468 0.659 9.738 118 HB2 ARG 16 HB2 ARG 16 -5.054 0.368 11.600 119 HB3 ARG 16 HB1 ARG 16 -4.896 -1.382 11.460 120 HG2 ARG 16 HG2 ARG 16 -2.308 -0.698 11.772 121 HG3 ARG 16 HG1 ARG 16 -3.088 0.595 12.684 122 HD2 ARG 16 HD2 ARG 16 -2.620 -1.224 14.180 123 HD3 ARG 16 HD1 ARG 16 -4.362 -1.125 13.935 124 HE ARG 16 HE ARG 16 -3.035 -2.968 12.161 125 HH11 ARG 16 HH11 ARG 16 -4.562 -2.576 15.283 126 HH12 ARG 16 HH12 ARG 16 -4.911 -4.267 15.466 127 HH21 ARG 16 HH21 ARG 16 -3.491 -5.208 12.402 128 HH22 ARG 16 HH22 ARG 16 -4.310 -5.753 13.835 129 H GLN 17 HN GLN 17 -4.562 -2.697 9.389 130 HA GLN 17 HA GLN 17 -2.006 -3.845 9.703 131 HB2 GLN 17 HB2 GLN 17 -4.241 -4.990 10.018 132 HB3 GLN 17 HB1 GLN 17 -4.346 -5.077 8.264 133 HG2 GLN 17 HG2 GLN 17 -3.536 -7.162 9.204 134 HG3 GLN 17 HG1 GLN 17 -2.311 -6.397 8.192 135 HE21 GLN 17 HE21 GLN 17 -0.643 -7.499 9.208 136 HE22 GLN 17 HE22 GLN 17 -0.122 -7.113 10.811 137 H LEU 18 HN LEU 18 -3.767 -2.620 6.990 138 HA LEU 18 HA LEU 18 -2.156 -3.707 4.928 139 HB2 LEU 18 HB2 LEU 18 -4.479 -2.275 5.049 140 HB3 LEU 18 HB1 LEU 18 -3.361 -1.044 4.503 141 HG LEU 18 HG LEU 18 -3.755 -3.682 3.091 142 HD11 LEU 18 HD11 LEU 18 -4.942 -0.994 2.465 143 HD12 LEU 18 HD12 LEU 18 -5.823 -2.381 3.101 144 HD13 LEU 18 HD13 LEU 18 -5.103 -2.453 1.491 145 HD21 LEU 18 HD21 LEU 18 -1.679 -2.796 2.448 146 HD22 LEU 18 HD22 LEU 18 -2.298 -1.151 2.410 147 HD23 LEU 18 HD23 LEU 18 -2.798 -2.313 1.183 148 H SER 19 HN SER 19 -2.036 -0.689 6.761 149 HA SER 19 HA SER 19 0.243 0.384 5.534 150 HB2 SER 19 HB2 SER 19 -0.575 0.606 8.447 151 HB3 SER 19 HB1 SER 19 0.515 1.696 7.592 152 HG SER 19 HG SER 19 -2.124 1.248 6.689 153 H LEU 20 HN LEU 20 -0.180 -2.079 7.946 154 HA LEU 20 HA LEU 20 2.596 -2.263 8.619 155 HB2 LEU 20 HB2 LEU 20 0.208 -3.964 9.265 156 HB3 LEU 20 HB1 LEU 20 1.816 -4.334 9.836 157 HG LEU 20 HG LEU 20 0.366 -1.768 10.452 158 HD11 LEU 20 HD11 LEU 20 -0.558 -3.994 11.345 159 HD12 LEU 20 HD12 LEU 20 -0.290 -2.674 12.481 160 HD13 LEU 20 HD13 LEU 20 0.870 -4.001 12.377 161 HD21 LEU 20 HD21 LEU 20 2.890 -1.775 10.480 162 HD22 LEU 20 HD22 LEU 20 2.792 -2.965 11.775 163 HD23 LEU 20 HD23 LEU 20 2.114 -1.353 12.005 164 H ASP 21 HN ASP 21 0.439 -3.874 6.362 165 HA ASP 21 HA ASP 21 2.243 -6.059 5.923 166 HB2 ASP 21 HB2 ASP 21 0.677 -6.778 4.173 167 HB3 ASP 21 HB1 ASP 21 -0.121 -6.471 5.703 168 H ILE 22 HN ILE 22 1.591 -2.997 4.315 169 HA ILE 22 HA ILE 22 3.310 -3.526 2.097 170 HB ILE 22 HB ILE 22 2.374 -0.910 3.279 171 HG12 ILE 22 HG12 ILE 22 1.520 -2.185 0.688 172 HG13 ILE 22 HG11 ILE 22 0.736 -2.604 2.215 173 HG21 ILE 22 HG21 ILE 22 4.327 -0.334 2.120 174 HG22 ILE 22 HG22 ILE 22 3.005 -0.012 0.994 175 HG23 ILE 22 HG23 ILE 22 3.981 -1.469 0.814 176 HD11 ILE 22 HD11 ILE 22 0.030 -0.385 2.520 177 HD12 ILE 22 HD12 ILE 22 -0.429 -0.868 0.895 178 HD13 ILE 22 HD13 ILE 22 0.962 0.192 1.147 179 H ASN 23 HN ASN 23 3.733 -2.165 5.286 180 HA ASN 23 HA ASN 23 6.371 -1.263 5.044 181 HB2 ASN 23 HB2 ASN 23 5.075 -0.596 6.927 182 HB3 ASN 23 HB1 ASN 23 4.745 -2.260 7.380 183 HD21 ASN 23 HD21 ASN 23 7.068 0.311 7.399 184 HD22 ASN 23 HD22 ASN 23 8.154 -0.396 8.542 185 H LYS 24 HN LYS 24 5.045 -4.434 5.159 186 HA LYS 24 HA LYS 24 7.413 -5.766 6.119 187 HB2 LYS 24 HB2 LYS 24 4.829 -6.747 4.919 188 HB3 LYS 24 HB1 LYS 24 6.137 -7.838 5.366 189 HG2 LYS 24 HG2 LYS 24 5.968 -7.107 7.679 190 HG3 LYS 24 HG1 LYS 24 4.708 -5.953 7.235 191 HD2 LYS 24 HD2 LYS 24 3.317 -7.862 6.454 192 HD3 LYS 24 HD1 LYS 24 4.557 -8.962 7.066 193 HE2 LYS 24 HE2 LYS 24 2.981 -6.969 8.694 194 HE3 LYS 24 HE1 LYS 24 2.735 -8.713 8.668 195 HZ1 LYS 24 HZ1 LYS 24 4.935 -9.012 9.589 196 HZ2 LYS 24 HZ2 LYS 24 4.021 -8.008 10.591 197 HZ3 LYS 24 HZ3 LYS 24 5.206 -7.343 9.586 198 H LEU 25 HN LEU 25 6.102 -4.841 3.035 199 HA LEU 25 HA LEU 25 7.510 -6.673 1.407 200 HB2 LEU 25 HB2 LEU 25 6.554 -3.906 0.740 201 HB3 LEU 25 HB1 LEU 25 7.008 -5.121 -0.421 202 HG LEU 25 HG LEU 25 4.596 -5.054 1.352 203 HD11 LEU 25 HD11 LEU 25 5.022 -5.297 -1.604 204 HD12 LEU 25 HD12 LEU 25 4.430 -3.882 -0.746 205 HD13 LEU 25 HD13 LEU 25 3.459 -5.352 -0.804 206 HD21 LEU 25 HD21 LEU 25 5.766 -7.358 -0.133 207 HD22 LEU 25 HD22 LEU 25 4.081 -7.299 0.368 208 HD23 LEU 25 HD23 LEU 25 5.369 -7.279 1.577 209 HA PRO 26 HA PRO 26 11.712 -5.006 1.589 210 HB2 PRO 26 HB2 PRO 26 11.817 -6.515 -0.982 211 HB3 PRO 26 HB1 PRO 26 12.925 -6.564 0.399 212 HG2 PRO 26 HG2 PRO 26 11.218 -8.555 -0.027 213 HG3 PRO 26 HG1 PRO 26 11.537 -7.975 1.617 214 HD2 PRO 26 HD2 PRO 26 9.174 -7.471 -0.143 215 HD3 PRO 26 HD1 PRO 26 9.237 -7.760 1.607 216 H GLY 27 HN GLY 27 12.906 -3.479 0.339 217 HA2 GLY 27 HA2 GLY 27 11.504 -1.364 -0.600 218 HA3 GLY 27 HA1 GLY 27 13.158 -1.682 -1.071 219 H GLU 28 HN GLU 28 12.768 -3.954 -2.687 220 HA GLU 28 HA GLU 28 12.070 -2.776 -5.138 221 HB2 GLU 28 HB2 GLU 28 13.581 -4.723 -4.891 222 HB3 GLU 28 HB1 GLU 28 12.200 -5.719 -4.455 223 HG2 GLU 28 HG2 GLU 28 12.788 -6.087 -6.757 224 HG3 GLU 28 HG1 GLU 28 11.218 -5.296 -6.661 225 H LYS 29 HN LYS 29 10.346 -5.320 -3.340 226 HA LYS 29 HA LYS 29 8.003 -5.349 -4.869 227 HB2 LYS 29 HB2 LYS 29 8.569 -6.056 -1.993 228 HB3 LYS 29 HB1 LYS 29 7.009 -6.337 -2.753 229 HG2 LYS 29 HG2 LYS 29 9.586 -7.487 -3.779 230 HG3 LYS 29 HG1 LYS 29 8.520 -8.316 -2.645 231 HD2 LYS 29 HD2 LYS 29 6.678 -8.029 -4.334 232 HD3 LYS 29 HD1 LYS 29 7.911 -7.489 -5.473 233 HE2 LYS 29 HE2 LYS 29 7.405 -9.866 -5.754 234 HE3 LYS 29 HE1 LYS 29 9.073 -9.612 -5.255 235 HZ1 LYS 29 HZ1 LYS 29 8.238 -10.042 -2.922 236 HZ2 LYS 29 HZ2 LYS 29 8.299 -11.372 -3.954 237 HZ3 LYS 29 HZ3 LYS 29 6.818 -10.622 -3.632 238 H LEU 30 HN LEU 30 8.992 -3.464 -2.123 239 HA LEU 30 HA LEU 30 6.566 -2.253 -1.400 240 HB2 LEU 30 HB2 LEU 30 8.565 -2.266 -0.009 241 HB3 LEU 30 HB1 LEU 30 9.424 -1.295 -1.187 242 HG LEU 30 HG LEU 30 8.206 0.634 -0.649 243 HD11 LEU 30 HD11 LEU 30 6.372 -0.781 1.223 244 HD12 LEU 30 HD12 LEU 30 6.011 -0.782 -0.497 245 HD13 LEU 30 HD13 LEU 30 6.150 0.739 0.369 246 HD21 LEU 30 HD21 LEU 30 8.491 0.802 1.795 247 HD22 LEU 30 HD22 LEU 30 9.876 0.052 1.001 248 HD23 LEU 30 HD23 LEU 30 8.708 -0.946 1.869 249 H GLY 31 HN GLY 31 9.035 -1.237 -3.749 250 HA2 GLY 31 HA2 GLY 31 8.144 1.343 -4.259 251 HA3 GLY 31 HA1 GLY 31 8.952 0.331 -5.437 252 H ARG 32 HN ARG 32 6.784 -1.682 -5.364 253 HA ARG 32 HA ARG 32 5.150 -0.689 -7.424 254 HB2 ARG 32 HB2 ARG 32 5.527 -3.076 -7.143 255 HB3 ARG 32 HB1 ARG 32 4.738 -3.033 -5.574 256 HG2 ARG 32 HG2 ARG 32 3.198 -3.972 -7.151 257 HG3 ARG 32 HG1 ARG 32 2.633 -2.366 -6.718 258 HD2 ARG 32 HD2 ARG 32 2.397 -2.628 -9.090 259 HD3 ARG 32 HD1 ARG 32 3.705 -1.485 -8.786 260 HE ARG 32 HE ARG 32 4.967 -3.894 -8.997 261 HH11 ARG 32 HH11 ARG 32 2.789 -2.077 -11.050 262 HH12 ARG 32 HH12 ARG 32 3.428 -2.737 -12.521 263 HH21 ARG 32 HH21 ARG 32 5.783 -4.784 -10.925 264 HH22 ARG 32 HH22 ARG 32 5.123 -4.284 -12.453 265 H VAL 33 HN VAL 33 4.524 -1.087 -3.941 266 HA VAL 33 HA VAL 33 1.758 -0.370 -4.142 267 HB VAL 33 HB VAL 33 3.022 0.074 -1.522 268 HG11 VAL 33 HG11 VAL 33 0.751 -1.673 -2.469 269 HG12 VAL 33 HG12 VAL 33 0.606 0.007 -1.951 270 HG13 VAL 33 HG13 VAL 33 1.110 -1.224 -0.801 271 HG21 VAL 33 HG21 VAL 33 4.469 -1.711 -2.148 272 HG22 VAL 33 HG22 VAL 33 3.145 -2.613 -2.882 273 HG23 VAL 33 HG23 VAL 33 3.206 -2.405 -1.134 274 H VAL 34 HN VAL 34 4.613 1.396 -2.961 275 HA VAL 34 HA VAL 34 3.410 3.843 -2.442 276 HB VAL 34 HB VAL 34 5.564 4.267 -1.955 277 HG11 VAL 34 HG11 VAL 34 6.067 1.928 -2.216 278 HG12 VAL 34 HG12 VAL 34 7.424 2.929 -2.736 279 HG13 VAL 34 HG13 VAL 34 6.374 2.172 -3.934 280 HG21 VAL 34 HG21 VAL 34 5.379 5.725 -3.943 281 HG22 VAL 34 HG22 VAL 34 6.081 4.441 -4.919 282 HG23 VAL 34 HG23 VAL 34 7.028 5.192 -3.635 283 H HIS 35 HN HIS 35 4.423 2.430 -5.492 284 HA HIS 35 HA HIS 35 3.710 4.634 -7.130 285 HB2 HIS 35 HB2 HIS 35 5.265 2.798 -7.803 286 HB3 HIS 35 HB1 HIS 35 3.872 1.731 -7.930 287 HD1 HIS 35 HD1 HIS 35 5.450 4.720 -9.570 288 HD2 HIS 35 HD2 HIS 35 2.399 1.992 -10.275 289 HE1 HIS 35 HE1 HIS 35 4.704 5.136 -11.932 290 HE2 HIS 35 HE2 HIS 35 2.758 3.579 -12.283 291 H ILE 36 HN ILE 36 1.968 1.667 -6.196 292 HA ILE 36 HA ILE 36 -0.269 1.969 -7.824 293 HB ILE 36 HB ILE 36 -0.264 0.782 -5.040 294 HG12 ILE 36 HG12 ILE 36 0.203 -0.448 -7.759 295 HG13 ILE 36 HG11 ILE 36 1.324 -0.399 -6.412 296 HG21 ILE 36 HG21 ILE 36 -2.475 0.597 -5.314 297 HG22 ILE 36 HG22 ILE 36 -2.163 -0.467 -6.685 298 HG23 ILE 36 HG23 ILE 36 -2.367 1.264 -6.944 299 HD11 ILE 36 HD11 ILE 36 -0.251 -1.851 -5.142 300 HD12 ILE 36 HD12 ILE 36 0.441 -2.603 -6.578 301 HD13 ILE 36 HD13 ILE 36 -1.213 -1.993 -6.613 302 H ILE 37 HN ILE 37 0.186 3.120 -4.476 303 HA ILE 37 HA ILE 37 -2.348 4.313 -4.284 304 HB ILE 37 HB ILE 37 0.153 5.182 -2.828 305 HG12 ILE 37 HG12 ILE 37 -1.647 3.770 -1.152 306 HG13 ILE 37 HG11 ILE 37 -1.452 2.800 -2.607 307 HG21 ILE 37 HG21 ILE 37 -2.049 6.616 -3.025 308 HG22 ILE 37 HG22 ILE 37 -1.172 6.488 -1.494 309 HG23 ILE 37 HG23 ILE 37 -2.610 5.503 -1.772 310 HD11 ILE 37 HD11 ILE 37 0.910 2.691 -2.294 311 HD12 ILE 37 HD12 ILE 37 0.117 2.232 -0.784 312 HD13 ILE 37 HD13 ILE 37 0.827 3.837 -0.956 313 H GLN 38 HN GLN 38 0.796 5.814 -5.027 314 HA GLN 38 HA GLN 38 -0.152 8.401 -5.465 315 HB2 GLN 38 HB2 GLN 38 2.238 6.963 -6.615 316 HB3 GLN 38 HB1 GLN 38 1.940 8.673 -6.901 317 HG2 GLN 38 HG2 GLN 38 1.773 8.524 -4.170 318 HG3 GLN 38 HG1 GLN 38 2.977 7.293 -4.529 319 HE21 GLN 38 HE21 GLN 38 4.570 8.555 -3.523 320 HE22 GLN 38 HE22 GLN 38 5.254 9.939 -4.300 321 H SER 39 HN SER 39 -0.116 5.625 -7.585 322 HA SER 39 HA SER 39 -0.728 7.127 -9.940 323 HB2 SER 39 HB2 SER 39 0.466 4.991 -10.070 324 HB3 SER 39 HB1 SER 39 -0.952 4.155 -9.433 325 HG SER 39 HG SER 39 -0.639 5.475 -11.917 326 H ARG 40 HN ARG 40 -2.635 5.539 -7.438 327 HA ARG 40 HA ARG 40 -5.032 5.708 -9.086 328 HB2 ARG 40 HB2 ARG 40 -4.742 4.767 -6.238 329 HB3 ARG 40 HB1 ARG 40 -6.168 4.591 -7.244 330 HG2 ARG 40 HG2 ARG 40 -4.470 3.304 -8.810 331 HG3 ARG 40 HG1 ARG 40 -3.618 3.079 -7.280 332 HD2 ARG 40 HD2 ARG 40 -5.074 1.214 -7.659 333 HD3 ARG 40 HD1 ARG 40 -5.652 2.172 -6.301 334 HE ARG 40 HE ARG 40 -7.099 3.195 -8.284 335 HH11 ARG 40 HH11 ARG 40 -6.448 -0.117 -7.392 336 HH12 ARG 40 HH12 ARG 40 -7.901 -0.738 -8.098 337 HH21 ARG 40 HH21 ARG 40 -9.031 2.396 -9.213 338 HH22 ARG 40 HH22 ARG 40 -9.375 0.696 -9.136 339 H GLU 41 HN GLU 41 -3.506 7.193 -6.337 340 HA GLU 41 HA GLU 41 -5.744 9.067 -6.072 341 HB2 GLU 41 HB2 GLU 41 -3.625 8.506 -4.050 342 HB3 GLU 41 HB1 GLU 41 -5.247 9.137 -3.807 343 HG2 GLU 41 HG2 GLU 41 -5.049 6.576 -5.108 344 HG3 GLU 41 HG1 GLU 41 -4.585 6.595 -3.444 345 HA PRO 42 HA PRO 42 -2.382 11.614 -7.967 346 HB2 PRO 42 HB2 PRO 42 -4.713 13.318 -8.602 347 HB3 PRO 42 HB1 PRO 42 -3.433 12.721 -9.662 348 HG2 PRO 42 HG2 PRO 42 -5.898 11.707 -9.783 349 HG3 PRO 42 HG1 PRO 42 -4.470 10.672 -9.977 350 HD2 PRO 42 HD2 PRO 42 -6.234 11.038 -7.584 351 HD3 PRO 42 HD1 PRO 42 -5.532 9.547 -8.249 352 H SER 43 HN SER 43 -4.750 12.254 -5.548 353 HA SER 43 HA SER 43 -4.140 14.957 -4.984 354 HB2 SER 43 HB2 SER 43 -5.249 12.843 -3.124 355 HB3 SER 43 HB1 SER 43 -5.331 14.586 -2.882 356 HG SER 43 HG SER 43 -7.208 13.376 -3.882 357 H LEU 44 HN LEU 44 -2.533 12.001 -4.207 358 HA LEU 44 HA LEU 44 -0.867 13.412 -2.236 359 HB2 LEU 44 HB2 LEU 44 -0.309 11.167 -1.331 360 HB3 LEU 44 HB1 LEU 44 -1.986 11.623 -1.144 361 HG LEU 44 HG LEU 44 -2.284 10.195 -3.358 362 HD11 LEU 44 HD11 LEU 44 0.139 9.808 -3.621 363 HD12 LEU 44 HD12 LEU 44 -0.781 8.314 -3.457 364 HD13 LEU 44 HD13 LEU 44 0.143 8.935 -2.090 365 HD21 LEU 44 HD21 LEU 44 -3.364 9.763 -1.220 366 HD22 LEU 44 HD22 LEU 44 -1.889 9.003 -0.619 367 HD23 LEU 44 HD23 LEU 44 -2.782 8.266 -1.949 368 H LYS 45 HN LYS 45 -0.728 13.032 -5.278 369 HA LYS 45 HA LYS 45 1.714 11.531 -5.577 370 HB2 LYS 45 HB2 LYS 45 0.811 11.189 -7.585 371 HB3 LYS 45 HB1 LYS 45 -0.364 12.466 -7.379 372 HG2 LYS 45 HG2 LYS 45 1.226 14.087 -8.239 373 HG3 LYS 45 HG1 LYS 45 2.459 12.829 -8.384 374 HD2 LYS 45 HD2 LYS 45 1.576 13.035 -10.542 375 HD3 LYS 45 HD1 LYS 45 0.745 11.628 -9.873 376 HE2 LYS 45 HE2 LYS 45 -1.058 12.750 -10.698 377 HE3 LYS 45 HE1 LYS 45 -0.965 13.477 -9.094 378 HZ1 LYS 45 HZ1 LYS 45 0.189 14.640 -11.564 379 HZ2 LYS 45 HZ2 LYS 45 0.240 15.334 -10.023 380 HZ3 LYS 45 HZ3 LYS 45 -1.238 15.144 -10.815 381 H ASN 46 HN ASN 46 1.142 14.501 -4.339 382 HA ASN 46 HA ASN 46 3.431 15.847 -5.520 383 HB2 ASN 46 HB2 ASN 46 2.875 17.700 -4.043 384 HB3 ASN 46 HB1 ASN 46 1.414 17.146 -4.850 385 HD21 ASN 46 HD21 ASN 46 -0.198 16.154 -3.653 386 HD22 ASN 46 HD22 ASN 46 -0.223 16.192 -1.923 387 H SER 47 HN SER 47 2.858 13.544 -3.217 388 HA SER 47 HA SER 47 4.781 14.277 -1.244 389 HB2 SER 47 HB2 SER 47 3.720 11.491 -1.806 390 HB3 SER 47 HB1 SER 47 4.325 12.139 -0.278 391 HG SER 47 HG SER 47 1.846 12.406 -1.469 392 H ASN 48 HN ASN 48 6.958 13.938 -1.282 393 HA ASN 48 HA ASN 48 8.312 13.149 -3.607 394 HB2 ASN 48 HB2 ASN 48 9.300 13.113 -0.739 395 HB3 ASN 48 HB1 ASN 48 10.326 12.968 -2.159 396 HD21 ASN 48 HD21 ASN 48 10.335 14.937 -0.038 397 HD22 ASN 48 HD22 ASN 48 10.154 16.467 -0.814 398 HA PRO 49 HA PRO 49 7.493 8.866 -3.678 399 HB2 PRO 49 HB2 PRO 49 9.744 8.059 -5.086 400 HB3 PRO 49 HB1 PRO 49 8.240 8.639 -5.796 401 HG2 PRO 49 HG2 PRO 49 10.804 10.077 -5.340 402 HG3 PRO 49 HG1 PRO 49 9.633 10.251 -6.659 403 HD2 PRO 49 HD2 PRO 49 9.832 12.041 -4.645 404 HD3 PRO 49 HD1 PRO 49 8.294 11.685 -5.451 405 H ASP 50 HN ASP 50 10.482 10.045 -2.330 406 HA ASP 50 HA ASP 50 11.183 7.461 -1.246 407 HB2 ASP 50 HB2 ASP 50 13.044 8.837 -1.778 408 HB3 ASP 50 HB1 ASP 50 12.376 10.210 -0.904 409 H GLU 51 HN GLU 51 9.490 10.308 -0.198 410 HA GLU 51 HA GLU 51 9.007 9.060 2.425 411 HB2 GLU 51 HB2 GLU 51 9.776 11.886 1.746 412 HB3 GLU 51 HB1 GLU 51 8.747 11.609 3.142 413 HG2 GLU 51 HG2 GLU 51 10.463 10.164 4.111 414 HG3 GLU 51 HG1 GLU 51 11.488 10.435 2.700 415 H ILE 52 HN ILE 52 7.117 8.281 1.003 416 HA ILE 52 HA ILE 52 5.370 10.326 0.008 417 HB ILE 52 HB ILE 52 4.156 8.661 -1.084 418 HG12 ILE 52 HG12 ILE 52 5.417 6.488 0.518 419 HG13 ILE 52 HG11 ILE 52 3.936 7.279 1.064 420 HG21 ILE 52 HG21 ILE 52 6.863 7.392 -0.861 421 HG22 ILE 52 HG22 ILE 52 6.575 8.886 -1.762 422 HG23 ILE 52 HG23 ILE 52 5.769 7.394 -2.251 423 HD11 ILE 52 HD11 ILE 52 2.886 6.685 -1.085 424 HD12 ILE 52 HD12 ILE 52 3.384 5.276 -0.143 425 HD13 ILE 52 HD13 ILE 52 4.349 5.800 -1.520 426 H GLU 53 HN GLU 53 3.318 10.816 0.657 427 HA GLU 53 HA GLU 53 2.704 10.140 3.447 428 HB2 GLU 53 HB2 GLU 53 3.096 12.567 2.206 429 HB3 GLU 53 HB1 GLU 53 1.352 12.416 2.178 430 HG2 GLU 53 HG2 GLU 53 3.202 12.582 4.519 431 HG3 GLU 53 HG1 GLU 53 1.846 13.622 4.111 432 H ILE 54 HN ILE 54 1.159 8.561 3.476 433 HA ILE 54 HA ILE 54 -0.840 8.528 1.303 434 HB ILE 54 HB ILE 54 -0.109 6.344 3.256 435 HG12 ILE 54 HG12 ILE 54 0.387 6.491 0.278 436 HG13 ILE 54 HG11 ILE 54 1.606 6.870 1.495 437 HG21 ILE 54 HG21 ILE 54 -1.488 4.934 1.737 438 HG22 ILE 54 HG22 ILE 54 -2.041 6.408 0.950 439 HG23 ILE 54 HG23 ILE 54 -2.409 6.123 2.652 440 HD11 ILE 54 HD11 ILE 54 1.761 4.584 0.547 441 HD12 ILE 54 HD12 ILE 54 0.202 4.222 1.284 442 HD13 ILE 54 HD13 ILE 54 1.585 4.625 2.297 443 H ASP 55 HN ASP 55 -2.938 8.995 1.689 444 HA ASP 55 HA ASP 55 -3.702 9.512 4.449 445 HB2 ASP 55 HB2 ASP 55 -5.767 10.536 3.139 446 HB3 ASP 55 HB1 ASP 55 -4.236 11.403 3.123 447 H PHE 56 HN PHE 56 -3.826 7.234 4.915 448 HA PHE 56 HA PHE 56 -5.142 5.351 3.369 449 HB2 PHE 56 HB2 PHE 56 -3.897 5.435 5.947 450 HB3 PHE 56 HB1 PHE 56 -5.361 4.454 6.010 451 HD1 PHE 56 HD2 PHE 56 -5.600 2.502 4.587 452 HD2 PHE 56 HD1 PHE 56 -1.983 4.719 4.698 453 HE1 PHE 56 HE2 PHE 56 -4.449 0.643 3.490 454 HE2 PHE 56 HE1 PHE 56 -0.809 2.860 3.596 455 HZ PHE 56 HZ PHE 56 -2.049 0.804 2.996 456 H GLU 57 HN GLU 57 -6.548 7.701 5.442 457 HA GLU 57 HA GLU 57 -8.987 6.216 5.814 458 HB2 GLU 57 HB2 GLU 57 -8.190 9.013 6.545 459 HB3 GLU 57 HB1 GLU 57 -9.753 8.306 6.939 460 HG2 GLU 57 HG2 GLU 57 -7.106 7.182 7.819 461 HG3 GLU 57 HG1 GLU 57 -8.103 8.262 8.787 462 H THR 58 HN THR 58 -7.714 8.095 3.358 463 HA THR 58 HA THR 58 -10.411 8.638 2.331 464 HB THR 58 HB THR 58 -9.547 10.754 1.316 465 HG1 THR 58 HG1 THR 58 -7.242 10.088 1.645 466 HG21 THR 58 HG21 THR 58 -9.501 10.432 4.299 467 HG22 THR 58 HG22 THR 58 -10.886 10.877 3.297 468 HG23 THR 58 HG23 THR 58 -9.537 12.000 3.491 469 H LEU 59 HN LEU 59 -7.934 6.747 1.850 470 HA LEU 59 HA LEU 59 -7.554 6.993 -0.989 471 HB2 LEU 59 HB2 LEU 59 -7.385 4.351 0.445 472 HB3 LEU 59 HB1 LEU 59 -6.511 4.891 -0.963 473 HG LEU 59 HG LEU 59 -6.035 5.767 1.876 474 HD11 LEU 59 HD11 LEU 59 -4.534 3.976 -0.021 475 HD12 LEU 59 HD12 LEU 59 -5.135 3.623 1.599 476 HD13 LEU 59 HD13 LEU 59 -3.779 4.727 1.386 477 HD21 LEU 59 HD21 LEU 59 -4.889 6.769 -0.711 478 HD22 LEU 59 HD22 LEU 59 -4.005 6.888 0.801 479 HD23 LEU 59 HD23 LEU 59 -5.566 7.683 0.628 480 H LYS 60 HN LYS 60 -8.566 5.765 -2.607 481 HA LYS 60 HA LYS 60 -11.330 5.210 -2.257 482 HB2 LYS 60 HB2 LYS 60 -9.460 4.284 -4.449 483 HB3 LYS 60 HB1 LYS 60 -11.216 4.342 -4.547 484 HG2 LYS 60 HG2 LYS 60 -11.098 6.804 -4.299 485 HG3 LYS 60 HG1 LYS 60 -9.335 6.687 -4.332 486 HD2 LYS 60 HD2 LYS 60 -9.517 5.586 -6.556 487 HD3 LYS 60 HD1 LYS 60 -11.252 5.899 -6.524 488 HE2 LYS 60 HE2 LYS 60 -10.256 7.634 -7.804 489 HE3 LYS 60 HE1 LYS 60 -10.708 8.333 -6.251 490 HZ1 LYS 60 HZ1 LYS 60 -8.532 9.075 -6.857 491 HZ2 LYS 60 HZ2 LYS 60 -7.986 7.497 -7.091 492 HZ3 LYS 60 HZ3 LYS 60 -8.377 8.032 -5.530 493 HA PRO 61 HA PRO 61 -11.211 1.110 -0.540 494 HB2 PRO 61 HB2 PRO 61 -13.498 0.471 -2.294 495 HB3 PRO 61 HB1 PRO 61 -13.385 0.427 -0.532 496 HG2 PRO 61 HG2 PRO 61 -14.769 2.330 -1.864 497 HG3 PRO 61 HG1 PRO 61 -13.982 2.630 -0.306 498 HD2 PRO 61 HD2 PRO 61 -13.169 3.487 -3.036 499 HD3 PRO 61 HD1 PRO 61 -12.890 4.274 -1.471 500 H SER 62 HN SER 62 -11.563 1.555 -4.020 501 HA SER 62 HA SER 62 -10.686 -1.019 -4.804 502 HB2 SER 62 HB2 SER 62 -10.070 0.287 -6.963 503 HB3 SER 62 HB1 SER 62 -11.768 0.187 -6.491 504 HG SER 62 HG SER 62 -11.781 2.259 -6.006 505 H THR 63 HN THR 63 -9.000 1.977 -4.061 506 HA THR 63 HA THR 63 -6.415 1.154 -4.814 507 HB THR 63 HB THR 63 -6.898 3.032 -2.493 508 HG1 THR 63 HG1 THR 63 -7.333 4.664 -3.997 509 HG21 THR 63 HG21 THR 63 -4.586 2.419 -3.244 510 HG22 THR 63 HG22 THR 63 -4.944 4.139 -3.313 511 HG23 THR 63 HG23 THR 63 -4.943 3.177 -4.790 512 H LEU 64 HN LEU 64 -7.993 1.212 -1.610 513 HA LEU 64 HA LEU 64 -5.981 -0.007 -0.134 514 HB2 LEU 64 HB2 LEU 64 -8.977 -0.147 0.187 515 HB3 LEU 64 HB1 LEU 64 -7.858 -0.806 1.364 516 HG LEU 64 HG LEU 64 -7.943 2.104 0.572 517 HD11 LEU 64 HD11 LEU 64 -10.022 1.396 1.722 518 HD12 LEU 64 HD12 LEU 64 -9.048 2.498 2.689 519 HD13 LEU 64 HD13 LEU 64 -9.040 0.774 3.046 520 HD21 LEU 64 HD21 LEU 64 -5.791 1.475 1.385 521 HD22 LEU 64 HD22 LEU 64 -6.506 0.587 2.726 522 HD23 LEU 64 HD23 LEU 64 -6.632 2.344 2.665 523 H ARG 65 HN ARG 65 -8.598 -1.507 -1.976 524 HA ARG 65 HA ARG 65 -8.046 -4.146 -1.130 525 HB2 ARG 65 HB2 ARG 65 -10.205 -3.298 -2.150 526 HB3 ARG 65 HB1 ARG 65 -9.374 -3.282 -3.691 527 HG2 ARG 65 HG2 ARG 65 -10.872 -5.296 -3.094 528 HG3 ARG 65 HG1 ARG 65 -9.329 -5.559 -3.892 529 HD2 ARG 65 HD2 ARG 65 -8.328 -6.370 -1.907 530 HD3 ARG 65 HD1 ARG 65 -9.633 -5.777 -0.881 531 HE ARG 65 HE ARG 65 -10.383 -7.747 -2.871 532 HH11 ARG 65 HH11 ARG 65 -9.353 -7.172 0.434 533 HH12 ARG 65 HH12 ARG 65 -10.035 -8.647 1.034 534 HH21 ARG 65 HH21 ARG 65 -11.267 -9.700 -2.074 535 HH22 ARG 65 HH22 ARG 65 -11.119 -10.085 -0.388 536 H GLU 66 HN GLU 66 -6.795 -2.127 -3.690 537 HA GLU 66 HA GLU 66 -5.474 -4.228 -5.126 538 HB2 GLU 66 HB2 GLU 66 -6.113 -2.225 -6.300 539 HB3 GLU 66 HB1 GLU 66 -5.207 -1.219 -5.180 540 HG2 GLU 66 HG2 GLU 66 -4.007 -1.375 -7.232 541 HG3 GLU 66 HG1 GLU 66 -3.119 -2.265 -5.995 542 H LEU 67 HN LEU 67 -4.638 -1.920 -2.636 543 HA LEU 67 HA LEU 67 -1.850 -2.350 -2.662 544 HB2 LEU 67 HB2 LEU 67 -3.625 -1.450 -0.386 545 HB3 LEU 67 HB1 LEU 67 -1.901 -1.171 -0.515 546 HG LEU 67 HG LEU 67 -4.017 -0.002 -2.328 547 HD11 LEU 67 HD11 LEU 67 -2.269 1.401 -0.333 548 HD12 LEU 67 HD12 LEU 67 -3.916 0.885 0.016 549 HD13 LEU 67 HD13 LEU 67 -3.612 2.074 -1.252 550 HD21 LEU 67 HD21 LEU 67 -1.793 -0.480 -3.377 551 HD22 LEU 67 HD22 LEU 67 -1.094 0.664 -2.232 552 HD23 LEU 67 HD23 LEU 67 -2.299 1.206 -3.397 553 H GLU 68 HN GLU 68 -4.504 -3.570 -0.667 554 HA GLU 68 HA GLU 68 -2.946 -5.311 0.922 555 HB2 GLU 68 HB2 GLU 68 -5.146 -4.634 1.651 556 HB3 GLU 68 HB1 GLU 68 -5.895 -5.389 0.249 557 HG2 GLU 68 HG2 GLU 68 -5.154 -7.606 1.067 558 HG3 GLU 68 HG1 GLU 68 -4.396 -6.820 2.437 559 H ARG 69 HN ARG 69 -4.822 -5.854 -2.064 560 HA ARG 69 HA ARG 69 -4.612 -8.675 -2.037 561 HB2 ARG 69 HB2 ARG 69 -6.221 -7.430 -3.455 562 HB3 ARG 69 HB1 ARG 69 -4.880 -6.898 -4.465 563 HG2 ARG 69 HG2 ARG 69 -4.369 -9.400 -4.712 564 HG3 ARG 69 HG1 ARG 69 -6.016 -9.638 -4.139 565 HD2 ARG 69 HD2 ARG 69 -5.822 -9.587 -6.619 566 HD3 ARG 69 HD1 ARG 69 -6.924 -8.384 -5.956 567 HE ARG 69 HE ARG 69 -4.696 -6.949 -6.166 568 HH11 ARG 69 HH11 ARG 69 -6.144 -9.172 -8.448 569 HH12 ARG 69 HH12 ARG 69 -5.593 -8.295 -9.840 570 HH21 ARG 69 HH21 ARG 69 -3.974 -5.791 -7.989 571 HH22 ARG 69 HH22 ARG 69 -4.354 -6.389 -9.581 572 H TYR 70 HN TYR 70 -2.502 -6.170 -3.097 573 HA TYR 70 HA TYR 70 -0.827 -7.931 -4.643 574 HB2 TYR 70 HB2 TYR 70 -0.916 -5.717 -5.458 575 HB3 TYR 70 HB1 TYR 70 -0.652 -5.029 -3.857 576 HD1 TYR 70 HD2 TYR 70 0.991 -6.895 -6.605 577 HD2 TYR 70 HD1 TYR 70 1.494 -4.629 -3.046 578 HE1 TYR 70 HE2 TYR 70 3.407 -6.803 -7.020 579 HE2 TYR 70 HE1 TYR 70 3.920 -4.522 -3.449 580 HH TYR 70 HH TYR 70 5.626 -5.481 -4.656 581 H VAL 71 HN VAL 71 -0.614 -6.260 -1.508 582 HA VAL 71 HA VAL 71 2.015 -7.179 -0.979 583 HB VAL 71 HB VAL 71 1.651 -6.470 1.321 584 HG11 VAL 71 HG11 VAL 71 0.512 -4.127 0.356 585 HG12 VAL 71 HG12 VAL 71 1.333 -4.840 -1.024 586 HG13 VAL 71 HG13 VAL 71 2.223 -4.509 0.461 587 HG21 VAL 71 HG21 VAL 71 -0.471 -6.961 1.979 588 HG22 VAL 71 HG22 VAL 71 -1.189 -6.423 0.457 589 HG23 VAL 71 HG23 VAL 71 -0.641 -5.237 1.644 590 H THR 72 HN THR 72 -1.183 -8.351 0.038 591 HA THR 72 HA THR 72 -0.300 -10.414 1.682 592 HB THR 72 HB THR 72 -2.662 -9.626 1.510 593 HG1 THR 72 HG1 THR 72 -2.945 -11.442 2.543 594 HG21 THR 72 HG21 THR 72 -2.900 -9.594 -0.899 595 HG22 THR 72 HG22 THR 72 -4.114 -10.652 -0.182 596 HG23 THR 72 HG23 THR 72 -2.694 -11.343 -0.970 597 H SER 73 HN SER 73 -0.526 -10.210 -1.789 598 HA SER 73 HA SER 73 -0.128 -12.955 -2.336 599 HB2 SER 73 HB2 SER 73 -0.038 -12.340 -4.569 600 HB3 SER 73 HB1 SER 73 -0.892 -10.962 -3.879 601 HG SER 73 HG SER 73 1.115 -9.852 -3.803 602 H CYS 74 HN CYS 74 1.965 -10.379 -1.425 603 HA CYS 74 HA CYS 74 4.388 -11.799 -2.191 604 HB2 CYS 74 HB2 CYS 74 4.291 -9.374 -2.548 605 HB3 CYS 74 HB1 CYS 74 4.027 -9.122 -0.825 606 HG CYS 74 HG CYS 74 6.584 -10.328 -0.198 607 H LEU 75 HN LEU 75 2.929 -10.517 0.810 608 HA LEU 75 HA LEU 75 4.723 -11.501 2.662 609 HB2 LEU 75 HB2 LEU 75 1.789 -11.628 3.222 610 HB3 LEU 75 HB1 LEU 75 3.092 -11.142 4.281 611 HG LEU 75 HG LEU 75 2.189 -9.501 1.937 612 HD11 LEU 75 HD11 LEU 75 1.552 -8.908 4.784 613 HD12 LEU 75 HD12 LEU 75 0.509 -9.974 3.846 614 HD13 LEU 75 HD13 LEU 75 0.778 -8.318 3.313 615 HD21 LEU 75 HD21 LEU 75 4.492 -9.180 2.794 616 HD22 LEU 75 HD22 LEU 75 3.810 -8.784 4.370 617 HD23 LEU 75 HD23 LEU 75 3.462 -7.760 2.975 618 H ARG 76 HN ARG 76 2.135 -13.169 1.003 619 HA ARG 76 HA ARG 76 2.463 -15.572 2.599 620 HB2 ARG 76 HB2 ARG 76 0.575 -14.804 0.379 621 HB3 ARG 76 HB1 ARG 76 0.614 -16.420 1.078 622 HG2 ARG 76 HG2 ARG 76 -0.209 -15.703 3.109 623 HG3 ARG 76 HG1 ARG 76 0.329 -14.041 2.857 624 HD2 ARG 76 HD2 ARG 76 -2.092 -14.229 2.708 625 HD3 ARG 76 HD1 ARG 76 -1.390 -13.717 1.178 626 HE ARG 76 HE ARG 76 -1.766 -16.539 1.269 627 HH11 ARG 76 HH11 ARG 76 -3.417 -13.493 0.823 628 HH12 ARG 76 HH12 ARG 76 -4.686 -14.166 -0.149 629 HH21 ARG 76 HH21 ARG 76 -3.432 -17.447 -0.017 630 HH22 ARG 76 HH22 ARG 76 -4.698 -16.428 -0.625 631 H LYS 77 HN LYS 77 4.458 -14.420 0.616 632 HA LYS 77 HA LYS 77 5.323 -16.981 -0.415 633 HB2 LYS 77 HB2 LYS 77 4.431 -14.747 -2.164 634 HB3 LYS 77 HB1 LYS 77 5.887 -15.610 -2.634 635 HG2 LYS 77 HG2 LYS 77 4.675 -17.699 -2.680 636 HG3 LYS 77 HG1 LYS 77 3.216 -16.884 -2.117 637 HD2 LYS 77 HD2 LYS 77 3.235 -15.497 -4.147 638 HD3 LYS 77 HD1 LYS 77 4.676 -16.342 -4.704 639 HE2 LYS 77 HE2 LYS 77 3.432 -18.434 -4.795 640 HE3 LYS 77 HE1 LYS 77 1.991 -17.620 -4.186 641 HZ1 LYS 77 HZ1 LYS 77 1.945 -16.257 -6.165 642 HZ2 LYS 77 HZ2 LYS 77 1.940 -17.891 -6.597 643 HZ3 LYS 77 HZ3 LYS 77 3.360 -16.984 -6.745 644 H LYS 78 HN LYS 78 7.477 -16.186 -1.894 645 HA LYS 78 HA LYS 78 8.890 -14.252 -0.208 646 HB2 LYS 78 HB2 LYS 78 9.731 -16.860 -1.315 647 HB3 LYS 78 HB1 LYS 78 10.919 -15.574 -1.401 648 HG2 LYS 78 HG2 LYS 78 11.274 -16.832 0.601 649 HG3 LYS 78 HG1 LYS 78 10.685 -15.228 1.020 650 HD2 LYS 78 HD2 LYS 78 9.609 -16.887 2.405 651 HD3 LYS 78 HD1 LYS 78 8.426 -16.158 1.320 652 HE2 LYS 78 HE2 LYS 78 8.524 -18.079 -0.139 653 HE3 LYS 78 HE1 LYS 78 9.812 -18.790 0.833 654 HZ1 LYS 78 HZ1 LYS 78 7.635 -19.751 1.322 655 HZ2 LYS 78 HZ2 LYS 78 7.062 -18.235 1.797 656 HZ3 LYS 78 HZ3 LYS 78 8.295 -18.983 2.676 657 H ARG 79 HN ARG 79 9.968 -15.617 -3.255 658 HA ARG 79 HA ARG 79 10.641 -14.682 -5.206 659 HB2 ARG 79 HB2 ARG 79 8.052 -14.463 -5.190 660 HB3 ARG 79 HB1 ARG 79 8.357 -12.748 -4.992 661 HG2 ARG 79 HG2 ARG 79 9.481 -14.381 -7.253 662 HG3 ARG 79 HG1 ARG 79 7.948 -13.522 -7.344 663 HD2 ARG 79 HD2 ARG 79 9.122 -11.409 -6.911 664 HD3 ARG 79 HD1 ARG 79 10.653 -12.280 -6.844 665 HE ARG 79 HE ARG 79 9.805 -12.976 -9.259 666 HH11 ARG 79 HH11 ARG 79 9.884 -9.827 -7.719 667 HH12 ARG 79 HH12 ARG 79 9.991 -8.960 -9.215 668 HH21 ARG 79 HH21 ARG 79 9.959 -11.823 -11.229 669 HH22 ARG 79 HH22 ARG 79 10.032 -10.090 -11.205 670 H LYS 80 HN LYS 80 12.584 -13.768 -4.588 671 HA LYS 80 HA LYS 80 12.737 -10.910 -4.634 672 HB2 LYS 80 HB2 LYS 80 12.113 -11.154 -2.257 673 HB3 LYS 80 HB1 LYS 80 13.440 -12.290 -2.023 674 HG2 LYS 80 HG2 LYS 80 15.025 -10.464 -2.592 675 HG3 LYS 80 HG1 LYS 80 13.656 -9.355 -2.679 676 HD2 LYS 80 HD2 LYS 80 13.118 -9.843 -0.336 677 HD3 LYS 80 HD1 LYS 80 14.492 -10.947 -0.253 678 HE2 LYS 80 HE2 LYS 80 15.995 -9.056 -0.784 679 HE3 LYS 80 HE1 LYS 80 14.605 -7.973 -0.759 680 HZ1 LYS 80 HZ1 LYS 80 14.246 -8.561 1.565 681 HZ2 LYS 80 HZ2 LYS 80 15.792 -7.921 1.338 682 HZ3 LYS 80 HZ3 LYS 80 15.589 -9.587 1.533 683 HA PRO 81 HA PRO 81 16.559 -13.119 -6.016 684 HB2 PRO 81 HB2 PRO 81 16.551 -12.280 -8.569 685 HB3 PRO 81 HB1 PRO 81 15.619 -13.690 -8.051 686 HG2 PRO 81 HG2 PRO 81 14.695 -10.893 -8.551 687 HG3 PRO 81 HG1 PRO 81 13.917 -12.421 -8.992 688 HD2 PRO 81 HD2 PRO 81 13.209 -10.915 -6.811 689 HD3 PRO 81 HD1 PRO 81 12.966 -12.670 -6.923 690 H GLN 82 HN GLN 82 15.527 -10.182 -5.240 691 HA GLN 82 HA GLN 82 17.973 -8.783 -6.090 692 HB2 GLN 82 HB2 GLN 82 15.760 -7.825 -6.837 693 HB3 GLN 82 HB1 GLN 82 15.377 -7.549 -5.146 694 HG2 GLN 82 HG2 GLN 82 16.158 -5.511 -6.157 695 HG3 GLN 82 HG1 GLN 82 17.323 -6.070 -4.959 696 HE21 GLN 82 HE21 GLN 82 17.008 -7.526 -8.115 697 HE22 GLN 82 HE22 GLN 82 18.523 -6.969 -8.734 698 H ALA 83 HN ALA 83 19.170 -9.695 -4.373 699 HA ALA 83 HA ALA 83 18.823 -8.331 -1.836 700 HB1 ALA 83 HB1 ALA 83 17.504 -10.368 -1.533 701 HB2 ALA 83 HB2 ALA 83 18.944 -10.388 -0.513 702 HB3 ALA 83 HB3 ALA 83 18.896 -11.345 -1.993 703 H1 GLU 201 HT1 GLU 201 -8.542 8.420 11.740 704 H2 GLU 201 HT2 GLU 201 -7.510 7.276 12.441 705 H3 GLU 201 HT3 GLU 201 -8.089 7.037 10.867 706 HA GLU 201 HA GLU 201 -6.844 8.846 10.035 707 HB2 GLU 201 HB2 GLU 201 -6.212 9.354 12.937 708 HB3 GLU 201 HB1 GLU 201 -5.244 10.026 11.635 709 HG2 GLU 201 HG2 GLU 201 -6.730 11.726 12.226 710 HG3 GLU 201 HG1 GLU 201 -7.393 11.036 10.749 711 H ILE 202 HN ILE 202 -5.606 7.521 8.905 712 HA ILE 202 HA ILE 202 -3.363 6.207 10.286 713 HB ILE 202 HB ILE 202 -5.050 5.015 8.074 714 HG12 ILE 202 HG12 ILE 202 -6.007 4.819 10.353 715 HG13 ILE 202 HG11 ILE 202 -5.570 3.257 9.670 716 HG21 ILE 202 HG21 ILE 202 -3.558 3.081 8.177 717 HG22 ILE 202 HG22 ILE 202 -2.544 3.925 9.347 718 HG23 ILE 202 HG23 ILE 202 -2.688 4.541 7.702 719 HD11 ILE 202 HD11 ILE 202 -3.499 3.287 10.993 720 HD12 ILE 202 HD12 ILE 202 -4.949 3.354 11.993 721 HD13 ILE 202 HD13 ILE 202 -4.004 4.816 11.711 722 H LYS 203 HN LYS 203 -1.479 6.890 9.498 723 HA LYS 203 HA LYS 203 -1.362 7.711 6.674 724 HB2 LYS 203 HB2 LYS 203 0.095 8.992 8.996 725 HB3 LYS 203 HB1 LYS 203 0.296 9.424 7.303 726 HG2 LYS 203 HG2 LYS 203 -2.078 10.083 7.227 727 HG3 LYS 203 HG1 LYS 203 -2.206 9.733 8.949 728 HD2 LYS 203 HD2 LYS 203 -0.524 11.429 9.425 729 HD3 LYS 203 HD1 LYS 203 -0.357 11.760 7.699 730 HE2 LYS 203 HE2 LYS 203 -2.659 12.503 7.588 731 HE3 LYS 203 HE1 LYS 203 -2.901 12.087 9.284 732 HZ1 LYS 203 HZ1 LYS 203 -1.046 14.162 8.255 733 HZ2 LYS 203 HZ2 LYS 203 -1.257 13.757 9.879 734 HZ3 LYS 203 HZ3 LYS 203 -2.531 14.448 9.011 735 H LEU 204 HN LEU 204 0.289 6.878 5.507 736 HA LEU 204 HA LEU 204 2.259 5.251 6.987 737 HB2 LEU 204 HB2 LEU 204 0.401 4.237 5.309 738 HB3 LEU 204 HB1 LEU 204 1.672 4.589 4.161 739 HG LEU 204 HG LEU 204 1.766 2.678 6.485 740 HD11 LEU 204 HD11 LEU 204 2.317 2.260 3.558 741 HD12 LEU 204 HD12 LEU 204 0.780 1.920 4.347 742 HD13 LEU 204 HD13 LEU 204 2.225 1.028 4.814 743 HD21 LEU 204 HD21 LEU 204 4.107 3.327 4.719 744 HD22 LEU 204 HD22 LEU 204 4.071 2.312 6.158 745 HD23 LEU 204 HD23 LEU 204 3.874 4.057 6.306 746 H LYS 205 HN LYS 205 4.064 6.437 6.985 747 HA LYS 205 HA LYS 205 4.948 7.846 4.605 748 HB2 LYS 205 HB2 LYS 205 6.027 7.530 7.390 749 HB3 LYS 205 HB1 LYS 205 7.048 8.157 6.109 750 HG2 LYS 205 HG2 LYS 205 4.438 9.356 7.008 751 HG3 LYS 205 HG1 LYS 205 6.050 9.926 7.454 752 HD2 LYS 205 HD2 LYS 205 6.438 10.097 4.901 753 HD3 LYS 205 HD1 LYS 205 4.680 10.014 4.788 754 HE2 LYS 205 HE2 LYS 205 6.311 12.062 6.275 755 HE3 LYS 205 HE1 LYS 205 5.361 12.317 4.813 756 HZ1 LYS 205 HZ1 LYS 205 4.103 13.115 6.630 757 HZ2 LYS 205 HZ2 LYS 205 4.355 11.708 7.530 758 HZ3 LYS 205 HZ3 LYS 205 3.375 11.661 6.151 759 H ILE 206 HN ILE 206 5.022 5.803 3.294 760 HA ILE 206 HA ILE 206 6.985 3.839 3.969 761 HB ILE 206 HB ILE 206 6.297 4.279 1.091 762 HG12 ILE 206 HG12 ILE 206 4.477 2.757 2.952 763 HG13 ILE 206 HG11 ILE 206 4.100 4.380 2.365 764 HG21 ILE 206 HG21 ILE 206 6.120 1.617 2.195 765 HG22 ILE 206 HG22 ILE 206 7.651 2.408 2.614 766 HG23 ILE 206 HG23 ILE 206 7.177 2.255 0.923 767 HD11 ILE 206 HD11 ILE 206 4.762 2.799 0.117 768 HD12 ILE 206 HD12 ILE 206 3.184 3.440 0.575 769 HD13 ILE 206 HD13 ILE 206 3.675 1.846 1.130 770 H THR 207 HN THR 207 9.134 4.090 3.881 771 HA THR 207 HA THR 207 10.196 6.208 2.145 772 HB THR 207 HB THR 207 12.246 6.030 3.631 773 HG1 THR 207 HG1 THR 207 11.955 5.011 5.629 774 HG21 THR 207 HG21 THR 207 9.644 6.866 4.917 775 HG22 THR 207 HG22 THR 207 10.637 7.857 3.847 776 HG23 THR 207 HG23 THR 207 11.254 7.374 5.427 777 H LYS 208 HN LYS 208 11.180 5.566 0.342 778 HA LYS 208 HA LYS 208 13.145 3.638 0.161 779 HB2 LYS 208 HB2 LYS 208 12.176 1.713 -0.810 780 HB3 LYS 208 HB1 LYS 208 11.217 2.073 0.609 781 HG2 LYS 208 HG2 LYS 208 10.435 2.705 -2.229 782 HG3 LYS 208 HG1 LYS 208 9.865 1.333 -1.290 783 HD2 LYS 208 HD2 LYS 208 8.133 2.727 -0.877 784 HD3 LYS 208 HD1 LYS 208 9.212 3.340 0.376 785 HE2 LYS 208 HE2 LYS 208 10.030 5.039 -1.198 786 HE3 LYS 208 HE1 LYS 208 8.887 4.450 -2.401 787 HZ1 LYS 208 HZ1 LYS 208 8.057 6.386 -1.271 788 HZ2 LYS 208 HZ2 LYS 208 8.185 5.617 0.234 789 HZ3 LYS 208 HZ3 LYS 208 7.082 5.047 -0.920 790 H THR 209 HN THR 209 12.610 2.650 -2.476 791 HA THR 209 HA THR 209 13.073 3.166 -4.606 792 HB THR 209 HB THR 209 11.926 5.025 -5.722 793 HG1 THR 209 HG1 THR 209 11.740 6.012 -3.195 794 HG21 THR 209 HG21 THR 209 10.089 3.583 -3.819 795 HG22 THR 209 HG22 THR 209 10.763 2.885 -5.290 796 HG23 THR 209 HG23 THR 209 9.665 4.261 -5.391 797 H ILE 210 HN ILE 210 14.922 3.988 -2.592 798 HA ILE 210 HA ILE 210 16.137 6.353 -3.832 799 HB ILE 210 HB ILE 210 17.741 6.251 -1.907 800 HG12 ILE 210 HG12 ILE 210 15.756 4.247 -0.804 801 HG13 ILE 210 HG11 ILE 210 17.372 3.847 -1.372 802 HG21 ILE 210 HG21 ILE 210 16.147 7.185 -0.295 803 HG22 ILE 210 HG22 ILE 210 14.815 6.550 -1.259 804 HG23 ILE 210 HG23 ILE 210 15.875 7.792 -1.928 805 HD11 ILE 210 HD11 ILE 210 17.257 4.003 1.059 806 HD12 ILE 210 HD12 ILE 210 16.737 5.683 0.923 807 HD13 ILE 210 HD13 ILE 210 18.345 5.212 0.377 808 H GLN 211 HN GLN 211 16.450 2.940 -3.460 809 HA GLN 211 HA GLN 211 19.161 2.926 -4.512 810 HB2 GLN 211 HB2 GLN 211 17.335 0.643 -3.739 811 HB3 GLN 211 HB1 GLN 211 19.009 0.477 -4.243 812 HG2 GLN 211 HG2 GLN 211 18.078 1.982 -1.812 813 HG3 GLN 211 HG1 GLN 211 18.717 0.342 -1.807 814 HE21 GLN 211 HE21 GLN 211 20.402 0.899 -0.454 815 HE22 GLN 211 HE22 GLN 211 21.756 1.831 -0.993 816 H ASN 212 HN ASN 212 18.614 3.903 -6.527 817 HA ASN 212 HA ASN 212 17.227 2.090 -8.390 818 HB2 ASN 212 HB2 ASN 212 17.723 5.056 -8.755 819 HB3 ASN 212 HB1 ASN 212 16.760 4.013 -9.795 820 HD21 ASN 212 HD21 ASN 212 16.868 5.844 -6.896 821 HD22 ASN 212 HD22 ASN 212 15.205 5.655 -6.451 Start of MODEL 6 1 H1 SER 1 HT1 SER 1 -8.736 -5.479 -12.120 2 H2 SER 1 HT2 SER 1 -10.037 -6.434 -11.617 3 H3 SER 1 HT3 SER 1 -9.392 -5.269 -10.576 4 HA SER 1 HA SER 1 -10.159 -3.500 -11.888 5 HB2 SER 1 HB2 SER 1 -11.203 -5.543 -13.859 6 HB3 SER 1 HB1 SER 1 -11.186 -3.787 -14.042 7 HG SER 1 HG SER 1 -9.411 -4.355 -15.111 8 H GLU 2 HN GLU 2 -12.315 -6.304 -12.435 9 HA GLU 2 HA GLU 2 -14.623 -4.856 -11.805 10 HB2 GLU 2 HB2 GLU 2 -14.206 -7.851 -11.792 11 HB3 GLU 2 HB1 GLU 2 -15.767 -7.048 -11.724 12 HG2 GLU 2 HG2 GLU 2 -13.783 -6.851 -13.974 13 HG3 GLU 2 HG1 GLU 2 -15.280 -7.785 -13.975 14 H GLU 3 HN GLU 3 -12.777 -7.100 -9.772 15 HA GLU 3 HA GLU 3 -14.662 -7.076 -7.648 16 HB2 GLU 3 HB2 GLU 3 -11.745 -7.873 -7.662 17 HB3 GLU 3 HB1 GLU 3 -12.842 -8.147 -6.323 18 HG2 GLU 3 HG2 GLU 3 -12.551 -10.170 -7.600 19 HG3 GLU 3 HG1 GLU 3 -14.210 -9.597 -7.743 20 H GLU 4 HN GLU 4 -11.901 -5.116 -8.453 21 HA GLU 4 HA GLU 4 -11.757 -3.939 -5.810 22 HB2 GLU 4 HB2 GLU 4 -9.924 -2.566 -6.741 23 HB3 GLU 4 HB1 GLU 4 -9.675 -4.286 -7.032 24 HG2 GLU 4 HG2 GLU 4 -10.633 -3.948 -9.316 25 HG3 GLU 4 HG1 GLU 4 -10.610 -2.217 -8.996 26 H ASP 5 HN ASP 5 -13.006 -3.046 -8.997 27 HA ASP 5 HA ASP 5 -13.398 -0.297 -8.345 28 HB2 ASP 5 HB2 ASP 5 -14.616 -1.978 -10.556 29 HB3 ASP 5 HB1 ASP 5 -14.862 -0.242 -10.393 30 H LYS 6 HN LYS 6 -15.093 -3.115 -7.473 31 HA LYS 6 HA LYS 6 -17.401 -1.466 -6.667 32 HB2 LYS 6 HB2 LYS 6 -17.832 -3.198 -8.474 33 HB3 LYS 6 HB1 LYS 6 -17.497 -4.423 -7.262 34 HG2 LYS 6 HG2 LYS 6 -19.863 -4.173 -7.431 35 HG3 LYS 6 HG1 LYS 6 -19.363 -3.471 -5.892 36 HD2 LYS 6 HD2 LYS 6 -20.974 -2.016 -6.930 37 HD3 LYS 6 HD1 LYS 6 -19.397 -1.233 -6.956 38 HE2 LYS 6 HE2 LYS 6 -20.541 -0.931 -9.078 39 HE3 LYS 6 HE1 LYS 6 -19.100 -1.921 -9.288 40 HZ1 LYS 6 HZ1 LYS 6 -21.000 -2.804 -10.505 41 HZ2 LYS 6 HZ2 LYS 6 -21.872 -2.961 -9.065 42 HZ3 LYS 6 HZ3 LYS 6 -20.483 -3.890 -9.317 43 H CYS 7 HN CYS 7 -14.805 -2.259 -5.397 44 HA CYS 7 HA CYS 7 -15.431 -4.191 -3.369 45 HB2 CYS 7 HB2 CYS 7 -13.140 -3.775 -4.344 46 HB3 CYS 7 HB1 CYS 7 -13.085 -2.289 -3.403 47 HG CYS 7 HG CYS 7 -13.437 -3.713 -0.933 48 H LYS 8 HN LYS 8 -15.996 -3.893 -1.299 49 HA LYS 8 HA LYS 8 -16.946 -1.305 -0.478 50 HB2 LYS 8 HB2 LYS 8 -16.968 -4.056 0.716 51 HB3 LYS 8 HB1 LYS 8 -17.317 -2.667 1.728 52 HG2 LYS 8 HG2 LYS 8 -19.370 -3.631 0.964 53 HG3 LYS 8 HG1 LYS 8 -19.153 -2.051 0.216 54 HD2 LYS 8 HD2 LYS 8 -18.379 -3.129 -1.838 55 HD3 LYS 8 HD1 LYS 8 -18.568 -4.712 -1.083 56 HE2 LYS 8 HE2 LYS 8 -20.971 -4.271 -0.808 57 HE3 LYS 8 HE1 LYS 8 -20.765 -2.717 -1.614 58 HZ1 LYS 8 HZ1 LYS 8 -21.580 -4.398 -3.137 59 HZ2 LYS 8 HZ2 LYS 8 -20.233 -5.375 -2.824 60 HZ3 LYS 8 HZ3 LYS 8 -20.036 -3.885 -3.597 61 HA PRO 9 HA PRO 9 -13.298 0.122 1.568 62 HB2 PRO 9 HB2 PRO 9 -15.003 1.187 3.706 63 HB3 PRO 9 HB1 PRO 9 -13.930 2.033 2.588 64 HG2 PRO 9 HG2 PRO 9 -16.620 2.169 2.393 65 HG3 PRO 9 HG1 PRO 9 -15.551 2.257 0.983 66 HD2 PRO 9 HD2 PRO 9 -17.220 -0.010 1.960 67 HD3 PRO 9 HD1 PRO 9 -16.818 0.467 0.299 68 H MET 10 HN MET 10 -11.978 -1.115 2.717 69 HA MET 10 HA MET 10 -12.874 -2.962 4.685 70 HB2 MET 10 HB2 MET 10 -10.487 -3.365 5.099 71 HB3 MET 10 HB1 MET 10 -10.854 -3.393 3.386 72 HG2 MET 10 HG2 MET 10 -9.969 -1.153 3.134 73 HG3 MET 10 HG1 MET 10 -9.626 -1.095 4.860 74 HE1 MET 10 HE1 MET 10 -8.898 -3.018 1.525 75 HE2 MET 10 HE2 MET 10 -9.166 -4.344 2.656 76 HE3 MET 10 HE3 MET 10 -7.556 -4.062 1.994 77 H SER 11 HN SER 11 -12.539 -2.891 6.930 78 HA SER 11 HA SER 11 -13.016 -0.248 7.959 79 HB2 SER 11 HB2 SER 11 -13.066 -2.966 9.291 80 HB3 SER 11 HB1 SER 11 -13.512 -1.458 10.089 81 HG SER 11 HG SER 11 -14.939 -1.323 8.031 82 H TYR 12 HN TYR 12 -12.060 -0.061 10.401 83 HA TYR 12 HA TYR 12 -9.574 1.089 9.929 84 HB2 TYR 12 HB2 TYR 12 -11.196 1.612 11.783 85 HB3 TYR 12 HB1 TYR 12 -10.570 0.203 12.642 86 HD1 TYR 12 HD1 TYR 12 -8.078 0.190 13.222 87 HD2 TYR 12 HD2 TYR 12 -10.128 3.680 11.931 88 HE1 TYR 12 HE1 TYR 12 -6.306 1.586 14.205 89 HE2 TYR 12 HE2 TYR 12 -8.360 5.085 12.897 90 HH TYR 12 HH TYR 12 -6.635 4.931 14.650 91 H GLU 13 HN GLU 13 -10.241 -2.074 11.410 92 HA GLU 13 HA GLU 13 -7.628 -2.619 12.282 93 HB2 GLU 13 HB2 GLU 13 -9.696 -3.875 12.942 94 HB3 GLU 13 HB1 GLU 13 -9.678 -4.647 11.363 95 HG2 GLU 13 HG2 GLU 13 -7.456 -5.582 11.883 96 HG3 GLU 13 HG1 GLU 13 -7.567 -4.875 13.495 97 H GLU 14 HN GLU 14 -9.071 -2.803 9.157 98 HA GLU 14 HA GLU 14 -7.073 -4.599 8.067 99 HB2 GLU 14 HB2 GLU 14 -9.410 -3.176 6.780 100 HB3 GLU 14 HB1 GLU 14 -8.372 -4.339 5.966 101 HG2 GLU 14 HG2 GLU 14 -9.153 -6.120 7.308 102 HG3 GLU 14 HG1 GLU 14 -9.949 -5.015 8.432 103 H LYS 15 HN LYS 15 -8.188 -1.259 7.625 104 HA LYS 15 HA LYS 15 -6.264 -0.396 5.813 105 HB2 LYS 15 HB2 LYS 15 -7.729 1.064 8.010 106 HB3 LYS 15 HB1 LYS 15 -6.649 1.874 6.892 107 HG2 LYS 15 HG2 LYS 15 -8.030 1.416 5.040 108 HG3 LYS 15 HG1 LYS 15 -8.982 0.250 5.968 109 HD2 LYS 15 HD2 LYS 15 -10.211 1.856 6.996 110 HD3 LYS 15 HD1 LYS 15 -8.879 3.011 7.032 111 HE2 LYS 15 HE2 LYS 15 -9.171 3.447 4.663 112 HE3 LYS 15 HE1 LYS 15 -10.464 2.253 4.577 113 HZ1 LYS 15 HZ1 LYS 15 -11.778 3.614 6.069 114 HZ2 LYS 15 HZ2 LYS 15 -11.295 4.537 4.736 115 HZ3 LYS 15 HZ3 LYS 15 -10.515 4.730 6.226 116 H ARG 16 HN ARG 16 -6.174 -0.473 9.355 117 HA ARG 16 HA ARG 16 -3.588 0.603 9.668 118 HB2 ARG 16 HB2 ARG 16 -5.207 0.345 11.520 119 HB3 ARG 16 HB1 ARG 16 -5.011 -1.404 11.430 120 HG2 ARG 16 HG2 ARG 16 -2.454 -0.732 11.753 121 HG3 ARG 16 HG1 ARG 16 -3.202 0.657 12.545 122 HD2 ARG 16 HD2 ARG 16 -2.785 -1.054 14.186 123 HD3 ARG 16 HD1 ARG 16 -4.524 -0.907 13.935 124 HE ARG 16 HE ARG 16 -3.321 -2.916 12.286 125 HH11 ARG 16 HH11 ARG 16 -4.620 -2.269 15.469 126 HH12 ARG 16 HH12 ARG 16 -5.017 -3.928 15.783 127 HH21 ARG 16 HH21 ARG 16 -3.837 -5.104 12.687 128 HH22 ARG 16 HH22 ARG 16 -4.568 -5.542 14.201 129 H GLN 17 HN GLN 17 -4.722 -2.744 9.358 130 HA GLN 17 HA GLN 17 -2.214 -3.956 9.722 131 HB2 GLN 17 HB2 GLN 17 -4.529 -5.015 9.899 132 HB3 GLN 17 HB1 GLN 17 -4.504 -5.112 8.145 133 HG2 GLN 17 HG2 GLN 17 -3.846 -7.219 9.051 134 HG3 GLN 17 HG1 GLN 17 -2.448 -6.463 8.289 135 HE21 GLN 17 HE21 GLN 17 -0.985 -7.637 9.483 136 HE22 GLN 17 HE22 GLN 17 -0.721 -7.369 11.169 137 H LEU 18 HN LEU 18 -3.768 -2.530 7.010 138 HA LEU 18 HA LEU 18 -2.149 -3.681 4.964 139 HB2 LEU 18 HB2 LEU 18 -4.441 -2.160 5.062 140 HB3 LEU 18 HB1 LEU 18 -3.263 -1.007 4.475 141 HG LEU 18 HG LEU 18 -3.709 -3.682 3.165 142 HD11 LEU 18 HD11 LEU 18 -4.978 -1.033 2.535 143 HD12 LEU 18 HD12 LEU 18 -5.801 -2.476 3.116 144 HD13 LEU 18 HD13 LEU 18 -5.060 -2.462 1.516 145 HD21 LEU 18 HD21 LEU 18 -1.647 -2.785 2.482 146 HD22 LEU 18 HD22 LEU 18 -2.296 -1.155 2.377 147 HD23 LEU 18 HD23 LEU 18 -2.781 -2.377 1.205 148 H SER 19 HN SER 19 -2.055 -0.656 6.798 149 HA SER 19 HA SER 19 0.301 0.382 5.707 150 HB2 SER 19 HB2 SER 19 -1.133 1.653 7.257 151 HB3 SER 19 HB1 SER 19 -0.707 0.551 8.565 152 HG SER 19 HG SER 19 0.484 2.716 8.157 153 H LEU 20 HN LEU 20 -0.277 -2.145 8.023 154 HA LEU 20 HA LEU 20 2.461 -2.446 8.796 155 HB2 LEU 20 HB2 LEU 20 0.012 -4.129 9.241 156 HB3 LEU 20 HB1 LEU 20 1.586 -4.552 9.869 157 HG LEU 20 HG LEU 20 0.130 -2.005 10.554 158 HD11 LEU 20 HD11 LEU 20 -0.835 -4.278 11.288 159 HD12 LEU 20 HD12 LEU 20 -0.629 -3.012 12.495 160 HD13 LEU 20 HD13 LEU 20 0.541 -4.330 12.387 161 HD21 LEU 20 HD21 LEU 20 2.650 -2.039 10.692 162 HD22 LEU 20 HD22 LEU 20 2.485 -3.293 11.919 163 HD23 LEU 20 HD23 LEU 20 1.810 -1.688 12.200 164 H ASP 21 HN ASP 21 0.373 -3.878 6.354 165 HA ASP 21 HA ASP 21 2.180 -6.067 5.893 166 HB2 ASP 21 HB2 ASP 21 0.652 -6.751 4.112 167 HB3 ASP 21 HB1 ASP 21 -0.185 -6.455 5.623 168 H ILE 22 HN ILE 22 1.555 -2.959 4.342 169 HA ILE 22 HA ILE 22 3.332 -3.410 2.159 170 HB ILE 22 HB ILE 22 2.350 -0.848 3.425 171 HG12 ILE 22 HG12 ILE 22 1.715 -1.900 0.682 172 HG13 ILE 22 HG11 ILE 22 0.833 -2.495 2.094 173 HG21 ILE 22 HG21 ILE 22 4.378 -0.196 2.480 174 HG22 ILE 22 HG22 ILE 22 3.155 0.205 1.273 175 HG23 ILE 22 HG23 ILE 22 4.154 -1.235 1.077 176 HD11 ILE 22 HD11 ILE 22 0.094 -0.294 2.587 177 HD12 ILE 22 HD12 ILE 22 -0.319 -0.678 0.923 178 HD13 ILE 22 HD13 ILE 22 1.045 0.388 1.276 179 H ASN 23 HN ASN 23 3.697 -2.172 5.406 180 HA ASN 23 HA ASN 23 6.334 -1.279 5.336 181 HB2 ASN 23 HB2 ASN 23 5.092 -0.775 7.265 182 HB3 ASN 23 HB1 ASN 23 4.582 -2.441 7.486 183 HD21 ASN 23 HD21 ASN 23 7.125 -0.133 7.957 184 HD22 ASN 23 HD22 ASN 23 8.066 -1.090 9.050 185 H LYS 24 HN LYS 24 5.030 -4.478 5.238 186 HA LYS 24 HA LYS 24 7.415 -5.823 6.134 187 HB2 LYS 24 HB2 LYS 24 4.850 -6.795 4.892 188 HB3 LYS 24 HB1 LYS 24 6.153 -7.875 5.382 189 HG2 LYS 24 HG2 LYS 24 5.900 -7.164 7.686 190 HG3 LYS 24 HG1 LYS 24 4.676 -5.984 7.214 191 HD2 LYS 24 HD2 LYS 24 3.284 -7.875 6.365 192 HD3 LYS 24 HD1 LYS 24 4.476 -8.989 7.036 193 HE2 LYS 24 HE2 LYS 24 2.889 -6.955 8.602 194 HE3 LYS 24 HE1 LYS 24 2.552 -8.682 8.531 195 HZ1 LYS 24 HZ1 LYS 24 4.996 -7.417 9.652 196 HZ2 LYS 24 HZ2 LYS 24 4.734 -9.083 9.533 197 HZ3 LYS 24 HZ3 LYS 24 3.747 -8.145 10.532 198 H LEU 25 HN LEU 25 6.087 -4.834 3.061 199 HA LEU 25 HA LEU 25 7.410 -6.654 1.373 200 HB2 LEU 25 HB2 LEU 25 6.594 -3.821 0.830 201 HB3 LEU 25 HB1 LEU 25 7.027 -4.977 -0.394 202 HG LEU 25 HG LEU 25 4.592 -4.938 1.344 203 HD11 LEU 25 HD11 LEU 25 5.107 -4.926 -1.610 204 HD12 LEU 25 HD12 LEU 25 4.445 -3.614 -0.638 205 HD13 LEU 25 HD13 LEU 25 3.509 -5.088 -0.891 206 HD21 LEU 25 HD21 LEU 25 5.663 -7.169 -0.322 207 HD22 LEU 25 HD22 LEU 25 3.997 -7.084 0.229 208 HD23 LEU 25 HD23 LEU 25 5.313 -7.209 1.399 209 HA PRO 26 HA PRO 26 11.683 -5.156 1.463 210 HB2 PRO 26 HB2 PRO 26 11.713 -6.606 -1.138 211 HB3 PRO 26 HB1 PRO 26 12.810 -6.754 0.244 212 HG2 PRO 26 HG2 PRO 26 11.018 -8.651 -0.255 213 HG3 PRO 26 HG1 PRO 26 11.344 -8.139 1.412 214 HD2 PRO 26 HD2 PRO 26 9.044 -7.427 -0.377 215 HD3 PRO 26 HD1 PRO 26 9.043 -7.839 1.354 216 H GLY 27 HN GLY 27 12.858 -3.606 0.253 217 HA2 GLY 27 HA2 GLY 27 11.468 -1.447 -0.597 218 HA3 GLY 27 HA1 GLY 27 13.117 -1.756 -1.085 219 H GLU 28 HN GLU 28 12.725 -3.933 -2.831 220 HA GLU 28 HA GLU 28 12.036 -2.582 -5.200 221 HB2 GLU 28 HB2 GLU 28 13.556 -4.547 -5.071 222 HB3 GLU 28 HB1 GLU 28 12.162 -5.570 -4.757 223 HG2 GLU 28 HG2 GLU 28 12.695 -5.803 -7.045 224 HG3 GLU 28 HG1 GLU 28 11.232 -4.823 -6.957 225 H LYS 29 HN LYS 29 10.282 -5.041 -3.362 226 HA LYS 29 HA LYS 29 7.950 -5.011 -4.979 227 HB2 LYS 29 HB2 LYS 29 8.582 -5.989 -2.201 228 HB3 LYS 29 HB1 LYS 29 6.973 -6.153 -2.902 229 HG2 LYS 29 HG2 LYS 29 9.491 -7.291 -4.101 230 HG3 LYS 29 HG1 LYS 29 8.354 -8.196 -3.101 231 HD2 LYS 29 HD2 LYS 29 6.572 -7.557 -4.758 232 HD3 LYS 29 HD1 LYS 29 7.859 -6.965 -5.803 233 HE2 LYS 29 HE2 LYS 29 7.266 -9.184 -6.485 234 HE3 LYS 29 HE1 LYS 29 8.875 -9.212 -5.772 235 HZ1 LYS 29 HZ1 LYS 29 7.479 -11.062 -5.043 236 HZ2 LYS 29 HZ2 LYS 29 6.384 -9.974 -4.357 237 HZ3 LYS 29 HZ3 LYS 29 7.956 -10.088 -3.749 238 H LEU 30 HN LEU 30 9.000 -3.362 -2.116 239 HA LEU 30 HA LEU 30 6.600 -2.146 -1.320 240 HB2 LEU 30 HB2 LEU 30 8.611 -2.228 0.064 241 HB3 LEU 30 HB1 LEU 30 9.467 -1.213 -1.076 242 HG LEU 30 HG LEU 30 8.256 0.700 -0.458 243 HD11 LEU 30 HD11 LEU 30 6.426 -0.737 1.382 244 HD12 LEU 30 HD12 LEU 30 6.063 -0.737 -0.334 245 HD13 LEU 30 HD13 LEU 30 6.203 0.784 0.532 246 HD21 LEU 30 HD21 LEU 30 8.533 0.774 1.997 247 HD22 LEU 30 HD22 LEU 30 9.925 0.078 1.167 248 HD23 LEU 30 HD23 LEU 30 8.775 -0.973 1.993 249 H GLY 31 HN GLY 31 9.031 -1.137 -3.692 250 HA2 GLY 31 HA2 GLY 31 8.142 1.458 -4.168 251 HA3 GLY 31 HA1 GLY 31 8.935 0.443 -5.361 252 H ARG 32 HN ARG 32 6.675 -1.556 -5.154 253 HA ARG 32 HA ARG 32 5.087 -0.485 -7.247 254 HB2 ARG 32 HB2 ARG 32 5.433 -2.876 -7.094 255 HB3 ARG 32 HB1 ARG 32 4.663 -2.914 -5.515 256 HG2 ARG 32 HG2 ARG 32 3.172 -3.753 -7.269 257 HG3 ARG 32 HG1 ARG 32 2.532 -2.296 -6.510 258 HD2 ARG 32 HD2 ARG 32 2.261 -2.241 -8.956 259 HD3 ARG 32 HD1 ARG 32 3.287 -0.938 -8.362 260 HE ARG 32 HE ARG 32 4.924 -3.094 -9.091 261 HH11 ARG 32 HH11 ARG 32 2.795 -0.742 -10.548 262 HH12 ARG 32 HH12 ARG 32 3.665 -0.681 -12.047 263 HH21 ARG 32 HH21 ARG 32 6.086 -3.024 -11.074 264 HH22 ARG 32 HH22 ARG 32 5.523 -1.993 -12.352 265 H VAL 33 HN VAL 33 4.379 -1.109 -3.805 266 HA VAL 33 HA VAL 33 1.675 -0.281 -3.985 267 HB VAL 33 HB VAL 33 2.413 0.233 -1.342 268 HG11 VAL 33 HG11 VAL 33 1.081 -1.979 -2.845 269 HG12 VAL 33 HG12 VAL 33 0.423 -0.872 -1.640 270 HG13 VAL 33 HG13 VAL 33 1.446 -2.214 -1.140 271 HG21 VAL 33 HG21 VAL 33 3.888 -2.192 -2.367 272 HG22 VAL 33 HG22 VAL 33 3.671 -1.750 -0.681 273 HG23 VAL 33 HG23 VAL 33 4.619 -0.715 -1.746 274 H VAL 34 HN VAL 34 4.589 1.475 -2.905 275 HA VAL 34 HA VAL 34 3.406 3.924 -2.322 276 HB VAL 34 HB VAL 34 5.564 4.407 -1.929 277 HG11 VAL 34 HG11 VAL 34 6.034 2.041 -2.152 278 HG12 VAL 34 HG12 VAL 34 7.397 3.043 -2.656 279 HG13 VAL 34 HG13 VAL 34 6.367 2.274 -3.864 280 HG21 VAL 34 HG21 VAL 34 5.390 5.828 -3.918 281 HG22 VAL 34 HG22 VAL 34 5.940 4.493 -4.921 282 HG23 VAL 34 HG23 VAL 34 7.022 5.199 -3.722 283 H HIS 35 HN HIS 35 4.342 2.560 -5.413 284 HA HIS 35 HA HIS 35 3.622 4.812 -6.990 285 HB2 HIS 35 HB2 HIS 35 5.211 3.007 -7.684 286 HB3 HIS 35 HB1 HIS 35 3.827 1.936 -7.868 287 HD1 HIS 35 HD1 HIS 35 5.475 4.931 -9.426 288 HD2 HIS 35 HD2 HIS 35 2.342 2.314 -10.202 289 HE1 HIS 35 HE1 HIS 35 4.794 5.374 -11.804 290 HE2 HIS 35 HE2 HIS 35 2.795 3.897 -12.191 291 H ILE 36 HN ILE 36 1.933 1.819 -6.093 292 HA ILE 36 HA ILE 36 -0.327 2.130 -7.698 293 HB ILE 36 HB ILE 36 -0.289 0.896 -4.933 294 HG12 ILE 36 HG12 ILE 36 0.210 -0.278 -7.668 295 HG13 ILE 36 HG11 ILE 36 1.320 -0.241 -6.308 296 HG21 ILE 36 HG21 ILE 36 -2.490 0.669 -5.211 297 HG22 ILE 36 HG22 ILE 36 -2.162 -0.361 -6.603 298 HG23 ILE 36 HG23 ILE 36 -2.399 1.371 -6.826 299 HD11 ILE 36 HD11 ILE 36 -0.222 -1.749 -5.087 300 HD12 ILE 36 HD12 ILE 36 0.456 -2.454 -6.551 301 HD13 ILE 36 HD13 ILE 36 -1.201 -1.856 -6.547 302 H ILE 37 HN ILE 37 0.169 3.238 -4.334 303 HA ILE 37 HA ILE 37 -2.374 4.407 -4.069 304 HB ILE 37 HB ILE 37 0.167 5.241 -2.656 305 HG12 ILE 37 HG12 ILE 37 -1.642 3.888 -0.946 306 HG13 ILE 37 HG11 ILE 37 -1.497 2.911 -2.401 307 HG21 ILE 37 HG21 ILE 37 -2.025 6.720 -2.797 308 HG22 ILE 37 HG22 ILE 37 -1.072 6.604 -1.316 309 HG23 ILE 37 HG23 ILE 37 -2.537 5.638 -1.501 310 HD11 ILE 37 HD11 ILE 37 0.841 2.701 -2.126 311 HD12 ILE 37 HD12 ILE 37 0.090 2.347 -0.567 312 HD13 ILE 37 HD13 ILE 37 0.855 3.910 -0.847 313 H GLN 38 HN GLN 38 0.728 5.879 -4.963 314 HA GLN 38 HA GLN 38 -0.180 8.490 -5.309 315 HB2 GLN 38 HB2 GLN 38 2.100 6.994 -6.590 316 HB3 GLN 38 HB1 GLN 38 1.813 8.698 -6.915 317 HG2 GLN 38 HG2 GLN 38 1.814 8.691 -4.193 318 HG3 GLN 38 HG1 GLN 38 2.914 7.361 -4.533 319 HE21 GLN 38 HE21 GLN 38 4.614 8.584 -3.649 320 HE22 GLN 38 HE22 GLN 38 5.369 9.850 -4.544 321 H SER 39 HN SER 39 -0.293 5.763 -7.527 322 HA SER 39 HA SER 39 -1.042 7.340 -9.793 323 HB2 SER 39 HB2 SER 39 0.106 5.172 -10.040 324 HB3 SER 39 HB1 SER 39 -1.295 4.354 -9.350 325 HG SER 39 HG SER 39 -2.489 4.883 -11.135 326 H ARG 40 HN ARG 40 -2.782 5.557 -7.304 327 HA ARG 40 HA ARG 40 -5.302 5.874 -8.706 328 HB2 ARG 40 HB2 ARG 40 -4.867 4.805 -5.928 329 HB3 ARG 40 HB1 ARG 40 -6.292 4.596 -6.933 330 HG2 ARG 40 HG2 ARG 40 -4.605 3.442 -8.570 331 HG3 ARG 40 HG1 ARG 40 -3.636 3.258 -7.105 332 HD2 ARG 40 HD2 ARG 40 -4.977 1.297 -7.455 333 HD3 ARG 40 HD1 ARG 40 -5.492 2.163 -6.015 334 HE ARG 40 HE ARG 40 -7.271 3.123 -7.604 335 HH11 ARG 40 HH11 ARG 40 -5.990 -0.129 -7.720 336 HH12 ARG 40 HH12 ARG 40 -7.403 -0.803 -8.475 337 HH21 ARG 40 HH21 ARG 40 -9.128 2.251 -8.594 338 HH22 ARG 40 HH22 ARG 40 -9.184 0.561 -8.978 339 H GLU 41 HN GLU 41 -3.649 7.218 -5.918 340 HA GLU 41 HA GLU 41 -5.859 9.130 -5.546 341 HB2 GLU 41 HB2 GLU 41 -3.598 8.567 -3.641 342 HB3 GLU 41 HB1 GLU 41 -5.048 9.495 -3.311 343 HG2 GLU 41 HG2 GLU 41 -4.801 6.527 -3.696 344 HG3 GLU 41 HG1 GLU 41 -5.256 7.397 -2.234 345 HA PRO 42 HA PRO 42 -2.592 11.546 -7.759 346 HB2 PRO 42 HB2 PRO 42 -4.926 13.315 -8.190 347 HB3 PRO 42 HB1 PRO 42 -3.758 12.690 -9.356 348 HG2 PRO 42 HG2 PRO 42 -6.247 11.740 -9.263 349 HG3 PRO 42 HG1 PRO 42 -4.868 10.673 -9.586 350 HD2 PRO 42 HD2 PRO 42 -6.424 11.046 -7.058 351 HD3 PRO 42 HD1 PRO 42 -5.779 9.553 -7.776 352 H SER 43 HN SER 43 -4.865 12.386 -5.284 353 HA SER 43 HA SER 43 -4.118 15.040 -4.796 354 HB2 SER 43 HB2 SER 43 -5.225 13.030 -2.828 355 HB3 SER 43 HB1 SER 43 -5.321 14.787 -2.705 356 HG SER 43 HG SER 43 -6.740 14.845 -4.373 357 H LEU 44 HN LEU 44 -2.484 12.101 -4.083 358 HA LEU 44 HA LEU 44 -0.656 13.592 -2.328 359 HB2 LEU 44 HB2 LEU 44 -0.044 11.420 -1.299 360 HB3 LEU 44 HB1 LEU 44 -1.693 11.916 -1.001 361 HG LEU 44 HG LEU 44 -2.175 10.344 -3.080 362 HD11 LEU 44 HD11 LEU 44 0.218 9.863 -3.453 363 HD12 LEU 44 HD12 LEU 44 -0.736 8.417 -3.131 364 HD13 LEU 44 HD13 LEU 44 0.284 9.098 -1.865 365 HD21 LEU 44 HD21 LEU 44 -3.135 10.118 -0.856 366 HD22 LEU 44 HD22 LEU 44 -1.650 9.361 -0.279 367 HD23 LEU 44 HD23 LEU 44 -2.642 8.548 -1.490 368 H LYS 45 HN LYS 45 -0.854 12.888 -5.347 369 HA LYS 45 HA LYS 45 1.599 11.441 -5.802 370 HB2 LYS 45 HB2 LYS 45 -0.338 11.665 -7.531 371 HB3 LYS 45 HB1 LYS 45 0.375 13.219 -7.957 372 HG2 LYS 45 HG2 LYS 45 2.379 12.234 -8.662 373 HG3 LYS 45 HG1 LYS 45 1.900 10.643 -8.040 374 HD2 LYS 45 HD2 LYS 45 0.231 10.402 -9.691 375 HD3 LYS 45 HD1 LYS 45 0.304 12.113 -10.122 376 HE2 LYS 45 HE2 LYS 45 1.424 10.898 -11.835 377 HE3 LYS 45 HE1 LYS 45 2.638 11.741 -10.873 378 HZ1 LYS 45 HZ1 LYS 45 3.087 9.669 -9.700 379 HZ2 LYS 45 HZ2 LYS 45 3.324 9.483 -11.361 380 HZ3 LYS 45 HZ3 LYS 45 1.930 8.867 -10.635 381 H ASN 46 HN ASN 46 1.156 14.322 -4.469 382 HA ASN 46 HA ASN 46 3.294 15.737 -5.852 383 HB2 ASN 46 HB2 ASN 46 1.148 16.848 -5.040 384 HB3 ASN 46 HB1 ASN 46 1.769 16.641 -3.408 385 HD21 ASN 46 HD21 ASN 46 3.675 17.398 -6.260 386 HD22 ASN 46 HD22 ASN 46 4.150 18.971 -5.741 387 H SER 47 HN SER 47 2.948 13.489 -3.421 388 HA SER 47 HA SER 47 4.932 14.424 -1.587 389 HB2 SER 47 HB2 SER 47 3.856 11.613 -1.979 390 HB3 SER 47 HB1 SER 47 4.722 12.220 -0.566 391 HG SER 47 HG SER 47 2.517 13.703 -1.276 392 H ASN 48 HN ASN 48 7.091 13.924 -1.483 393 HA ASN 48 HA ASN 48 8.516 13.139 -3.779 394 HB2 ASN 48 HB2 ASN 48 9.417 12.966 -0.886 395 HB3 ASN 48 HB1 ASN 48 10.465 12.980 -2.297 396 HD21 ASN 48 HD21 ASN 48 10.411 14.746 -0.016 397 HD22 ASN 48 HD22 ASN 48 10.168 16.342 -0.642 398 HA PRO 49 HA PRO 49 7.618 8.841 -3.815 399 HB2 PRO 49 HB2 PRO 49 9.894 7.984 -5.141 400 HB3 PRO 49 HB1 PRO 49 8.416 8.569 -5.902 401 HG2 PRO 49 HG2 PRO 49 10.988 9.983 -5.403 402 HG3 PRO 49 HG1 PRO 49 9.860 10.148 -6.757 403 HD2 PRO 49 HD2 PRO 49 10.032 11.971 -4.764 404 HD3 PRO 49 HD1 PRO 49 8.516 11.631 -5.620 405 H ASP 50 HN ASP 50 10.681 9.991 -2.546 406 HA ASP 50 HA ASP 50 11.415 7.468 -1.406 407 HB2 ASP 50 HB2 ASP 50 12.443 10.225 -0.716 408 HB3 ASP 50 HB1 ASP 50 13.183 8.704 -0.251 409 H GLU 51 HN GLU 51 9.522 10.196 -0.444 410 HA GLU 51 HA GLU 51 8.982 8.968 2.176 411 HB2 GLU 51 HB2 GLU 51 9.926 11.734 1.572 412 HB3 GLU 51 HB1 GLU 51 8.695 11.578 2.816 413 HG2 GLU 51 HG2 GLU 51 10.153 10.052 4.049 414 HG3 GLU 51 HG1 GLU 51 11.379 10.220 2.797 415 H ILE 52 HN ILE 52 7.085 8.213 0.810 416 HA ILE 52 HA ILE 52 5.402 10.275 -0.276 417 HB ILE 52 HB ILE 52 4.152 8.621 -1.320 418 HG12 ILE 52 HG12 ILE 52 5.260 6.399 0.299 419 HG13 ILE 52 HG11 ILE 52 3.914 7.350 0.937 420 HG21 ILE 52 HG21 ILE 52 6.798 7.241 -1.016 421 HG22 ILE 52 HG22 ILE 52 6.576 8.704 -1.987 422 HG23 ILE 52 HG23 ILE 52 5.712 7.225 -2.411 423 HD11 ILE 52 HD11 ILE 52 2.815 6.893 -1.335 424 HD12 ILE 52 HD12 ILE 52 2.866 5.598 -0.150 425 HD13 ILE 52 HD13 ILE 52 4.012 5.610 -1.488 426 H GLU 53 HN GLU 53 3.315 10.782 0.340 427 HA GLU 53 HA GLU 53 2.795 10.318 3.185 428 HB2 GLU 53 HB2 GLU 53 2.977 12.630 1.782 429 HB3 GLU 53 HB1 GLU 53 1.258 12.321 1.644 430 HG2 GLU 53 HG2 GLU 53 2.880 12.799 4.111 431 HG3 GLU 53 HG1 GLU 53 1.517 13.726 3.496 432 H ILE 54 HN ILE 54 1.461 8.601 3.434 433 HA ILE 54 HA ILE 54 -0.794 8.297 1.558 434 HB ILE 54 HB ILE 54 0.318 6.304 3.539 435 HG12 ILE 54 HG12 ILE 54 0.338 6.261 0.516 436 HG13 ILE 54 HG11 ILE 54 1.729 6.669 1.524 437 HG21 ILE 54 HG21 ILE 54 -1.236 4.739 2.346 438 HG22 ILE 54 HG22 ILE 54 -1.981 6.151 1.606 439 HG23 ILE 54 HG23 ILE 54 -2.025 5.946 3.357 440 HD11 ILE 54 HD11 ILE 54 1.744 4.347 0.689 441 HD12 ILE 54 HD12 ILE 54 0.269 4.042 1.603 442 HD13 ILE 54 HD13 ILE 54 1.760 4.456 2.443 443 H ASP 55 HN ASP 55 -2.859 8.553 2.229 444 HA ASP 55 HA ASP 55 -3.278 8.800 5.137 445 HB2 ASP 55 HB2 ASP 55 -3.567 10.967 3.861 446 HB3 ASP 55 HB1 ASP 55 -4.923 10.207 3.026 447 H PHE 56 HN PHE 56 -3.950 6.787 5.579 448 HA PHE 56 HA PHE 56 -5.333 5.166 3.730 449 HB2 PHE 56 HB2 PHE 56 -4.246 4.914 6.419 450 HB3 PHE 56 HB1 PHE 56 -5.692 3.938 6.158 451 HD1 PHE 56 HD2 PHE 56 -5.710 2.179 4.534 452 HD2 PHE 56 HD1 PHE 56 -2.198 4.461 5.216 453 HE1 PHE 56 HE2 PHE 56 -4.411 0.515 3.314 454 HE2 PHE 56 HE1 PHE 56 -0.878 2.788 3.987 455 HZ PHE 56 HZ PHE 56 -1.994 0.799 3.038 456 H GLU 57 HN GLU 57 -6.559 7.698 5.387 457 HA GLU 57 HA GLU 57 -9.158 6.450 5.854 458 HB2 GLU 57 HB2 GLU 57 -8.026 9.112 6.660 459 HB3 GLU 57 HB1 GLU 57 -9.652 8.562 7.058 460 HG2 GLU 57 HG2 GLU 57 -7.165 7.075 7.855 461 HG3 GLU 57 HG1 GLU 57 -7.910 8.312 8.859 462 H THR 58 HN THR 58 -7.591 7.884 3.368 463 HA THR 58 HA THR 58 -10.100 8.996 2.313 464 HB THR 58 HB THR 58 -8.702 10.670 1.046 465 HG1 THR 58 HG1 THR 58 -6.728 10.219 3.027 466 HG21 THR 58 HG21 THR 58 -8.667 10.789 4.054 467 HG22 THR 58 HG22 THR 58 -10.007 11.285 3.015 468 HG23 THR 58 HG23 THR 58 -8.481 12.174 2.978 469 H LEU 59 HN LEU 59 -7.394 6.960 1.799 470 HA LEU 59 HA LEU 59 -7.252 6.840 -0.994 471 HB2 LEU 59 HB2 LEU 59 -7.120 4.299 0.587 472 HB3 LEU 59 HB1 LEU 59 -6.187 4.786 -0.805 473 HG LEU 59 HG LEU 59 -5.822 5.751 2.024 474 HD11 LEU 59 HD11 LEU 59 -4.261 3.928 0.214 475 HD12 LEU 59 HD12 LEU 59 -4.892 3.614 1.832 476 HD13 LEU 59 HD13 LEU 59 -3.538 4.720 1.616 477 HD21 LEU 59 HD21 LEU 59 -4.594 6.694 -0.543 478 HD22 LEU 59 HD22 LEU 59 -3.770 6.871 0.996 479 HD23 LEU 59 HD23 LEU 59 -5.332 7.642 0.738 480 H LYS 60 HN LYS 60 -8.500 5.876 -2.542 481 HA LYS 60 HA LYS 60 -11.208 5.310 -2.057 482 HB2 LYS 60 HB2 LYS 60 -9.471 4.424 -4.372 483 HB3 LYS 60 HB1 LYS 60 -11.230 4.517 -4.380 484 HG2 LYS 60 HG2 LYS 60 -11.105 6.941 -4.110 485 HG3 LYS 60 HG1 LYS 60 -9.341 6.850 -4.067 486 HD2 LYS 60 HD2 LYS 60 -9.404 5.847 -6.345 487 HD3 LYS 60 HD1 LYS 60 -11.143 6.154 -6.379 488 HE2 LYS 60 HE2 LYS 60 -9.912 7.931 -7.513 489 HE3 LYS 60 HE1 LYS 60 -10.740 8.539 -6.081 490 HZ1 LYS 60 HZ1 LYS 60 -7.846 7.913 -6.338 491 HZ2 LYS 60 HZ2 LYS 60 -8.597 8.319 -4.877 492 HZ3 LYS 60 HZ3 LYS 60 -8.547 9.445 -6.144 493 HA PRO 61 HA PRO 61 -11.356 1.180 -0.502 494 HB2 PRO 61 HB2 PRO 61 -13.477 0.620 -2.493 495 HB3 PRO 61 HB1 PRO 61 -13.535 0.507 -0.734 496 HG2 PRO 61 HG2 PRO 61 -14.760 2.484 -2.102 497 HG3 PRO 61 HG1 PRO 61 -14.097 2.727 -0.479 498 HD2 PRO 61 HD2 PRO 61 -13.059 3.639 -3.111 499 HD3 PRO 61 HD1 PRO 61 -12.883 4.373 -1.504 500 H SER 62 HN SER 62 -11.448 1.628 -3.994 501 HA SER 62 HA SER 62 -10.608 -0.999 -4.669 502 HB2 SER 62 HB2 SER 62 -9.985 0.206 -6.872 503 HB3 SER 62 HB1 SER 62 -11.681 0.171 -6.395 504 HG SER 62 HG SER 62 -11.301 2.258 -6.890 505 H THR 63 HN THR 63 -8.939 2.010 -3.945 506 HA THR 63 HA THR 63 -6.351 1.205 -4.702 507 HB THR 63 HB THR 63 -6.929 3.125 -2.427 508 HG1 THR 63 HG1 THR 63 -7.058 4.709 -4.227 509 HG21 THR 63 HG21 THR 63 -4.571 2.514 -2.987 510 HG22 THR 63 HG22 THR 63 -4.932 4.226 -3.163 511 HG23 THR 63 HG23 THR 63 -4.821 3.197 -4.588 512 H LEU 64 HN LEU 64 -8.017 1.148 -1.568 513 HA LEU 64 HA LEU 64 -5.979 -0.026 -0.061 514 HB2 LEU 64 HB2 LEU 64 -8.980 -0.215 0.217 515 HB3 LEU 64 HB1 LEU 64 -7.855 -0.821 1.422 516 HG LEU 64 HG LEU 64 -8.002 2.063 0.554 517 HD11 LEU 64 HD11 LEU 64 -10.069 1.408 1.696 518 HD12 LEU 64 HD12 LEU 64 -9.091 2.472 2.700 519 HD13 LEU 64 HD13 LEU 64 -9.119 0.740 3.021 520 HD21 LEU 64 HD21 LEU 64 -5.837 1.507 1.394 521 HD22 LEU 64 HD22 LEU 64 -6.539 0.651 2.761 522 HD23 LEU 64 HD23 LEU 64 -6.705 2.402 2.637 523 H ARG 65 HN ARG 65 -8.584 -1.565 -1.912 524 HA ARG 65 HA ARG 65 -7.958 -4.205 -1.125 525 HB2 ARG 65 HB2 ARG 65 -10.123 -3.431 -2.155 526 HB3 ARG 65 HB1 ARG 65 -9.265 -3.293 -3.676 527 HG2 ARG 65 HG2 ARG 65 -10.671 -5.403 -3.258 528 HG3 ARG 65 HG1 ARG 65 -9.086 -5.559 -3.988 529 HD2 ARG 65 HD2 ARG 65 -8.154 -6.455 -2.008 530 HD3 ARG 65 HD1 ARG 65 -9.520 -5.958 -1.012 531 HE ARG 65 HE ARG 65 -10.164 -7.808 -3.142 532 HH11 ARG 65 HH11 ARG 65 -9.101 -7.531 0.193 533 HH12 ARG 65 HH12 ARG 65 -9.863 -9.014 0.681 534 HH21 ARG 65 HH21 ARG 65 -11.133 -9.766 -2.496 535 HH22 ARG 65 HH22 ARG 65 -10.992 -10.296 -0.850 536 H GLU 66 HN GLU 66 -6.698 -2.097 -3.607 537 HA GLU 66 HA GLU 66 -5.386 -4.172 -5.094 538 HB2 GLU 66 HB2 GLU 66 -6.074 -2.171 -6.235 539 HB3 GLU 66 HB1 GLU 66 -5.151 -1.160 -5.131 540 HG2 GLU 66 HG2 GLU 66 -3.999 -1.304 -7.219 541 HG3 GLU 66 HG1 GLU 66 -3.075 -2.185 -6.000 542 H LEU 67 HN LEU 67 -4.520 -1.841 -2.627 543 HA LEU 67 HA LEU 67 -1.739 -2.309 -2.582 544 HB2 LEU 67 HB2 LEU 67 -3.599 -1.467 -0.342 545 HB3 LEU 67 HB1 LEU 67 -1.866 -1.225 -0.367 546 HG LEU 67 HG LEU 67 -3.870 0.076 -2.207 547 HD11 LEU 67 HD11 LEU 67 -2.185 1.237 -0.001 548 HD12 LEU 67 HD12 LEU 67 -3.918 0.933 0.082 549 HD13 LEU 67 HD13 LEU 67 -3.283 2.125 -1.052 550 HD21 LEU 67 HD21 LEU 67 -1.675 -0.421 -3.258 551 HD22 LEU 67 HD22 LEU 67 -0.910 0.577 -2.020 552 HD23 LEU 67 HD23 LEU 67 -2.057 1.293 -3.151 553 H GLU 68 HN GLU 68 -4.453 -3.531 -0.694 554 HA GLU 68 HA GLU 68 -3.014 -5.275 0.994 555 HB2 GLU 68 HB2 GLU 68 -5.277 -4.435 1.470 556 HB3 GLU 68 HB1 GLU 68 -5.912 -5.386 0.134 557 HG2 GLU 68 HG2 GLU 68 -4.678 -7.311 1.516 558 HG3 GLU 68 HG1 GLU 68 -5.079 -6.210 2.828 559 H ARG 69 HN ARG 69 -4.964 -5.958 -1.918 560 HA ARG 69 HA ARG 69 -4.614 -8.728 -1.989 561 HB2 ARG 69 HB2 ARG 69 -6.225 -7.543 -3.421 562 HB3 ARG 69 HB1 ARG 69 -4.899 -6.886 -4.370 563 HG2 ARG 69 HG2 ARG 69 -4.250 -9.388 -4.663 564 HG3 ARG 69 HG1 ARG 69 -5.940 -9.668 -4.250 565 HD2 ARG 69 HD2 ARG 69 -5.611 -9.505 -6.676 566 HD3 ARG 69 HD1 ARG 69 -6.660 -8.233 -6.060 567 HE ARG 69 HE ARG 69 -4.734 -6.720 -6.228 568 HH11 ARG 69 HH11 ARG 69 -4.604 -9.720 -8.035 569 HH12 ARG 69 HH12 ARG 69 -3.510 -9.097 -9.225 570 HH21 ARG 69 HH21 ARG 69 -3.307 -5.894 -7.790 571 HH22 ARG 69 HH22 ARG 69 -2.773 -6.929 -9.088 572 H TYR 70 HN TYR 70 -2.545 -6.175 -3.156 573 HA TYR 70 HA TYR 70 -0.865 -7.927 -4.662 574 HB2 TYR 70 HB2 TYR 70 -0.932 -5.716 -5.463 575 HB3 TYR 70 HB1 TYR 70 -0.688 -5.035 -3.858 576 HD1 TYR 70 HD2 TYR 70 0.990 -6.805 -6.638 577 HD2 TYR 70 HD1 TYR 70 1.446 -4.675 -3.003 578 HE1 TYR 70 HE2 TYR 70 3.411 -6.670 -7.043 579 HE2 TYR 70 HE1 TYR 70 3.875 -4.518 -3.384 580 HH TYR 70 HH TYR 70 5.315 -5.321 -6.384 581 H VAL 71 HN VAL 71 -0.537 -6.237 -1.543 582 HA VAL 71 HA VAL 71 2.071 -7.183 -1.029 583 HB VAL 71 HB VAL 71 1.716 -6.511 1.289 584 HG11 VAL 71 HG11 VAL 71 0.516 -4.174 0.395 585 HG12 VAL 71 HG12 VAL 71 1.351 -4.827 -1.008 586 HG13 VAL 71 HG13 VAL 71 2.237 -4.515 0.484 587 HG21 VAL 71 HG21 VAL 71 -0.405 -7.085 1.917 588 HG22 VAL 71 HG22 VAL 71 -1.136 -6.435 0.447 589 HG23 VAL 71 HG23 VAL 71 -0.564 -5.340 1.708 590 H THR 72 HN THR 72 -1.113 -8.401 -0.026 591 HA THR 72 HA THR 72 -0.195 -10.420 1.667 592 HB THR 72 HB THR 72 -2.585 -9.598 1.429 593 HG1 THR 72 HG1 THR 72 -3.231 -11.420 2.386 594 HG21 THR 72 HG21 THR 72 -2.674 -9.965 -1.044 595 HG22 THR 72 HG22 THR 72 -4.034 -10.646 -0.151 596 HG23 THR 72 HG23 THR 72 -2.739 -11.697 -0.729 597 H SER 73 HN SER 73 -0.426 -10.266 -1.794 598 HA SER 73 HA SER 73 -0.013 -13.024 -2.271 599 HB2 SER 73 HB2 SER 73 0.370 -10.642 -4.007 600 HB3 SER 73 HB1 SER 73 0.442 -12.298 -4.588 601 HG SER 73 HG SER 73 -1.763 -10.832 -3.586 602 H CYS 74 HN CYS 74 2.044 -10.402 -1.453 603 HA CYS 74 HA CYS 74 4.452 -11.814 -2.276 604 HB2 CYS 74 HB2 CYS 74 4.345 -9.376 -2.602 605 HB3 CYS 74 HB1 CYS 74 4.136 -9.146 -0.866 606 HG CYS 74 HG CYS 74 6.853 -10.930 -1.577 607 H LEU 75 HN LEU 75 3.065 -10.510 0.743 608 HA LEU 75 HA LEU 75 4.835 -11.485 2.601 609 HB2 LEU 75 HB2 LEU 75 1.895 -11.625 3.145 610 HB3 LEU 75 HB1 LEU 75 3.191 -11.140 4.213 611 HG LEU 75 HG LEU 75 2.300 -9.498 1.865 612 HD11 LEU 75 HD11 LEU 75 1.629 -8.935 4.718 613 HD12 LEU 75 HD12 LEU 75 0.588 -9.953 3.726 614 HD13 LEU 75 HD13 LEU 75 0.902 -8.287 3.248 615 HD21 LEU 75 HD21 LEU 75 4.600 -9.187 2.738 616 HD22 LEU 75 HD22 LEU 75 3.905 -8.772 4.303 617 HD23 LEU 75 HD23 LEU 75 3.578 -7.760 2.894 618 H ARG 76 HN ARG 76 2.143 -13.186 1.071 619 HA ARG 76 HA ARG 76 2.502 -15.522 2.728 620 HB2 ARG 76 HB2 ARG 76 0.631 -14.874 0.465 621 HB3 ARG 76 HB1 ARG 76 0.669 -16.449 1.249 622 HG2 ARG 76 HG2 ARG 76 -0.017 -15.530 3.318 623 HG3 ARG 76 HG1 ARG 76 0.232 -13.881 2.740 624 HD2 ARG 76 HD2 ARG 76 -2.138 -14.489 2.763 625 HD3 ARG 76 HD1 ARG 76 -1.559 -14.151 1.131 626 HE ARG 76 HE ARG 76 -1.285 -16.821 1.301 627 HH11 ARG 76 HH11 ARG 76 -3.974 -14.703 2.040 628 HH12 ARG 76 HH12 ARG 76 -5.174 -15.877 1.605 629 HH21 ARG 76 HH21 ARG 76 -2.859 -18.358 0.734 630 HH22 ARG 76 HH22 ARG 76 -4.540 -17.955 0.857 631 H LYS 77 HN LYS 77 4.410 -14.476 0.445 632 HA LYS 77 HA LYS 77 4.989 -17.173 -0.527 633 HB2 LYS 77 HB2 LYS 77 4.655 -14.715 -2.217 634 HB3 LYS 77 HB1 LYS 77 5.628 -16.077 -2.756 635 HG2 LYS 77 HG2 LYS 77 3.763 -17.544 -2.686 636 HG3 LYS 77 HG1 LYS 77 2.772 -16.329 -1.885 637 HD2 LYS 77 HD2 LYS 77 2.998 -14.907 -3.921 638 HD3 LYS 77 HD1 LYS 77 3.842 -16.244 -4.704 639 HE2 LYS 77 HE2 LYS 77 1.014 -16.280 -3.652 640 HE3 LYS 77 HE1 LYS 77 1.495 -16.214 -5.346 641 HZ1 LYS 77 HZ1 LYS 77 0.902 -18.449 -4.748 642 HZ2 LYS 77 HZ2 LYS 77 1.997 -18.452 -3.462 643 HZ3 LYS 77 HZ3 LYS 77 2.563 -18.386 -5.054 644 H LYS 78 HN LYS 78 7.195 -16.323 -2.181 645 HA LYS 78 HA LYS 78 9.182 -16.102 -0.149 646 HB2 LYS 78 HB2 LYS 78 9.308 -16.133 -3.156 647 HB3 LYS 78 HB1 LYS 78 10.739 -15.861 -2.181 648 HG2 LYS 78 HG2 LYS 78 10.585 -18.180 -2.865 649 HG3 LYS 78 HG1 LYS 78 10.441 -18.034 -1.115 650 HD2 LYS 78 HD2 LYS 78 8.047 -18.301 -1.250 651 HD3 LYS 78 HD1 LYS 78 8.116 -18.319 -3.014 652 HE2 LYS 78 HE2 LYS 78 7.889 -20.578 -2.191 653 HE3 LYS 78 HE1 LYS 78 9.479 -20.368 -2.918 654 HZ1 LYS 78 HZ1 LYS 78 10.385 -20.062 -0.674 655 HZ2 LYS 78 HZ2 LYS 78 9.671 -21.580 -0.872 656 HZ3 LYS 78 HZ3 LYS 78 8.858 -20.369 -0.017 657 H ARG 79 HN ARG 79 9.334 -14.210 0.909 658 HA ARG 79 HA ARG 79 9.018 -11.732 -0.606 659 HB2 ARG 79 HB2 ARG 79 9.138 -10.828 1.911 660 HB3 ARG 79 HB1 ARG 79 7.654 -11.393 1.164 661 HG2 ARG 79 HG2 ARG 79 7.683 -12.382 3.276 662 HG3 ARG 79 HG1 ARG 79 8.188 -13.661 2.177 663 HD2 ARG 79 HD2 ARG 79 9.593 -13.729 4.113 664 HD3 ARG 79 HD1 ARG 79 10.552 -13.139 2.757 665 HE ARG 79 HE ARG 79 9.448 -10.960 4.161 666 HH11 ARG 79 HH11 ARG 79 11.891 -13.435 4.504 667 HH12 ARG 79 HH12 ARG 79 12.893 -12.481 5.548 668 HH21 ARG 79 HH21 ARG 79 10.741 -9.707 5.541 669 HH22 ARG 79 HH22 ARG 79 12.233 -10.352 6.148 670 H LYS 80 HN LYS 80 11.029 -11.861 -1.631 671 HA LYS 80 HA LYS 80 13.046 -10.274 -0.537 672 HB2 LYS 80 HB2 LYS 80 13.543 -12.234 0.922 673 HB3 LYS 80 HB1 LYS 80 13.803 -13.212 -0.519 674 HG2 LYS 80 HG2 LYS 80 15.664 -11.724 -1.156 675 HG3 LYS 80 HG1 LYS 80 15.415 -10.816 0.335 676 HD2 LYS 80 HD2 LYS 80 16.080 -13.758 0.202 677 HD3 LYS 80 HD1 LYS 80 17.256 -12.474 0.484 678 HE2 LYS 80 HE2 LYS 80 16.083 -11.834 2.524 679 HE3 LYS 80 HE1 LYS 80 14.873 -13.082 2.234 680 HZ1 LYS 80 HZ1 LYS 80 16.580 -14.759 2.454 681 HZ2 LYS 80 HZ2 LYS 80 16.558 -13.790 3.837 682 HZ3 LYS 80 HZ3 LYS 80 17.765 -13.580 2.677 683 HA PRO 81 HA PRO 81 13.035 -11.046 -5.117 684 HB2 PRO 81 HB2 PRO 81 13.001 -8.458 -5.865 685 HB3 PRO 81 HB1 PRO 81 11.528 -9.322 -5.410 686 HG2 PRO 81 HG2 PRO 81 13.219 -7.477 -3.764 687 HG3 PRO 81 HG1 PRO 81 11.454 -7.512 -3.936 688 HD2 PRO 81 HD2 PRO 81 12.712 -8.617 -1.823 689 HD3 PRO 81 HD1 PRO 81 11.219 -9.304 -2.503 690 H GLN 82 HN GLN 82 15.314 -11.489 -3.769 691 HA GLN 82 HA GLN 82 17.266 -10.227 -5.491 692 HB2 GLN 82 HB2 GLN 82 17.139 -8.685 -3.551 693 HB3 GLN 82 HB1 GLN 82 17.557 -10.022 -2.488 694 HG2 GLN 82 HG2 GLN 82 19.713 -10.244 -3.549 695 HG3 GLN 82 HG1 GLN 82 19.294 -8.990 -4.716 696 HE21 GLN 82 HE21 GLN 82 19.218 -6.845 -4.051 697 HE22 GLN 82 HE22 GLN 82 19.963 -6.319 -2.581 698 H ALA 83 HN ALA 83 18.867 -11.592 -5.981 699 HA ALA 83 HA ALA 83 18.944 -14.154 -4.546 700 HB1 ALA 83 HB1 ALA 83 19.870 -15.109 -6.588 701 HB2 ALA 83 HB2 ALA 83 19.851 -13.522 -7.355 702 HB3 ALA 83 HB3 ALA 83 18.334 -14.308 -6.918 703 H1 GLU 201 HT1 GLU 201 -8.399 8.250 12.118 704 H2 GLU 201 HT2 GLU 201 -7.406 7.066 12.805 705 H3 GLU 201 HT3 GLU 201 -8.022 6.853 11.239 706 HA GLU 201 HA GLU 201 -6.722 8.618 10.387 707 HB2 GLU 201 HB2 GLU 201 -5.875 9.016 13.256 708 HB3 GLU 201 HB1 GLU 201 -5.103 9.794 11.882 709 HG2 GLU 201 HG2 GLU 201 -7.267 10.837 11.310 710 HG3 GLU 201 HG1 GLU 201 -7.952 10.135 12.775 711 H ILE 202 HN ILE 202 -5.379 7.459 9.212 712 HA ILE 202 HA ILE 202 -3.233 5.961 10.526 713 HB ILE 202 HB ILE 202 -5.058 4.808 8.405 714 HG12 ILE 202 HG12 ILE 202 -5.901 4.661 10.731 715 HG13 ILE 202 HG11 ILE 202 -5.565 3.081 10.027 716 HG21 ILE 202 HG21 ILE 202 -2.743 4.245 7.906 717 HG22 ILE 202 HG22 ILE 202 -3.624 2.820 8.456 718 HG23 ILE 202 HG23 ILE 202 -2.519 3.649 9.551 719 HD11 ILE 202 HD11 ILE 202 -3.413 3.045 11.239 720 HD12 ILE 202 HD12 ILE 202 -4.816 3.123 12.304 721 HD13 ILE 202 HD13 ILE 202 -3.855 4.570 12.004 722 H LYS 203 HN LYS 203 -1.394 6.713 9.706 723 HA LYS 203 HA LYS 203 -1.351 7.602 6.896 724 HB2 LYS 203 HB2 LYS 203 0.459 8.422 9.178 725 HB3 LYS 203 HB1 LYS 203 0.581 8.993 7.520 726 HG2 LYS 203 HG2 LYS 203 -1.600 10.052 7.714 727 HG3 LYS 203 HG1 LYS 203 -1.744 9.463 9.368 728 HD2 LYS 203 HD2 LYS 203 0.263 10.742 9.980 729 HD3 LYS 203 HD1 LYS 203 0.363 11.350 8.327 730 HE2 LYS 203 HE2 LYS 203 -0.682 13.020 9.695 731 HE3 LYS 203 HE1 LYS 203 -1.895 12.340 8.613 732 HZ1 LYS 203 HZ1 LYS 203 -2.832 12.524 10.774 733 HZ2 LYS 203 HZ2 LYS 203 -1.524 11.727 11.488 734 HZ3 LYS 203 HZ3 LYS 203 -2.579 10.878 10.477 735 H LEU 204 HN LEU 204 0.777 7.296 5.809 736 HA LEU 204 HA LEU 204 2.566 5.348 6.988 737 HB2 LEU 204 HB2 LEU 204 0.588 4.360 5.375 738 HB3 LEU 204 HB1 LEU 204 1.881 4.637 4.226 739 HG LEU 204 HG LEU 204 1.925 2.821 6.633 740 HD11 LEU 204 HD11 LEU 204 2.401 2.230 3.721 741 HD12 LEU 204 HD12 LEU 204 0.863 2.001 4.548 742 HD13 LEU 204 HD13 LEU 204 2.276 1.071 5.042 743 HD21 LEU 204 HD21 LEU 204 4.246 3.340 4.788 744 HD22 LEU 204 HD22 LEU 204 4.215 2.340 6.239 745 HD23 LEU 204 HD23 LEU 204 4.074 4.092 6.373 746 H LYS 205 HN LYS 205 4.140 6.924 6.916 747 HA LYS 205 HA LYS 205 4.966 8.052 4.393 748 HB2 LYS 205 HB2 LYS 205 6.156 8.030 7.162 749 HB3 LYS 205 HB1 LYS 205 7.050 8.654 5.787 750 HG2 LYS 205 HG2 LYS 205 4.381 9.686 6.719 751 HG3 LYS 205 HG1 LYS 205 5.945 10.409 7.103 752 HD2 LYS 205 HD2 LYS 205 6.292 10.501 4.558 753 HD3 LYS 205 HD1 LYS 205 4.554 10.220 4.451 754 HE2 LYS 205 HE2 LYS 205 5.967 12.523 5.778 755 HE3 LYS 205 HE1 LYS 205 4.935 12.573 4.352 756 HZ1 LYS 205 HZ1 LYS 205 3.072 11.834 5.783 757 HZ2 LYS 205 HZ2 LYS 205 3.699 13.346 6.221 758 HZ3 LYS 205 HZ3 LYS 205 4.089 11.979 7.132 759 H ILE 206 HN ILE 206 5.112 5.978 3.241 760 HA ILE 206 HA ILE 206 7.006 4.013 4.054 761 HB ILE 206 HB ILE 206 6.423 4.373 1.136 762 HG12 ILE 206 HG12 ILE 206 4.504 2.873 2.899 763 HG13 ILE 206 HG11 ILE 206 4.211 4.565 2.470 764 HG21 ILE 206 HG21 ILE 206 6.107 1.745 2.279 765 HG22 ILE 206 HG22 ILE 206 7.642 2.483 2.781 766 HG23 ILE 206 HG23 ILE 206 7.267 2.323 1.066 767 HD11 ILE 206 HD11 ILE 206 4.856 2.822 0.203 768 HD12 ILE 206 HD12 ILE 206 3.588 4.022 0.390 769 HD13 ILE 206 HD13 ILE 206 3.367 2.407 1.049 770 H THR 207 HN THR 207 9.166 4.236 4.054 771 HA THR 207 HA THR 207 10.350 6.244 2.269 772 HB THR 207 HB THR 207 12.390 5.945 3.754 773 HG1 THR 207 HG1 THR 207 11.497 3.899 4.652 774 HG21 THR 207 HG21 THR 207 9.846 6.949 5.037 775 HG22 THR 207 HG22 THR 207 10.895 7.870 3.958 776 HG23 THR 207 HG23 THR 207 11.485 7.361 5.540 777 H LYS 208 HN LYS 208 11.152 5.482 0.430 778 HA LYS 208 HA LYS 208 13.090 3.488 0.320 779 HB2 LYS 208 HB2 LYS 208 12.052 1.626 -0.698 780 HB3 LYS 208 HB1 LYS 208 11.070 2.026 0.694 781 HG2 LYS 208 HG2 LYS 208 10.412 2.745 -2.157 782 HG3 LYS 208 HG1 LYS 208 9.753 1.376 -1.273 783 HD2 LYS 208 HD2 LYS 208 8.076 2.824 -0.844 784 HD3 LYS 208 HD1 LYS 208 9.165 3.390 0.424 785 HE2 LYS 208 HE2 LYS 208 10.075 5.051 -1.143 786 HE3 LYS 208 HE1 LYS 208 8.909 4.520 -2.350 787 HZ1 LYS 208 HZ1 LYS 208 7.130 5.216 -0.915 788 HZ2 LYS 208 HZ2 LYS 208 8.200 6.500 -1.191 789 HZ3 LYS 208 HZ3 LYS 208 8.230 5.678 0.292 790 H THR 209 HN THR 209 12.521 2.571 -2.367 791 HA THR 209 HA THR 209 12.953 3.104 -4.497 792 HB THR 209 HB THR 209 11.928 5.137 -5.504 793 HG1 THR 209 HG1 THR 209 11.913 6.039 -3.035 794 HG21 THR 209 HG21 THR 209 10.003 3.646 -3.741 795 HG22 THR 209 HG22 THR 209 10.706 2.977 -5.213 796 HG23 THR 209 HG23 THR 209 9.667 4.400 -5.299 797 H ILE 210 HN ILE 210 15.141 3.249 -3.317 798 HA ILE 210 HA ILE 210 16.383 5.863 -3.634 799 HB ILE 210 HB ILE 210 17.010 4.423 -1.713 800 HG12 ILE 210 HG12 ILE 210 19.277 4.925 -3.653 801 HG13 ILE 210 HG11 ILE 210 18.572 6.128 -2.580 802 HG21 ILE 210 HG21 ILE 210 18.169 2.613 -3.827 803 HG22 ILE 210 HG22 ILE 210 16.827 2.244 -2.745 804 HG23 ILE 210 HG23 ILE 210 18.451 2.461 -2.093 805 HD11 ILE 210 HD11 ILE 210 19.319 4.838 -0.648 806 HD12 ILE 210 HD12 ILE 210 20.666 5.283 -1.697 807 HD13 ILE 210 HD13 ILE 210 20.031 3.638 -1.727 808 H GLN 211 HN GLN 211 15.818 3.010 -5.395 809 HA GLN 211 HA GLN 211 17.901 3.581 -7.362 810 HB2 GLN 211 HB2 GLN 211 15.891 1.331 -7.168 811 HB3 GLN 211 HB1 GLN 211 17.076 1.496 -8.455 812 HG2 GLN 211 HG2 GLN 211 17.712 1.166 -5.532 813 HG3 GLN 211 HG1 GLN 211 17.770 -0.110 -6.746 814 HE21 GLN 211 HE21 GLN 211 19.301 2.760 -5.529 815 HE22 GLN 211 HE22 GLN 211 20.780 2.579 -6.401 816 H ASN 212 HN ASN 212 17.328 5.293 -8.553 817 HA ASN 212 HA ASN 212 14.564 5.627 -9.413 818 HB2 ASN 212 HB2 ASN 212 16.965 7.442 -9.757 819 HB3 ASN 212 HB1 ASN 212 15.312 7.841 -10.208 820 HD21 ASN 212 HD21 ASN 212 13.803 8.258 -8.609 821 HD22 ASN 212 HD22 ASN 212 14.261 8.612 -6.980 Start of MODEL 7 1 H1 SER 1 HT1 SER 1 -14.409 -3.409 -15.111 2 H2 SER 1 HT2 SER 1 -15.695 -4.431 -14.724 3 H3 SER 1 HT3 SER 1 -14.718 -3.800 -13.492 4 HA SER 1 HA SER 1 -15.457 -1.578 -14.007 5 HB2 SER 1 HB2 SER 1 -17.501 -2.842 -15.825 6 HB3 SER 1 HB1 SER 1 -17.064 -1.135 -15.681 7 HG SER 1 HG SER 1 -16.091 -1.920 -17.518 8 H GLU 2 HN GLU 2 -16.811 -4.651 -13.278 9 HA GLU 2 HA GLU 2 -19.028 -3.408 -11.840 10 HB2 GLU 2 HB2 GLU 2 -19.861 -5.756 -11.551 11 HB3 GLU 2 HB1 GLU 2 -19.818 -5.178 -13.202 12 HG2 GLU 2 HG2 GLU 2 -17.766 -6.429 -13.596 13 HG3 GLU 2 HG1 GLU 2 -17.787 -6.994 -11.926 14 H GLU 3 HN GLU 3 -16.550 -5.935 -11.195 15 HA GLU 3 HA GLU 3 -17.358 -5.986 -8.441 16 HB2 GLU 3 HB2 GLU 3 -15.786 -7.822 -8.189 17 HB3 GLU 3 HB1 GLU 3 -16.851 -8.065 -9.567 18 HG2 GLU 3 HG2 GLU 3 -15.153 -7.474 -11.093 19 HG3 GLU 3 HG1 GLU 3 -14.127 -6.894 -9.788 20 H GLU 4 HN GLU 4 -14.638 -4.677 -10.211 21 HA GLU 4 HA GLU 4 -13.195 -4.184 -7.723 22 HB2 GLU 4 HB2 GLU 4 -11.365 -3.388 -9.060 23 HB3 GLU 4 HB1 GLU 4 -11.940 -4.886 -9.768 24 HG2 GLU 4 HG2 GLU 4 -12.629 -2.130 -10.770 25 HG3 GLU 4 HG1 GLU 4 -11.363 -3.159 -11.430 26 H ASP 5 HN ASP 5 -15.326 -2.636 -9.871 27 HA ASP 5 HA ASP 5 -14.696 0.051 -9.007 28 HB2 ASP 5 HB2 ASP 5 -15.467 -0.275 -11.281 29 HB3 ASP 5 HB1 ASP 5 -16.931 -1.068 -10.730 30 H LYS 6 HN LYS 6 -16.554 -2.539 -7.851 31 HA LYS 6 HA LYS 6 -18.320 -0.744 -6.330 32 HB2 LYS 6 HB2 LYS 6 -19.294 -2.459 -7.968 33 HB3 LYS 6 HB1 LYS 6 -18.800 -3.678 -6.805 34 HG2 LYS 6 HG2 LYS 6 -21.080 -3.224 -6.397 35 HG3 LYS 6 HG1 LYS 6 -20.182 -2.438 -5.098 36 HD2 LYS 6 HD2 LYS 6 -20.395 -0.302 -6.177 37 HD3 LYS 6 HD1 LYS 6 -21.138 -1.043 -7.596 38 HE2 LYS 6 HE2 LYS 6 -22.286 -1.017 -4.803 39 HE3 LYS 6 HE1 LYS 6 -22.799 0.022 -6.128 40 HZ1 LYS 6 HZ1 LYS 6 -22.957 -2.943 -6.165 41 HZ2 LYS 6 HZ2 LYS 6 -23.571 -1.881 -7.329 42 HZ3 LYS 6 HZ3 LYS 6 -24.247 -1.920 -5.782 43 H CYS 7 HN CYS 7 -15.583 -1.464 -5.663 44 HA CYS 7 HA CYS 7 -15.642 -3.509 -3.666 45 HB2 CYS 7 HB2 CYS 7 -13.284 -2.410 -3.146 46 HB3 CYS 7 HB1 CYS 7 -13.528 -3.225 -4.699 47 HG CYS 7 HG CYS 7 -13.124 -1.182 -6.219 48 H LYS 8 HN LYS 8 -15.828 -3.301 -1.492 49 HA LYS 8 HA LYS 8 -16.792 -0.735 -0.502 50 HB2 LYS 8 HB2 LYS 8 -17.026 -3.573 0.406 51 HB3 LYS 8 HB1 LYS 8 -17.193 -2.291 1.594 52 HG2 LYS 8 HG2 LYS 8 -19.360 -2.968 0.789 53 HG3 LYS 8 HG1 LYS 8 -19.012 -1.318 0.281 54 HD2 LYS 8 HD2 LYS 8 -18.287 -2.242 -1.930 55 HD3 LYS 8 HD1 LYS 8 -18.868 -3.819 -1.395 56 HE2 LYS 8 HE2 LYS 8 -20.545 -2.715 -2.757 57 HE3 LYS 8 HE1 LYS 8 -21.111 -2.877 -1.096 58 HZ1 LYS 8 HZ1 LYS 8 -21.614 -0.695 -1.949 59 HZ2 LYS 8 HZ2 LYS 8 -19.993 -0.419 -2.330 60 HZ3 LYS 8 HZ3 LYS 8 -20.466 -0.564 -0.716 61 HA PRO 9 HA PRO 9 -13.079 0.240 1.686 62 HB2 PRO 9 HB2 PRO 9 -14.675 1.175 3.948 63 HB3 PRO 9 HB1 PRO 9 -13.600 2.081 2.881 64 HG2 PRO 9 HG2 PRO 9 -16.298 2.341 2.812 65 HG3 PRO 9 HG1 PRO 9 -15.267 2.571 1.390 66 HD2 PRO 9 HD2 PRO 9 -17.001 0.263 2.125 67 HD3 PRO 9 HD1 PRO 9 -16.611 0.921 0.524 68 H MET 10 HN MET 10 -11.775 -0.800 3.056 69 HA MET 10 HA MET 10 -12.854 -2.939 4.661 70 HB2 MET 10 HB2 MET 10 -10.483 -3.451 5.144 71 HB3 MET 10 HB1 MET 10 -10.822 -3.365 3.426 72 HG2 MET 10 HG2 MET 10 -9.886 -1.109 3.361 73 HG3 MET 10 HG1 MET 10 -9.504 -1.240 5.075 74 HE1 MET 10 HE1 MET 10 -8.931 -2.818 1.547 75 HE2 MET 10 HE2 MET 10 -9.219 -4.259 2.523 76 HE3 MET 10 HE3 MET 10 -7.616 -3.951 1.854 77 H SER 11 HN SER 11 -12.231 -3.181 6.921 78 HA SER 11 HA SER 11 -13.098 -0.888 8.355 79 HB2 SER 11 HB2 SER 11 -12.834 -2.364 10.355 80 HB3 SER 11 HB1 SER 11 -13.800 -3.083 9.066 81 HG SER 11 HG SER 11 -11.979 -4.291 8.438 82 H TYR 12 HN TYR 12 -11.948 -0.407 10.557 83 HA TYR 12 HA TYR 12 -9.573 0.982 9.993 84 HB2 TYR 12 HB2 TYR 12 -11.142 1.519 11.848 85 HB3 TYR 12 HB1 TYR 12 -10.583 0.082 12.708 86 HD1 TYR 12 HD1 TYR 12 -8.057 -0.013 13.250 87 HD2 TYR 12 HD2 TYR 12 -10.083 3.566 12.193 88 HE1 TYR 12 HE1 TYR 12 -6.278 1.297 14.321 89 HE2 TYR 12 HE2 TYR 12 -8.300 4.892 13.254 90 HH TYR 12 HH TYR 12 -5.320 3.527 14.219 91 H GLU 13 HN GLU 13 -10.080 -2.178 11.527 92 HA GLU 13 HA GLU 13 -7.421 -2.683 12.255 93 HB2 GLU 13 HB2 GLU 13 -9.364 -4.044 13.006 94 HB3 GLU 13 HB1 GLU 13 -9.486 -4.720 11.386 95 HG2 GLU 13 HG2 GLU 13 -7.294 -5.716 11.601 96 HG3 GLU 13 HG1 GLU 13 -7.092 -4.982 13.190 97 H GLU 14 HN GLU 14 -9.121 -3.085 9.225 98 HA GLU 14 HA GLU 14 -7.054 -4.650 7.992 99 HB2 GLU 14 HB2 GLU 14 -9.480 -3.254 6.866 100 HB3 GLU 14 HB1 GLU 14 -8.394 -4.248 5.906 101 HG2 GLU 14 HG2 GLU 14 -8.988 -6.209 7.108 102 HG3 GLU 14 HG1 GLU 14 -9.856 -5.268 8.325 103 H LYS 15 HN LYS 15 -8.156 -1.277 7.711 104 HA LYS 15 HA LYS 15 -6.257 -0.422 5.855 105 HB2 LYS 15 HB2 LYS 15 -7.670 1.054 8.077 106 HB3 LYS 15 HB1 LYS 15 -6.615 1.851 6.924 107 HG2 LYS 15 HG2 LYS 15 -8.059 1.431 5.124 108 HG3 LYS 15 HG1 LYS 15 -8.966 0.223 6.047 109 HD2 LYS 15 HD2 LYS 15 -9.981 1.839 7.398 110 HD3 LYS 15 HD1 LYS 15 -8.856 3.106 6.929 111 HE2 LYS 15 HE2 LYS 15 -10.130 2.219 4.569 112 HE3 LYS 15 HE1 LYS 15 -11.388 2.345 5.794 113 HZ1 LYS 15 HZ1 LYS 15 -11.160 4.443 4.691 114 HZ2 LYS 15 HZ2 LYS 15 -9.495 4.485 4.994 115 HZ3 LYS 15 HZ3 LYS 15 -10.589 4.611 6.281 116 H ARG 16 HN ARG 16 -6.112 -0.480 9.401 117 HA ARG 16 HA ARG 16 -3.519 0.566 9.686 118 HB2 ARG 16 HB2 ARG 16 -5.090 0.264 11.574 119 HB3 ARG 16 HB1 ARG 16 -4.899 -1.484 11.435 120 HG2 ARG 16 HG2 ARG 16 -2.334 -0.828 11.699 121 HG3 ARG 16 HG1 ARG 16 -3.047 0.551 12.536 122 HD2 ARG 16 HD2 ARG 16 -2.601 -1.151 14.156 123 HD3 ARG 16 HD1 ARG 16 -4.346 -1.056 13.928 124 HE ARG 16 HE ARG 16 -2.875 -3.067 12.402 125 HH11 ARG 16 HH11 ARG 16 -5.024 -2.304 15.050 126 HH12 ARG 16 HH12 ARG 16 -5.547 -3.943 15.269 127 HH21 ARG 16 HH21 ARG 16 -3.549 -5.241 12.686 128 HH22 ARG 16 HH22 ARG 16 -4.709 -5.615 13.924 129 H GLN 17 HN GLN 17 -4.663 -2.778 9.351 130 HA GLN 17 HA GLN 17 -2.152 -3.995 9.645 131 HB2 GLN 17 HB2 GLN 17 -4.490 -5.042 9.801 132 HB3 GLN 17 HB1 GLN 17 -4.425 -5.142 8.047 133 HG2 GLN 17 HG2 GLN 17 -3.776 -7.244 9.030 134 HG3 GLN 17 HG1 GLN 17 -2.400 -6.503 8.210 135 HE21 GLN 17 HE21 GLN 17 -0.936 -7.698 9.445 136 HE22 GLN 17 HE22 GLN 17 -0.630 -7.333 11.108 137 H LEU 18 HN LEU 18 -3.739 -2.506 6.983 138 HA LEU 18 HA LEU 18 -2.128 -3.638 4.911 139 HB2 LEU 18 HB2 LEU 18 -4.445 -2.165 5.028 140 HB3 LEU 18 HB1 LEU 18 -3.293 -0.978 4.456 141 HG LEU 18 HG LEU 18 -3.694 -3.640 3.105 142 HD11 LEU 18 HD11 LEU 18 -5.009 -1.003 2.523 143 HD12 LEU 18 HD12 LEU 18 -5.804 -2.475 3.068 144 HD13 LEU 18 HD13 LEU 18 -5.060 -2.411 1.471 145 HD21 LEU 18 HD21 LEU 18 -1.645 -2.704 2.435 146 HD22 LEU 18 HD22 LEU 18 -2.319 -1.083 2.350 147 HD23 LEU 18 HD23 LEU 18 -2.786 -2.297 1.162 148 H SER 19 HN SER 19 -2.061 -0.653 6.796 149 HA SER 19 HA SER 19 0.278 0.432 5.707 150 HB2 SER 19 HB2 SER 19 -1.124 1.683 7.287 151 HB3 SER 19 HB1 SER 19 -0.738 0.535 8.567 152 HG SER 19 HG SER 19 0.554 2.378 8.750 153 H LEU 20 HN LEU 20 -0.260 -2.116 8.012 154 HA LEU 20 HA LEU 20 2.489 -2.408 8.739 155 HB2 LEU 20 HB2 LEU 20 0.062 -4.112 9.209 156 HB3 LEU 20 HB1 LEU 20 1.646 -4.516 9.822 157 HG LEU 20 HG LEU 20 0.164 -1.990 10.524 158 HD11 LEU 20 HD11 LEU 20 -0.772 -4.267 11.261 159 HD12 LEU 20 HD12 LEU 20 -0.554 -3.010 12.477 160 HD13 LEU 20 HD13 LEU 20 0.620 -4.322 12.340 161 HD21 LEU 20 HD21 LEU 20 2.688 -1.995 10.633 162 HD22 LEU 20 HD22 LEU 20 2.550 -3.240 11.870 163 HD23 LEU 20 HD23 LEU 20 1.859 -1.642 12.145 164 H ASP 21 HN ASP 21 0.356 -3.851 6.344 165 HA ASP 21 HA ASP 21 2.152 -6.040 5.871 166 HB2 ASP 21 HB2 ASP 21 0.591 -6.738 4.122 167 HB3 ASP 21 HB1 ASP 21 -0.211 -6.447 5.651 168 H ILE 22 HN ILE 22 1.513 -2.940 4.317 169 HA ILE 22 HA ILE 22 3.251 -3.459 2.108 170 HB ILE 22 HB ILE 22 2.316 -0.851 3.305 171 HG12 ILE 22 HG12 ILE 22 1.554 -2.100 0.662 172 HG13 ILE 22 HG11 ILE 22 0.659 -2.433 2.150 173 HG21 ILE 22 HG21 ILE 22 4.271 -0.204 2.260 174 HG22 ILE 22 HG22 ILE 22 3.046 0.039 1.012 175 HG23 ILE 22 HG23 ILE 22 4.084 -1.385 0.966 176 HD11 ILE 22 HD11 ILE 22 0.268 -0.023 2.358 177 HD12 ILE 22 HD12 ILE 22 -0.453 -0.722 0.919 178 HD13 ILE 22 HD13 ILE 22 1.033 0.224 0.798 179 H ASN 23 HN ASN 23 3.663 -2.144 5.327 180 HA ASN 23 HA ASN 23 6.327 -1.299 5.054 181 HB2 ASN 23 HB2 ASN 23 5.042 -0.518 6.895 182 HB3 ASN 23 HB1 ASN 23 4.688 -2.150 7.439 183 HD21 ASN 23 HD21 ASN 23 6.235 -3.204 8.750 184 HD22 ASN 23 HD22 ASN 23 7.677 -2.425 9.334 185 H LYS 24 HN LYS 24 4.945 -4.425 5.170 186 HA LYS 24 HA LYS 24 7.293 -5.792 6.134 187 HB2 LYS 24 HB2 LYS 24 4.742 -6.743 4.846 188 HB3 LYS 24 HB1 LYS 24 6.044 -7.837 5.302 189 HG2 LYS 24 HG2 LYS 24 5.797 -7.182 7.624 190 HG3 LYS 24 HG1 LYS 24 4.546 -6.019 7.182 191 HD2 LYS 24 HD2 LYS 24 3.177 -7.887 6.311 192 HD3 LYS 24 HD1 LYS 24 4.411 -9.017 6.869 193 HE2 LYS 24 HE2 LYS 24 2.844 -7.116 8.610 194 HE3 LYS 24 HE1 LYS 24 2.548 -8.846 8.453 195 HZ1 LYS 24 HZ1 LYS 24 5.060 -7.635 9.475 196 HZ2 LYS 24 HZ2 LYS 24 4.713 -9.287 9.389 197 HZ3 LYS 24 HZ3 LYS 24 3.834 -8.292 10.438 198 H LEU 25 HN LEU 25 5.987 -4.823 3.050 199 HA LEU 25 HA LEU 25 7.387 -6.612 1.399 200 HB2 LEU 25 HB2 LEU 25 6.475 -3.822 0.797 201 HB3 LEU 25 HB1 LEU 25 6.957 -4.991 -0.396 202 HG LEU 25 HG LEU 25 4.509 -4.988 1.319 203 HD11 LEU 25 HD11 LEU 25 5.037 -5.057 -1.631 204 HD12 LEU 25 HD12 LEU 25 4.353 -3.722 -0.708 205 HD13 LEU 25 HD13 LEU 25 3.440 -5.219 -0.908 206 HD21 LEU 25 HD21 LEU 25 5.657 -7.228 -0.282 207 HD22 LEU 25 HD22 LEU 25 3.991 -7.181 0.276 208 HD23 LEU 25 HD23 LEU 25 5.316 -7.229 1.443 209 HA PRO 26 HA PRO 26 11.604 -5.035 1.636 210 HB2 PRO 26 HB2 PRO 26 11.740 -6.598 -0.892 211 HB3 PRO 26 HB1 PRO 26 12.783 -6.675 0.537 212 HG2 PRO 26 HG2 PRO 26 11.008 -8.600 0.038 213 HG3 PRO 26 HG1 PRO 26 11.306 -8.044 1.695 214 HD2 PRO 26 HD2 PRO 26 9.024 -7.434 -0.135 215 HD3 PRO 26 HD1 PRO 26 9.023 -7.734 1.617 216 H GLY 27 HN GLY 27 12.815 -3.531 0.400 217 HA2 GLY 27 HA2 GLY 27 11.477 -1.435 -0.648 218 HA3 GLY 27 HA1 GLY 27 13.137 -1.787 -1.065 219 H GLU 28 HN GLU 28 12.780 -4.078 -2.661 220 HA GLU 28 HA GLU 28 12.173 -2.950 -5.149 221 HB2 GLU 28 HB2 GLU 28 13.593 -4.958 -4.811 222 HB3 GLU 28 HB1 GLU 28 12.153 -5.881 -4.403 223 HG2 GLU 28 HG2 GLU 28 12.706 -6.373 -6.653 224 HG3 GLU 28 HG1 GLU 28 11.266 -5.358 -6.675 225 H LYS 29 HN LYS 29 10.295 -5.201 -3.170 226 HA LYS 29 HA LYS 29 8.019 -5.239 -4.878 227 HB2 LYS 29 HB2 LYS 29 8.439 -6.031 -1.999 228 HB3 LYS 29 HB1 LYS 29 6.941 -6.315 -2.876 229 HG2 LYS 29 HG2 LYS 29 9.622 -7.402 -3.708 230 HG3 LYS 29 HG1 LYS 29 8.438 -8.292 -2.747 231 HD2 LYS 29 HD2 LYS 29 6.800 -7.886 -4.625 232 HD3 LYS 29 HD1 LYS 29 8.165 -7.323 -5.588 233 HE2 LYS 29 HE2 LYS 29 7.780 -9.621 -6.121 234 HE3 LYS 29 HE1 LYS 29 9.269 -9.526 -5.183 235 HZ1 LYS 29 HZ1 LYS 29 8.055 -10.208 -3.228 236 HZ2 LYS 29 HZ2 LYS 29 7.844 -11.345 -4.459 237 HZ3 LYS 29 HZ3 LYS 29 6.606 -10.256 -4.099 238 H LEU 30 HN LEU 30 9.030 -3.422 -2.117 239 HA LEU 30 HA LEU 30 6.625 -2.173 -1.388 240 HB2 LEU 30 HB2 LEU 30 8.636 -2.208 0.002 241 HB3 LEU 30 HB1 LEU 30 9.486 -1.222 -1.168 242 HG LEU 30 HG LEU 30 8.252 0.694 -0.620 243 HD11 LEU 30 HD11 LEU 30 6.437 -0.715 1.264 244 HD12 LEU 30 HD12 LEU 30 6.072 -0.758 -0.452 245 HD13 LEU 30 HD13 LEU 30 6.194 0.782 0.379 246 HD21 LEU 30 HD21 LEU 30 8.512 0.844 1.838 247 HD22 LEU 30 HD22 LEU 30 9.923 0.158 1.030 248 HD23 LEU 30 HD23 LEU 30 8.793 -0.897 1.881 249 H GLY 31 HN GLY 31 9.107 -1.196 -3.750 250 HA2 GLY 31 HA2 GLY 31 8.191 1.364 -4.324 251 HA3 GLY 31 HA1 GLY 31 8.993 0.326 -5.484 252 H ARG 32 HN ARG 32 6.788 -1.695 -5.254 253 HA ARG 32 HA ARG 32 5.153 -0.800 -7.365 254 HB2 ARG 32 HB2 ARG 32 5.529 -3.204 -6.793 255 HB3 ARG 32 HB1 ARG 32 4.540 -2.971 -5.360 256 HG2 ARG 32 HG2 ARG 32 3.191 -4.024 -7.042 257 HG3 ARG 32 HG1 ARG 32 2.634 -2.364 -6.840 258 HD2 ARG 32 HD2 ARG 32 2.782 -2.996 -9.219 259 HD3 ARG 32 HD1 ARG 32 3.871 -1.670 -8.808 260 HE ARG 32 HE ARG 32 4.949 -4.391 -8.810 261 HH11 ARG 32 HH11 ARG 32 4.681 -1.291 -10.405 262 HH12 ARG 32 HH12 ARG 32 6.121 -1.507 -11.348 263 HH21 ARG 32 HH21 ARG 32 6.838 -4.697 -10.063 264 HH22 ARG 32 HH22 ARG 32 7.341 -3.452 -11.162 265 H VAL 33 HN VAL 33 4.477 -1.116 -3.885 266 HA VAL 33 HA VAL 33 1.767 -0.291 -4.130 267 HB VAL 33 HB VAL 33 2.517 0.225 -1.477 268 HG11 VAL 33 HG11 VAL 33 1.099 -1.968 -2.948 269 HG12 VAL 33 HG12 VAL 33 0.460 -0.763 -1.832 270 HG13 VAL 33 HG13 VAL 33 1.399 -2.119 -1.220 271 HG21 VAL 33 HG21 VAL 33 3.869 -2.261 -2.521 272 HG22 VAL 33 HG22 VAL 33 3.655 -1.845 -0.826 273 HG23 VAL 33 HG23 VAL 33 4.664 -0.835 -1.861 274 H VAL 34 HN VAL 34 4.682 1.437 -2.985 275 HA VAL 34 HA VAL 34 3.509 3.910 -2.481 276 HB VAL 34 HB VAL 34 5.672 4.321 -1.998 277 HG11 VAL 34 HG11 VAL 34 6.235 2.016 -2.226 278 HG12 VAL 34 HG12 VAL 34 7.546 3.012 -2.854 279 HG13 VAL 34 HG13 VAL 34 6.440 2.200 -3.964 280 HG21 VAL 34 HG21 VAL 34 5.532 5.817 -3.923 281 HG22 VAL 34 HG22 VAL 34 6.084 4.526 -4.978 282 HG23 VAL 34 HG23 VAL 34 7.158 5.176 -3.742 283 H HIS 35 HN HIS 35 4.611 2.522 -5.519 284 HA HIS 35 HA HIS 35 3.886 4.688 -7.175 285 HB2 HIS 35 HB2 HIS 35 5.421 2.896 -7.883 286 HB3 HIS 35 HB1 HIS 35 4.077 1.762 -7.896 287 HD1 HIS 35 HD1 HIS 35 5.313 4.850 -9.703 288 HD2 HIS 35 HD2 HIS 35 2.630 1.723 -10.229 289 HE1 HIS 35 HE1 HIS 35 4.489 5.056 -12.068 290 HE2 HIS 35 HE2 HIS 35 2.756 3.246 -12.313 291 H ILE 36 HN ILE 36 2.105 1.736 -6.252 292 HA ILE 36 HA ILE 36 -0.128 2.079 -7.873 293 HB ILE 36 HB ILE 36 -0.132 0.901 -5.083 294 HG12 ILE 36 HG12 ILE 36 0.316 -0.341 -7.802 295 HG13 ILE 36 HG11 ILE 36 1.419 -0.327 -6.437 296 HG21 ILE 36 HG21 ILE 36 -2.338 0.680 -5.317 297 HG22 ILE 36 HG22 ILE 36 -2.068 -0.290 -6.767 298 HG23 ILE 36 HG23 ILE 36 -2.258 1.457 -6.899 299 HD11 ILE 36 HD11 ILE 36 -0.206 -1.738 -5.197 300 HD12 ILE 36 HD12 ILE 36 0.484 -2.503 -6.626 301 HD13 ILE 36 HD13 ILE 36 -1.153 -1.856 -6.679 302 H ILE 37 HN ILE 37 0.259 3.184 -4.482 303 HA ILE 37 HA ILE 37 -2.256 4.391 -4.302 304 HB ILE 37 HB ILE 37 0.247 5.288 -2.869 305 HG12 ILE 37 HG12 ILE 37 -1.533 3.912 -1.155 306 HG13 ILE 37 HG11 ILE 37 -1.368 2.920 -2.598 307 HG21 ILE 37 HG21 ILE 37 -1.933 6.734 -3.069 308 HG22 ILE 37 HG22 ILE 37 -1.076 6.601 -1.529 309 HG23 ILE 37 HG23 ILE 37 -2.521 5.631 -1.824 310 HD11 ILE 37 HD11 ILE 37 0.946 2.703 -2.309 311 HD12 ILE 37 HD12 ILE 37 0.230 2.451 -0.715 312 HD13 ILE 37 HD13 ILE 37 0.990 3.991 -1.111 313 H GLN 38 HN GLN 38 0.868 5.860 -5.108 314 HA GLN 38 HA GLN 38 0.003 8.460 -5.546 315 HB2 GLN 38 HB2 GLN 38 2.259 6.888 -6.772 316 HB3 GLN 38 HB1 GLN 38 2.023 8.593 -7.127 317 HG2 GLN 38 HG2 GLN 38 2.023 8.744 -4.459 318 HG3 GLN 38 HG1 GLN 38 2.951 7.253 -4.637 319 HE21 GLN 38 HE21 GLN 38 4.049 9.826 -3.655 320 HE22 GLN 38 HE22 GLN 38 5.264 10.284 -4.788 321 H SER 39 HN SER 39 -0.156 5.685 -7.704 322 HA SER 39 HA SER 39 -0.821 7.219 -10.003 323 HB2 SER 39 HB2 SER 39 -0.991 4.259 -9.437 324 HB3 SER 39 HB1 SER 39 -1.114 5.015 -11.012 325 HG SER 39 HG SER 39 1.127 4.917 -9.303 326 H ARG 40 HN ARG 40 -2.630 5.685 -7.410 327 HA ARG 40 HA ARG 40 -5.106 5.781 -8.967 328 HB2 ARG 40 HB2 ARG 40 -4.722 4.871 -6.120 329 HB3 ARG 40 HB1 ARG 40 -6.119 4.578 -7.141 330 HG2 ARG 40 HG2 ARG 40 -4.456 3.330 -8.679 331 HG3 ARG 40 HG1 ARG 40 -3.411 3.313 -7.253 332 HD2 ARG 40 HD2 ARG 40 -4.703 1.274 -7.403 333 HD3 ARG 40 HD1 ARG 40 -5.124 2.215 -5.980 334 HE ARG 40 HE ARG 40 -7.125 2.961 -7.246 335 HH11 ARG 40 HH11 ARG 40 -5.502 -0.009 -8.171 336 HH12 ARG 40 HH12 ARG 40 -6.928 -0.718 -8.851 337 HH21 ARG 40 HH21 ARG 40 -8.989 2.028 -8.145 338 HH22 ARG 40 HH22 ARG 40 -8.910 0.442 -8.846 339 H GLU 41 HN GLU 41 -3.467 7.302 -6.315 340 HA GLU 41 HA GLU 41 -5.711 9.146 -5.946 341 HB2 GLU 41 HB2 GLU 41 -3.449 8.616 -4.072 342 HB3 GLU 41 HB1 GLU 41 -5.021 9.324 -3.722 343 HG2 GLU 41 HG2 GLU 41 -5.061 6.726 -4.958 344 HG3 GLU 41 HG1 GLU 41 -4.418 6.754 -3.350 345 HA PRO 42 HA PRO 42 -2.628 11.821 -8.087 346 HB2 PRO 42 HB2 PRO 42 -5.060 13.475 -8.396 347 HB3 PRO 42 HB1 PRO 42 -3.893 12.953 -9.612 348 HG2 PRO 42 HG2 PRO 42 -6.336 11.878 -9.492 349 HG3 PRO 42 HG1 PRO 42 -4.915 10.901 -9.907 350 HD2 PRO 42 HD2 PRO 42 -6.406 11.076 -7.319 351 HD3 PRO 42 HD1 PRO 42 -5.709 9.654 -8.128 352 H SER 43 HN SER 43 -4.768 12.303 -5.439 353 HA SER 43 HA SER 43 -4.151 15.015 -4.865 354 HB2 SER 43 HB2 SER 43 -5.176 12.883 -2.982 355 HB3 SER 43 HB1 SER 43 -5.321 14.628 -2.779 356 HG SER 43 HG SER 43 -6.801 12.892 -4.328 357 H LEU 44 HN LEU 44 -2.401 12.120 -4.414 358 HA LEU 44 HA LEU 44 -0.603 13.511 -2.555 359 HB2 LEU 44 HB2 LEU 44 -0.063 11.319 -1.530 360 HB3 LEU 44 HB1 LEU 44 -1.700 11.854 -1.251 361 HG LEU 44 HG LEU 44 -2.218 10.292 -3.329 362 HD11 LEU 44 HD11 LEU 44 0.212 9.813 -3.666 363 HD12 LEU 44 HD12 LEU 44 -0.800 8.384 -3.470 364 HD13 LEU 44 HD13 LEU 44 0.195 8.950 -2.129 365 HD21 LEU 44 HD21 LEU 44 -3.156 10.067 -1.087 366 HD22 LEU 44 HD22 LEU 44 -1.678 9.272 -0.542 367 HD23 LEU 44 HD23 LEU 44 -2.702 8.496 -1.749 368 H LYS 45 HN LYS 45 -0.765 12.856 -5.585 369 HA LYS 45 HA LYS 45 1.616 11.307 -6.016 370 HB2 LYS 45 HB2 LYS 45 1.310 11.676 -8.332 371 HB3 LYS 45 HB1 LYS 45 -0.308 11.529 -7.669 372 HG2 LYS 45 HG2 LYS 45 -0.458 14.006 -7.663 373 HG3 LYS 45 HG1 LYS 45 1.112 14.050 -8.478 374 HD2 LYS 45 HD2 LYS 45 0.009 12.451 -10.179 375 HD3 LYS 45 HD1 LYS 45 -1.512 13.025 -9.491 376 HE2 LYS 45 HE2 LYS 45 -0.879 15.322 -9.995 377 HE3 LYS 45 HE1 LYS 45 0.657 14.755 -10.646 378 HZ1 LYS 45 HZ1 LYS 45 -2.035 14.113 -11.724 379 HZ2 LYS 45 HZ2 LYS 45 -0.569 13.539 -12.345 380 HZ3 LYS 45 HZ3 LYS 45 -0.922 15.191 -12.406 381 H ASN 46 HN ASN 46 1.094 14.326 -4.872 382 HA ASN 46 HA ASN 46 3.501 15.514 -6.000 383 HB2 ASN 46 HB2 ASN 46 2.813 17.513 -4.632 384 HB3 ASN 46 HB1 ASN 46 1.667 17.039 -5.876 385 HD21 ASN 46 HD21 ASN 46 0.014 18.128 -4.802 386 HD22 ASN 46 HD22 ASN 46 -0.724 17.491 -3.375 387 H SER 47 HN SER 47 2.722 13.476 -3.512 388 HA SER 47 HA SER 47 4.513 14.454 -1.515 389 HB2 SER 47 HB2 SER 47 3.484 11.618 -1.922 390 HB3 SER 47 HB1 SER 47 4.195 12.285 -0.449 391 HG SER 47 HG SER 47 2.296 13.926 -0.940 392 H ASN 48 HN ASN 48 6.684 14.075 -1.303 393 HA ASN 48 HA ASN 48 8.227 13.351 -3.519 394 HB2 ASN 48 HB2 ASN 48 9.046 13.173 -0.603 395 HB3 ASN 48 HB1 ASN 48 10.133 13.266 -1.984 396 HD21 ASN 48 HD21 ASN 48 9.836 15.009 0.351 397 HD22 ASN 48 HD22 ASN 48 9.533 16.592 -0.286 398 HA PRO 49 HA PRO 49 7.448 9.018 -3.662 399 HB2 PRO 49 HB2 PRO 49 9.667 8.266 -5.100 400 HB3 PRO 49 HB1 PRO 49 8.199 8.944 -5.805 401 HG2 PRO 49 HG2 PRO 49 10.782 10.293 -5.124 402 HG3 PRO 49 HG1 PRO 49 9.750 10.507 -6.553 403 HD2 PRO 49 HD2 PRO 49 9.741 12.281 -4.542 404 HD3 PRO 49 HD1 PRO 49 8.252 11.874 -5.421 405 H ASP 50 HN ASP 50 10.371 10.333 -2.384 406 HA ASP 50 HA ASP 50 11.385 7.851 -1.368 407 HB2 ASP 50 HB2 ASP 50 12.189 10.578 -0.381 408 HB3 ASP 50 HB1 ASP 50 13.163 9.122 -0.489 409 H GLU 51 HN GLU 51 9.279 10.383 -0.282 410 HA GLU 51 HA GLU 51 8.944 9.102 2.338 411 HB2 GLU 51 HB2 GLU 51 9.656 11.957 1.720 412 HB3 GLU 51 HB1 GLU 51 8.643 11.630 3.119 413 HG2 GLU 51 HG2 GLU 51 10.348 10.365 4.158 414 HG3 GLU 51 HG1 GLU 51 11.294 10.309 2.677 415 H ILE 52 HN ILE 52 7.079 8.347 0.849 416 HA ILE 52 HA ILE 52 5.289 10.373 -0.081 417 HB ILE 52 HB ILE 52 4.075 8.706 -1.165 418 HG12 ILE 52 HG12 ILE 52 5.339 6.519 0.411 419 HG13 ILE 52 HG11 ILE 52 3.874 7.321 0.983 420 HG21 ILE 52 HG21 ILE 52 6.769 7.409 -0.974 421 HG22 ILE 52 HG22 ILE 52 6.512 8.938 -1.829 422 HG23 ILE 52 HG23 ILE 52 5.678 7.478 -2.367 423 HD11 ILE 52 HD11 ILE 52 2.811 6.769 -1.185 424 HD12 ILE 52 HD12 ILE 52 3.252 5.354 -0.223 425 HD13 ILE 52 HD13 ILE 52 4.246 5.828 -1.599 426 H GLU 53 HN GLU 53 3.265 10.878 0.609 427 HA GLU 53 HA GLU 53 2.753 10.228 3.413 428 HB2 GLU 53 HB2 GLU 53 2.885 12.631 2.182 429 HB3 GLU 53 HB1 GLU 53 1.176 12.297 1.975 430 HG2 GLU 53 HG2 GLU 53 2.728 12.710 4.496 431 HG3 GLU 53 HG1 GLU 53 1.289 13.548 3.927 432 H ILE 54 HN ILE 54 1.438 8.479 3.561 433 HA ILE 54 HA ILE 54 -0.859 8.299 1.715 434 HB ILE 54 HB ILE 54 0.327 6.160 3.488 435 HG12 ILE 54 HG12 ILE 54 0.262 6.339 0.475 436 HG13 ILE 54 HG11 ILE 54 1.667 6.764 1.455 437 HG21 ILE 54 HG21 ILE 54 -1.244 4.676 2.274 438 HG22 ILE 54 HG22 ILE 54 -1.972 6.098 1.545 439 HG23 ILE 54 HG23 ILE 54 -2.051 5.864 3.292 440 HD11 ILE 54 HD11 ILE 54 1.736 4.494 0.467 441 HD12 ILE 54 HD12 ILE 54 0.353 4.064 1.470 442 HD13 ILE 54 HD13 ILE 54 1.881 4.520 2.221 443 H ASP 55 HN ASP 55 -2.888 8.528 2.484 444 HA ASP 55 HA ASP 55 -3.197 8.494 5.417 445 HB2 ASP 55 HB2 ASP 55 -3.476 10.788 4.396 446 HB3 ASP 55 HB1 ASP 55 -4.861 10.149 3.512 447 H PHE 56 HN PHE 56 -4.043 6.552 5.817 448 HA PHE 56 HA PHE 56 -5.351 5.060 3.823 449 HB2 PHE 56 HB2 PHE 56 -4.473 4.640 6.571 450 HB3 PHE 56 HB1 PHE 56 -5.881 3.680 6.112 451 HD1 PHE 56 HD1 PHE 56 -2.362 4.436 5.263 452 HD2 PHE 56 HD2 PHE 56 -5.709 1.919 4.588 453 HE1 PHE 56 HE1 PHE 56 -0.945 2.878 3.984 454 HE2 PHE 56 HE2 PHE 56 -4.314 0.379 3.325 455 HZ PHE 56 HZ PHE 56 -1.927 0.829 3.022 456 H GLU 57 HN GLU 57 -6.639 7.473 5.754 457 HA GLU 57 HA GLU 57 -9.304 6.319 5.789 458 HB2 GLU 57 HB2 GLU 57 -8.146 8.880 6.829 459 HB3 GLU 57 HB1 GLU 57 -9.875 8.559 6.844 460 HG2 GLU 57 HG2 GLU 57 -7.834 6.775 8.138 461 HG3 GLU 57 HG1 GLU 57 -8.678 8.072 8.981 462 H THR 58 HN THR 58 -7.385 8.075 3.696 463 HA THR 58 HA THR 58 -9.729 9.290 2.403 464 HB THR 58 HB THR 58 -8.145 10.827 1.287 465 HG1 THR 58 HG1 THR 58 -6.281 9.355 2.846 466 HG21 THR 58 HG21 THR 58 -8.119 10.693 4.296 467 HG22 THR 58 HG22 THR 58 -9.208 11.627 3.263 468 HG23 THR 58 HG23 THR 58 -7.506 12.077 3.384 469 H LEU 59 HN LEU 59 -7.444 6.804 2.053 470 HA LEU 59 HA LEU 59 -7.196 6.829 -0.787 471 HB2 LEU 59 HB2 LEU 59 -7.084 4.259 0.744 472 HB3 LEU 59 HB1 LEU 59 -6.158 4.766 -0.645 473 HG LEU 59 HG LEU 59 -5.762 5.674 2.193 474 HD11 LEU 59 HD11 LEU 59 -4.233 3.863 0.346 475 HD12 LEU 59 HD12 LEU 59 -4.856 3.531 1.964 476 HD13 LEU 59 HD13 LEU 59 -3.492 4.626 1.754 477 HD21 LEU 59 HD21 LEU 59 -4.544 6.655 -0.364 478 HD22 LEU 59 HD22 LEU 59 -3.713 6.799 1.175 479 HD23 LEU 59 HD23 LEU 59 -5.271 7.583 0.939 480 H LYS 60 HN LYS 60 -8.401 5.865 -2.316 481 HA LYS 60 HA LYS 60 -11.139 5.343 -1.876 482 HB2 LYS 60 HB2 LYS 60 -9.390 4.455 -4.179 483 HB3 LYS 60 HB1 LYS 60 -11.143 4.592 -4.207 484 HG2 LYS 60 HG2 LYS 60 -10.926 7.025 -3.880 485 HG3 LYS 60 HG1 LYS 60 -9.168 6.852 -3.927 486 HD2 LYS 60 HD2 LYS 60 -9.376 5.873 -6.195 487 HD3 LYS 60 HD1 LYS 60 -11.108 6.200 -6.142 488 HE2 LYS 60 HE2 LYS 60 -10.071 7.972 -7.354 489 HE3 LYS 60 HE1 LYS 60 -10.565 8.609 -5.788 490 HZ1 LYS 60 HZ1 LYS 60 -8.246 8.274 -5.025 491 HZ2 LYS 60 HZ2 LYS 60 -8.380 9.387 -6.295 492 HZ3 LYS 60 HZ3 LYS 60 -7.818 7.823 -6.604 493 HA PRO 61 HA PRO 61 -11.255 1.160 -0.419 494 HB2 PRO 61 HB2 PRO 61 -13.425 0.683 -2.371 495 HB3 PRO 61 HB1 PRO 61 -13.438 0.516 -0.614 496 HG2 PRO 61 HG2 PRO 61 -14.683 2.544 -1.903 497 HG3 PRO 61 HG1 PRO 61 -14.003 2.715 -0.277 498 HD2 PRO 61 HD2 PRO 61 -12.994 3.755 -2.866 499 HD3 PRO 61 HD1 PRO 61 -12.780 4.394 -1.227 500 H SER 62 HN SER 62 -11.318 1.800 -3.880 501 HA SER 62 HA SER 62 -10.543 -0.826 -4.663 502 HB2 SER 62 HB2 SER 62 -9.941 0.357 -6.849 503 HB3 SER 62 HB1 SER 62 -11.622 0.478 -6.331 504 HG SER 62 HG SER 62 -11.360 2.558 -5.893 505 H THR 63 HN THR 63 -8.804 2.168 -3.994 506 HA THR 63 HA THR 63 -6.224 1.331 -4.676 507 HB THR 63 HB THR 63 -6.703 3.101 -2.274 508 HG1 THR 63 HG1 THR 63 -7.140 4.822 -3.694 509 HG21 THR 63 HG21 THR 63 -4.401 2.516 -3.137 510 HG22 THR 63 HG22 THR 63 -4.755 4.232 -3.000 511 HG23 THR 63 HG23 THR 63 -4.792 3.447 -4.576 512 H LEU 64 HN LEU 64 -7.950 1.211 -1.579 513 HA LEU 64 HA LEU 64 -5.981 -0.053 -0.064 514 HB2 LEU 64 HB2 LEU 64 -8.987 -0.137 0.144 515 HB3 LEU 64 HB1 LEU 64 -7.928 -0.850 1.343 516 HG LEU 64 HG LEU 64 -7.903 2.074 0.610 517 HD11 LEU 64 HD11 LEU 64 -10.037 1.442 1.671 518 HD12 LEU 64 HD12 LEU 64 -9.051 2.460 2.715 519 HD13 LEU 64 HD13 LEU 64 -9.137 0.724 3.005 520 HD21 LEU 64 HD21 LEU 64 -5.805 1.391 1.475 521 HD22 LEU 64 HD22 LEU 64 -6.574 0.471 2.762 522 HD23 LEU 64 HD23 LEU 64 -6.668 2.231 2.758 523 H ARG 65 HN ARG 65 -8.489 -1.481 -2.116 524 HA ARG 65 HA ARG 65 -7.823 -4.137 -1.229 525 HB2 ARG 65 HB2 ARG 65 -9.848 -2.941 -3.005 526 HB3 ARG 65 HB1 ARG 65 -9.361 -4.566 -3.410 527 HG2 ARG 65 HG2 ARG 65 -10.469 -3.643 -0.782 528 HG3 ARG 65 HG1 ARG 65 -11.336 -4.613 -1.984 529 HD2 ARG 65 HD2 ARG 65 -9.667 -6.415 -1.630 530 HD3 ARG 65 HD1 ARG 65 -8.918 -5.443 -0.364 531 HE ARG 65 HE ARG 65 -11.713 -5.788 0.073 532 HH11 ARG 65 HH11 ARG 65 -8.615 -7.393 0.440 533 HH12 ARG 65 HH12 ARG 65 -9.168 -8.398 1.745 534 HH21 ARG 65 HH21 ARG 65 -12.415 -7.089 1.799 535 HH22 ARG 65 HH22 ARG 65 -11.315 -8.214 2.533 536 H GLU 66 HN GLU 66 -6.610 -1.997 -3.575 537 HA GLU 66 HA GLU 66 -5.405 -4.090 -5.162 538 HB2 GLU 66 HB2 GLU 66 -6.042 -2.061 -6.293 539 HB3 GLU 66 HB1 GLU 66 -5.108 -1.081 -5.167 540 HG2 GLU 66 HG2 GLU 66 -3.924 -1.229 -7.230 541 HG3 GLU 66 HG1 GLU 66 -3.049 -2.164 -6.019 542 H LEU 67 HN LEU 67 -4.494 -1.757 -2.694 543 HA LEU 67 HA LEU 67 -1.726 -2.302 -2.645 544 HB2 LEU 67 HB2 LEU 67 -3.551 -1.377 -0.405 545 HB3 LEU 67 HB1 LEU 67 -1.808 -1.186 -0.440 546 HG LEU 67 HG LEU 67 -3.790 0.162 -2.282 547 HD11 LEU 67 HD11 LEU 67 -2.045 1.293 -0.096 548 HD12 LEU 67 HD12 LEU 67 -3.787 1.037 0.005 549 HD13 LEU 67 HD13 LEU 67 -3.134 2.201 -1.146 550 HD21 LEU 67 HD21 LEU 67 -1.598 -0.421 -3.330 551 HD22 LEU 67 HD22 LEU 67 -0.823 0.614 -2.129 552 HD23 LEU 67 HD23 LEU 67 -1.971 1.296 -3.278 553 H GLU 68 HN GLU 68 -4.486 -3.458 -0.754 554 HA GLU 68 HA GLU 68 -3.038 -5.198 0.944 555 HB2 GLU 68 HB2 GLU 68 -5.217 -4.354 1.573 556 HB3 GLU 68 HB1 GLU 68 -5.966 -5.135 0.193 557 HG2 GLU 68 HG2 GLU 68 -4.516 -6.831 2.143 558 HG3 GLU 68 HG1 GLU 68 -6.068 -6.157 2.611 559 H ARG 69 HN ARG 69 -5.185 -5.952 -1.831 560 HA ARG 69 HA ARG 69 -4.786 -8.691 -1.891 561 HB2 ARG 69 HB2 ARG 69 -6.423 -7.488 -3.290 562 HB3 ARG 69 HB1 ARG 69 -5.103 -6.913 -4.305 563 HG2 ARG 69 HG2 ARG 69 -4.534 -9.398 -4.591 564 HG3 ARG 69 HG1 ARG 69 -6.170 -9.683 -3.995 565 HD2 ARG 69 HD2 ARG 69 -6.039 -9.593 -6.473 566 HD3 ARG 69 HD1 ARG 69 -7.129 -8.398 -5.775 567 HE ARG 69 HE ARG 69 -4.847 -7.000 -6.019 568 HH11 ARG 69 HH11 ARG 69 -6.590 -9.026 -8.273 569 HH12 ARG 69 HH12 ARG 69 -6.077 -8.136 -9.670 570 HH21 ARG 69 HH21 ARG 69 -4.191 -5.792 -7.848 571 HH22 ARG 69 HH22 ARG 69 -4.714 -6.301 -9.430 572 H TYR 70 HN TYR 70 -2.690 -6.176 -3.072 573 HA TYR 70 HA TYR 70 -1.043 -7.980 -4.592 574 HB2 TYR 70 HB2 TYR 70 -1.036 -5.813 -5.472 575 HB3 TYR 70 HB1 TYR 70 -0.839 -5.068 -3.887 576 HD1 TYR 70 HD2 TYR 70 0.944 -7.035 -6.491 577 HD2 TYR 70 HD1 TYR 70 1.264 -4.615 -3.019 578 HE1 TYR 70 HE2 TYR 70 3.380 -6.936 -6.803 579 HE2 TYR 70 HE1 TYR 70 3.714 -4.497 -3.321 580 HH TYR 70 HH TYR 70 5.478 -5.563 -4.379 581 H VAL 71 HN VAL 71 -0.659 -6.220 -1.516 582 HA VAL 71 HA VAL 71 1.954 -7.168 -1.030 583 HB VAL 71 HB VAL 71 1.643 -6.451 1.280 584 HG11 VAL 71 HG11 VAL 71 0.453 -4.122 0.376 585 HG12 VAL 71 HG12 VAL 71 1.229 -4.808 -1.046 586 HG13 VAL 71 HG13 VAL 71 2.173 -4.483 0.409 587 HG21 VAL 71 HG21 VAL 71 -0.482 -7.018 1.927 588 HG22 VAL 71 HG22 VAL 71 -1.222 -6.346 0.473 589 HG23 VAL 71 HG23 VAL 71 -0.613 -5.271 1.733 590 H THR 72 HN THR 72 -1.217 -8.347 0.030 591 HA THR 72 HA THR 72 -0.302 -10.372 1.718 592 HB THR 72 HB THR 72 -2.671 -9.536 1.534 593 HG1 THR 72 HG1 THR 72 -2.481 -11.334 2.772 594 HG21 THR 72 HG21 THR 72 -2.847 -9.724 -0.917 595 HG22 THR 72 HG22 THR 72 -4.156 -10.547 -0.071 596 HG23 THR 72 HG23 THR 72 -2.830 -11.480 -0.763 597 H SER 73 HN SER 73 -0.592 -10.211 -1.735 598 HA SER 73 HA SER 73 -0.207 -12.921 -2.375 599 HB2 SER 73 HB2 SER 73 -0.902 -11.001 -3.916 600 HB3 SER 73 HB1 SER 73 0.799 -10.566 -3.976 601 HG SER 73 HG SER 73 -0.399 -12.981 -4.852 602 H CYS 74 HN CYS 74 1.964 -10.359 -1.453 603 HA CYS 74 HA CYS 74 4.342 -11.862 -2.172 604 HB2 CYS 74 HB2 CYS 74 4.306 -9.457 -2.581 605 HB3 CYS 74 HB1 CYS 74 4.017 -9.145 -0.868 606 HG CYS 74 HG CYS 74 6.647 -10.885 -0.731 607 H LEU 75 HN LEU 75 2.886 -10.540 0.801 608 HA LEU 75 HA LEU 75 4.695 -11.484 2.667 609 HB2 LEU 75 HB2 LEU 75 1.767 -11.613 3.246 610 HB3 LEU 75 HB1 LEU 75 3.076 -11.096 4.283 611 HG LEU 75 HG LEU 75 2.142 -9.517 1.910 612 HD11 LEU 75 HD11 LEU 75 1.509 -8.893 4.759 613 HD12 LEU 75 HD12 LEU 75 0.458 -9.930 3.799 614 HD13 LEU 75 HD13 LEU 75 0.763 -8.276 3.284 615 HD21 LEU 75 HD21 LEU 75 4.451 -9.173 2.733 616 HD22 LEU 75 HD22 LEU 75 3.785 -8.728 4.304 617 HD23 LEU 75 HD23 LEU 75 3.424 -7.748 2.881 618 H ARG 76 HN ARG 76 2.199 -13.220 0.945 619 HA ARG 76 HA ARG 76 2.567 -15.542 2.675 620 HB2 ARG 76 HB2 ARG 76 0.444 -14.838 0.663 621 HB3 ARG 76 HB1 ARG 76 0.517 -16.385 1.498 622 HG2 ARG 76 HG2 ARG 76 -0.031 -15.470 3.534 623 HG3 ARG 76 HG1 ARG 76 0.554 -13.866 3.086 624 HD2 ARG 76 HD2 ARG 76 -1.861 -13.889 3.228 625 HD3 ARG 76 HD1 ARG 76 -1.336 -13.595 1.572 626 HE ARG 76 HE ARG 76 -1.841 -16.358 2.041 627 HH11 ARG 76 HH11 ARG 76 -3.381 -13.279 1.390 628 HH12 ARG 76 HH12 ARG 76 -4.814 -13.994 0.713 629 HH21 ARG 76 HH21 ARG 76 -3.717 -17.303 1.146 630 HH22 ARG 76 HH22 ARG 76 -5.002 -16.289 0.575 631 H LYS 77 HN LYS 77 3.828 -14.385 -0.115 632 HA LYS 77 HA LYS 77 4.672 -17.054 -0.948 633 HB2 LYS 77 HB2 LYS 77 3.268 -15.088 -2.733 634 HB3 LYS 77 HB1 LYS 77 4.343 -16.322 -3.382 635 HG2 LYS 77 HG2 LYS 77 2.969 -18.067 -2.593 636 HG3 LYS 77 HG1 LYS 77 2.027 -16.962 -1.596 637 HD2 LYS 77 HD2 LYS 77 1.200 -15.861 -3.641 638 HD3 LYS 77 HD1 LYS 77 2.121 -17.008 -4.614 639 HE2 LYS 77 HE2 LYS 77 -0.097 -17.706 -2.694 640 HE3 LYS 77 HE1 LYS 77 -0.245 -17.637 -4.448 641 HZ1 LYS 77 HZ1 LYS 77 1.444 -19.401 -4.578 642 HZ2 LYS 77 HZ2 LYS 77 0.056 -19.897 -3.751 643 HZ3 LYS 77 HZ3 LYS 77 1.457 -19.505 -2.892 644 H LYS 78 HN LYS 78 6.819 -16.983 -0.868 645 HA LYS 78 HA LYS 78 8.976 -16.341 -1.130 646 HB2 LYS 78 HB2 LYS 78 7.765 -16.029 -3.523 647 HB3 LYS 78 HB1 LYS 78 8.338 -14.391 -3.259 648 HG2 LYS 78 HG2 LYS 78 10.006 -16.897 -3.371 649 HG3 LYS 78 HG1 LYS 78 9.948 -15.597 -4.561 650 HD2 LYS 78 HD2 LYS 78 10.811 -14.042 -2.823 651 HD3 LYS 78 HD1 LYS 78 10.994 -15.419 -1.737 652 HE2 LYS 78 HE2 LYS 78 12.375 -15.028 -4.389 653 HE3 LYS 78 HE1 LYS 78 13.111 -14.888 -2.794 654 HZ1 LYS 78 HZ1 LYS 78 12.534 -17.258 -2.441 655 HZ2 LYS 78 HZ2 LYS 78 13.647 -17.008 -3.688 656 HZ3 LYS 78 HZ3 LYS 78 12.032 -17.344 -4.055 657 H ARG 79 HN ARG 79 8.558 -15.218 0.999 658 HA ARG 79 HA ARG 79 8.752 -12.295 0.722 659 HB2 ARG 79 HB2 ARG 79 8.178 -12.203 3.150 660 HB3 ARG 79 HB1 ARG 79 6.907 -12.883 2.147 661 HG2 ARG 79 HG2 ARG 79 8.833 -14.732 3.464 662 HG3 ARG 79 HG1 ARG 79 7.568 -13.976 4.436 663 HD2 ARG 79 HD2 ARG 79 5.864 -14.876 2.977 664 HD3 ARG 79 HD1 ARG 79 7.091 -15.546 1.905 665 HE ARG 79 HE ARG 79 7.754 -16.923 3.926 666 HH11 ARG 79 HH11 ARG 79 4.484 -15.751 3.480 667 HH12 ARG 79 HH12 ARG 79 3.754 -17.111 4.275 668 HH21 ARG 79 HH21 ARG 79 6.788 -18.715 4.972 669 HH22 ARG 79 HH22 ARG 79 5.061 -18.802 5.104 670 H LYS 80 HN LYS 80 10.943 -13.851 0.126 671 HA LYS 80 HA LYS 80 12.821 -12.962 2.165 672 HB2 LYS 80 HB2 LYS 80 14.058 -15.141 1.983 673 HB3 LYS 80 HB1 LYS 80 12.519 -15.229 2.824 674 HG2 LYS 80 HG2 LYS 80 11.470 -16.165 0.836 675 HG3 LYS 80 HG1 LYS 80 12.997 -16.041 -0.039 676 HD2 LYS 80 HD2 LYS 80 12.541 -17.698 2.444 677 HD3 LYS 80 HD1 LYS 80 12.573 -18.322 0.793 678 HE2 LYS 80 HE2 LYS 80 14.886 -17.566 0.552 679 HE3 LYS 80 HE1 LYS 80 14.853 -16.928 2.193 680 HZ1 LYS 80 HZ1 LYS 80 14.592 -19.776 1.409 681 HZ2 LYS 80 HZ2 LYS 80 14.440 -19.197 2.990 682 HZ3 LYS 80 HZ3 LYS 80 15.915 -19.059 2.179 683 HA PRO 81 HA PRO 81 14.218 -12.018 -2.159 684 HB2 PRO 81 HB2 PRO 81 14.831 -9.441 -1.754 685 HB3 PRO 81 HB1 PRO 81 13.162 -9.956 -2.036 686 HG2 PRO 81 HG2 PRO 81 14.544 -9.399 0.568 687 HG3 PRO 81 HG1 PRO 81 12.970 -8.812 0.002 688 HD2 PRO 81 HD2 PRO 81 13.183 -10.919 1.662 689 HD3 PRO 81 HD1 PRO 81 11.923 -10.834 0.411 690 H GLN 82 HN GLN 82 16.335 -11.291 -2.889 691 HA GLN 82 HA GLN 82 18.413 -11.656 -0.833 692 HB2 GLN 82 HB2 GLN 82 18.176 -13.476 -2.569 693 HB3 GLN 82 HB1 GLN 82 18.634 -12.292 -3.780 694 HG2 GLN 82 HG2 GLN 82 20.505 -13.702 -3.136 695 HG3 GLN 82 HG1 GLN 82 20.797 -12.012 -2.734 696 HE21 GLN 82 HE21 GLN 82 18.682 -14.053 -0.846 697 HE22 GLN 82 HE22 GLN 82 19.708 -14.150 0.541 698 H ALA 83 HN ALA 83 16.907 -9.362 -2.417 699 HA ALA 83 HA ALA 83 19.246 -7.623 -2.515 700 HB1 ALA 83 HB1 ALA 83 18.557 -6.640 -4.640 701 HB2 ALA 83 HB2 ALA 83 17.218 -7.784 -4.747 702 HB3 ALA 83 HB3 ALA 83 18.881 -8.364 -4.827 703 H1 GLU 201 HT1 GLU 201 -5.607 8.469 13.797 704 H2 GLU 201 HT2 GLU 201 -6.892 7.756 12.964 705 H3 GLU 201 HT3 GLU 201 -6.896 9.419 13.263 706 HA GLU 201 HA GLU 201 -6.330 8.880 10.963 707 HB2 GLU 201 HB2 GLU 201 -4.199 10.174 12.670 708 HB3 GLU 201 HB1 GLU 201 -4.215 10.241 10.913 709 HG2 GLU 201 HG2 GLU 201 -6.318 11.427 10.942 710 HG3 GLU 201 HG1 GLU 201 -6.400 11.286 12.698 711 H ILE 202 HN ILE 202 -5.103 7.760 9.518 712 HA ILE 202 HA ILE 202 -2.989 6.019 10.595 713 HB ILE 202 HB ILE 202 -5.079 5.223 8.556 714 HG12 ILE 202 HG12 ILE 202 -5.865 5.195 10.912 715 HG13 ILE 202 HG11 ILE 202 -5.819 3.591 10.189 716 HG21 ILE 202 HG21 ILE 202 -2.880 4.299 8.010 717 HG22 ILE 202 HG22 ILE 202 -3.989 3.035 8.535 718 HG23 ILE 202 HG23 ILE 202 -2.752 3.634 9.638 719 HD11 ILE 202 HD11 ILE 202 -3.704 3.150 11.337 720 HD12 ILE 202 HD12 ILE 202 -5.007 3.535 12.461 721 HD13 ILE 202 HD13 ILE 202 -3.786 4.748 12.080 722 H LYS 203 HN LYS 203 -1.327 7.280 9.830 723 HA LYS 203 HA LYS 203 -1.237 7.806 6.940 724 HB2 LYS 203 HB2 LYS 203 0.583 8.839 9.125 725 HB3 LYS 203 HB1 LYS 203 0.620 9.320 7.436 726 HG2 LYS 203 HG2 LYS 203 -1.606 10.298 7.669 727 HG3 LYS 203 HG1 LYS 203 -1.637 9.821 9.365 728 HD2 LYS 203 HD2 LYS 203 0.480 11.181 9.646 729 HD3 LYS 203 HD1 LYS 203 0.180 11.816 8.027 730 HE2 LYS 203 HE2 LYS 203 -0.718 13.370 9.601 731 HE3 LYS 203 HE1 LYS 203 -2.070 12.553 8.818 732 HZ1 LYS 203 HZ1 LYS 203 -1.023 12.148 11.554 733 HZ2 LYS 203 HZ2 LYS 203 -2.018 11.006 10.808 734 HZ3 LYS 203 HZ3 LYS 203 -2.597 12.576 11.080 735 H LEU 204 HN LEU 204 0.323 6.903 5.644 736 HA LEU 204 HA LEU 204 2.290 5.146 6.970 737 HB2 LEU 204 HB2 LEU 204 0.333 4.208 5.347 738 HB3 LEU 204 HB1 LEU 204 1.575 4.557 4.158 739 HG LEU 204 HG LEU 204 1.699 2.602 6.450 740 HD11 LEU 204 HD11 LEU 204 2.184 2.227 3.506 741 HD12 LEU 204 HD12 LEU 204 0.661 1.891 4.323 742 HD13 LEU 204 HD13 LEU 204 2.107 0.975 4.743 743 HD21 LEU 204 HD21 LEU 204 4.019 3.266 4.653 744 HD22 LEU 204 HD22 LEU 204 3.998 2.201 6.055 745 HD23 LEU 204 HD23 LEU 204 3.826 3.943 6.269 746 H LYS 205 HN LYS 205 3.966 6.576 6.963 747 HA LYS 205 HA LYS 205 4.783 7.899 4.529 748 HB2 LYS 205 HB2 LYS 205 5.943 7.697 7.299 749 HB3 LYS 205 HB1 LYS 205 6.855 8.407 5.976 750 HG2 LYS 205 HG2 LYS 205 4.173 9.365 6.939 751 HG3 LYS 205 HG1 LYS 205 5.729 10.078 7.368 752 HD2 LYS 205 HD2 LYS 205 6.068 10.257 4.804 753 HD3 LYS 205 HD1 LYS 205 4.314 10.063 4.732 754 HE2 LYS 205 HE2 LYS 205 5.891 12.224 6.098 755 HE3 LYS 205 HE1 LYS 205 4.752 12.393 4.763 756 HZ1 LYS 205 HZ1 LYS 205 4.076 11.623 7.551 757 HZ2 LYS 205 HZ2 LYS 205 2.964 11.672 6.274 758 HZ3 LYS 205 HZ3 LYS 205 3.717 13.096 6.803 759 H ILE 206 HN ILE 206 4.854 5.717 3.368 760 HA ILE 206 HA ILE 206 6.891 3.874 4.019 761 HB ILE 206 HB ILE 206 6.331 4.315 1.120 762 HG12 ILE 206 HG12 ILE 206 4.419 2.788 2.879 763 HG13 ILE 206 HG11 ILE 206 4.068 4.410 2.275 764 HG21 ILE 206 HG21 ILE 206 6.106 1.656 2.257 765 HG22 ILE 206 HG22 ILE 206 7.623 2.461 2.703 766 HG23 ILE 206 HG23 ILE 206 7.197 2.275 1.004 767 HD11 ILE 206 HD11 ILE 206 4.856 2.877 0.055 768 HD12 ILE 206 HD12 ILE 206 3.236 3.445 0.452 769 HD13 ILE 206 HD13 ILE 206 3.768 1.862 1.001 770 H THR 207 HN THR 207 8.947 4.431 4.237 771 HA THR 207 HA THR 207 10.007 6.555 2.513 772 HB THR 207 HB THR 207 11.500 5.489 4.879 773 HG1 THR 207 HG1 THR 207 8.985 6.377 5.038 774 HG21 THR 207 HG21 THR 207 11.822 8.077 5.046 775 HG22 THR 207 HG22 THR 207 11.267 8.063 3.372 776 HG23 THR 207 HG23 THR 207 12.712 7.160 3.831 777 H LYS 208 HN LYS 208 10.870 5.706 0.704 778 HA LYS 208 HA LYS 208 13.018 3.875 0.829 779 HB2 LYS 208 HB2 LYS 208 12.137 1.922 -0.147 780 HB3 LYS 208 HB1 LYS 208 11.017 2.350 1.132 781 HG2 LYS 208 HG2 LYS 208 10.587 2.885 -1.806 782 HG3 LYS 208 HG1 LYS 208 9.897 1.548 -0.898 783 HD2 LYS 208 HD2 LYS 208 8.143 2.935 -0.676 784 HD3 LYS 208 HD1 LYS 208 9.117 3.678 0.599 785 HE2 LYS 208 HE2 LYS 208 10.044 5.237 -1.061 786 HE3 LYS 208 HE1 LYS 208 9.005 4.521 -2.290 787 HZ1 LYS 208 HZ1 LYS 208 8.059 5.879 0.168 788 HZ2 LYS 208 HZ2 LYS 208 7.085 5.238 -1.063 789 HZ3 LYS 208 HZ3 LYS 208 8.098 6.556 -1.386 790 H THR 209 HN THR 209 12.928 2.823 -1.739 791 HA THR 209 HA THR 209 13.569 3.237 -3.836 792 HB THR 209 HB THR 209 12.568 4.979 -5.198 793 HG1 THR 209 HG1 THR 209 12.136 6.194 -2.793 794 HG21 THR 209 HG21 THR 209 10.457 3.817 -3.382 795 HG22 THR 209 HG22 THR 209 11.283 2.918 -4.655 796 HG23 THR 209 HG23 THR 209 10.276 4.303 -5.068 797 H ILE 210 HN ILE 210 15.511 3.710 -4.406 798 HA ILE 210 HA ILE 210 17.646 4.439 -4.156 799 HB ILE 210 HB ILE 210 18.071 6.711 -4.934 800 HG12 ILE 210 HG12 ILE 210 15.070 7.093 -4.853 801 HG13 ILE 210 HG11 ILE 210 16.221 7.873 -3.775 802 HG21 ILE 210 HG21 ILE 210 16.963 6.510 -7.120 803 HG22 ILE 210 HG22 ILE 210 15.907 5.268 -6.446 804 HG23 ILE 210 HG23 ILE 210 17.643 4.985 -6.556 805 HD11 ILE 210 HD11 ILE 210 15.515 9.384 -5.529 806 HD12 ILE 210 HD12 ILE 210 16.059 8.241 -6.758 807 HD13 ILE 210 HD13 ILE 210 17.231 9.011 -5.689 808 H GLN 211 HN GLN 211 16.498 4.138 -1.678 809 HA GLN 211 HA GLN 211 16.877 6.469 -0.061 810 HB2 GLN 211 HB2 GLN 211 16.449 4.928 1.835 811 HB3 GLN 211 HB1 GLN 211 15.202 4.866 0.599 812 HG2 GLN 211 HG2 GLN 211 16.140 2.805 -0.272 813 HG3 GLN 211 HG1 GLN 211 17.443 2.880 0.913 814 HE21 GLN 211 HE21 GLN 211 16.996 2.449 3.068 815 HE22 GLN 211 HE22 GLN 211 15.544 1.657 3.569 816 H ASN 212 HN ASN 212 18.552 7.011 1.224 817 HA ASN 212 HA ASN 212 21.065 5.641 0.714 818 HB2 ASN 212 HB2 ASN 212 20.907 8.123 0.534 819 HB3 ASN 212 HB1 ASN 212 20.552 8.194 2.257 820 HD21 ASN 212 HD21 ASN 212 22.970 7.557 -0.148 821 HD22 ASN 212 HD22 ASN 212 24.332 7.615 0.917 Start of MODEL 8 1 H1 SER 1 HT1 SER 1 -14.530 -7.412 -13.034 2 H2 SER 1 HT2 SER 1 -13.716 -6.097 -12.340 3 H3 SER 1 HT3 SER 1 -13.543 -6.428 -13.991 4 HA SER 1 HA SER 1 -14.987 -4.563 -13.668 5 HB2 SER 1 HB2 SER 1 -16.601 -6.969 -14.529 6 HB3 SER 1 HB1 SER 1 -16.789 -5.303 -15.071 7 HG SER 1 HG SER 1 -15.600 -6.785 -16.503 8 H GLU 2 HN GLU 2 -15.747 -7.327 -11.698 9 HA GLU 2 HA GLU 2 -18.014 -5.904 -10.507 10 HB2 GLU 2 HB2 GLU 2 -17.078 -8.740 -10.040 11 HB3 GLU 2 HB1 GLU 2 -18.538 -8.010 -9.387 12 HG2 GLU 2 HG2 GLU 2 -19.405 -7.722 -11.654 13 HG3 GLU 2 HG1 GLU 2 -17.949 -8.476 -12.299 14 H GLU 3 HN GLU 3 -15.063 -7.610 -9.482 15 HA GLU 3 HA GLU 3 -15.448 -7.098 -6.743 16 HB2 GLU 3 HB2 GLU 3 -12.936 -7.841 -8.241 17 HB3 GLU 3 HB1 GLU 3 -13.100 -7.861 -6.491 18 HG2 GLU 3 HG2 GLU 3 -14.866 -9.551 -6.686 19 HG3 GLU 3 HG1 GLU 3 -14.666 -9.541 -8.438 20 H GLU 4 HN GLU 4 -13.570 -5.340 -9.188 21 HA GLU 4 HA GLU 4 -12.406 -3.669 -7.099 22 HB2 GLU 4 HB2 GLU 4 -11.017 -2.689 -8.809 23 HB3 GLU 4 HB1 GLU 4 -10.969 -4.437 -8.966 24 HG2 GLU 4 HG2 GLU 4 -12.699 -2.642 -10.653 25 HG3 GLU 4 HG1 GLU 4 -11.089 -3.185 -11.116 26 H ASP 5 HN ASP 5 -14.964 -3.556 -9.413 27 HA ASP 5 HA ASP 5 -15.214 -0.666 -9.207 28 HB2 ASP 5 HB2 ASP 5 -15.643 -1.653 -11.378 29 HB3 ASP 5 HB1 ASP 5 -16.883 -2.701 -10.718 30 H LYS 6 HN LYS 6 -16.406 -3.438 -7.600 31 HA LYS 6 HA LYS 6 -18.482 -1.802 -6.311 32 HB2 LYS 6 HB2 LYS 6 -19.277 -3.688 -7.851 33 HB3 LYS 6 HB1 LYS 6 -18.667 -4.792 -6.628 34 HG2 LYS 6 HG2 LYS 6 -21.017 -4.504 -6.296 35 HG3 LYS 6 HG1 LYS 6 -20.179 -3.673 -4.980 36 HD2 LYS 6 HD2 LYS 6 -20.499 -1.545 -6.060 37 HD3 LYS 6 HD1 LYS 6 -21.199 -2.326 -7.481 38 HE2 LYS 6 HE2 LYS 6 -23.032 -3.176 -6.046 39 HE3 LYS 6 HE1 LYS 6 -22.341 -2.296 -4.686 40 HZ1 LYS 6 HZ1 LYS 6 -22.664 -0.236 -5.939 41 HZ2 LYS 6 HZ2 LYS 6 -24.123 -1.039 -5.672 42 HZ3 LYS 6 HZ3 LYS 6 -23.389 -1.104 -7.194 43 H CYS 7 HN CYS 7 -15.794 -1.992 -5.527 44 HA CYS 7 HA CYS 7 -15.487 -4.039 -3.541 45 HB2 CYS 7 HB2 CYS 7 -13.284 -2.677 -3.105 46 HB3 CYS 7 HB1 CYS 7 -13.492 -3.440 -4.690 47 HG CYS 7 HG CYS 7 -13.615 -1.261 -6.132 48 H LYS 8 HN LYS 8 -15.922 -3.903 -1.451 49 HA LYS 8 HA LYS 8 -17.000 -1.434 -0.372 50 HB2 LYS 8 HB2 LYS 8 -16.979 -4.298 0.493 51 HB3 LYS 8 HB1 LYS 8 -17.251 -3.049 1.695 52 HG2 LYS 8 HG2 LYS 8 -19.344 -3.979 0.838 53 HG3 LYS 8 HG1 LYS 8 -19.193 -2.257 0.494 54 HD2 LYS 8 HD2 LYS 8 -18.534 -2.754 -1.795 55 HD3 LYS 8 HD1 LYS 8 -18.605 -4.483 -1.458 56 HE2 LYS 8 HE2 LYS 8 -20.949 -2.600 -1.248 57 HE3 LYS 8 HE1 LYS 8 -20.601 -3.606 -2.652 58 HZ1 LYS 8 HZ1 LYS 8 -20.855 -5.566 -1.288 59 HZ2 LYS 8 HZ2 LYS 8 -22.246 -4.611 -1.175 60 HZ3 LYS 8 HZ3 LYS 8 -21.123 -4.622 0.088 61 HA PRO 9 HA PRO 9 -13.240 -0.205 1.611 62 HB2 PRO 9 HB2 PRO 9 -14.802 0.855 3.838 63 HB3 PRO 9 HB1 PRO 9 -13.795 1.709 2.663 64 HG2 PRO 9 HG2 PRO 9 -16.499 1.872 2.665 65 HG3 PRO 9 HG1 PRO 9 -15.523 2.014 1.193 66 HD2 PRO 9 HD2 PRO 9 -17.141 -0.288 2.189 67 HD3 PRO 9 HD1 PRO 9 -16.850 0.255 0.526 68 H MET 10 HN MET 10 -11.913 -1.455 2.757 69 HA MET 10 HA MET 10 -12.819 -3.317 4.701 70 HB2 MET 10 HB2 MET 10 -10.437 -3.686 5.180 71 HB3 MET 10 HB1 MET 10 -10.763 -3.710 3.457 72 HG2 MET 10 HG2 MET 10 -9.935 -1.425 3.271 73 HG3 MET 10 HG1 MET 10 -9.574 -1.433 4.994 74 HE1 MET 10 HE1 MET 10 -8.882 -3.155 1.569 75 HE2 MET 10 HE2 MET 10 -9.110 -4.565 2.606 76 HE3 MET 10 HE3 MET 10 -7.518 -4.210 1.939 77 H SER 11 HN SER 11 -12.196 -3.297 6.975 78 HA SER 11 HA SER 11 -13.173 -0.883 8.125 79 HB2 SER 11 HB2 SER 11 -13.042 -2.127 10.262 80 HB3 SER 11 HB1 SER 11 -13.874 -3.033 9.000 81 HG SER 11 HG SER 11 -11.933 -4.204 8.653 82 H TYR 12 HN TYR 12 -12.127 -0.212 10.329 83 HA TYR 12 HA TYR 12 -9.822 1.255 9.729 84 HB2 TYR 12 HB2 TYR 12 -11.497 1.807 11.480 85 HB3 TYR 12 HB1 TYR 12 -10.872 0.489 12.467 86 HD1 TYR 12 HD1 TYR 12 -8.371 0.630 13.108 87 HD2 TYR 12 HD2 TYR 12 -10.628 3.944 11.710 88 HE1 TYR 12 HE1 TYR 12 -6.762 2.155 14.163 89 HE2 TYR 12 HE2 TYR 12 -9.020 5.486 12.752 90 HH TYR 12 HH TYR 12 -5.992 4.430 13.976 91 H GLU 13 HN GLU 13 -10.157 -1.801 11.513 92 HA GLU 13 HA GLU 13 -7.499 -2.064 12.359 93 HB2 GLU 13 HB2 GLU 13 -9.422 -3.465 13.129 94 HB3 GLU 13 HB1 GLU 13 -9.378 -4.307 11.583 95 HG2 GLU 13 HG2 GLU 13 -7.069 -5.018 12.076 96 HG3 GLU 13 HG1 GLU 13 -7.204 -4.258 13.662 97 H GLU 14 HN GLU 14 -9.091 -2.961 9.369 98 HA GLU 14 HA GLU 14 -6.920 -4.484 8.320 99 HB2 GLU 14 HB2 GLU 14 -9.389 -3.311 7.044 100 HB3 GLU 14 HB1 GLU 14 -8.237 -4.313 6.175 101 HG2 GLU 14 HG2 GLU 14 -8.741 -6.208 7.486 102 HG3 GLU 14 HG1 GLU 14 -9.633 -5.239 8.665 103 H LYS 15 HN LYS 15 -8.168 -1.219 7.672 104 HA LYS 15 HA LYS 15 -6.338 -0.429 5.743 105 HB2 LYS 15 HB2 LYS 15 -7.735 1.143 7.901 106 HB3 LYS 15 HB1 LYS 15 -6.765 1.890 6.644 107 HG2 LYS 15 HG2 LYS 15 -8.260 1.379 4.980 108 HG3 LYS 15 HG1 LYS 15 -8.963 0.041 5.897 109 HD2 LYS 15 HD2 LYS 15 -10.234 1.431 7.237 110 HD3 LYS 15 HD1 LYS 15 -9.199 2.827 6.954 111 HE2 LYS 15 HE2 LYS 15 -10.561 1.776 4.567 112 HE3 LYS 15 HE1 LYS 15 -11.626 2.432 5.811 113 HZ1 LYS 15 HZ1 LYS 15 -10.269 4.461 5.796 114 HZ2 LYS 15 HZ2 LYS 15 -11.009 4.162 4.302 115 HZ3 LYS 15 HZ3 LYS 15 -9.361 3.839 4.507 116 H ARG 16 HN ARG 16 -6.099 -0.255 9.270 117 HA ARG 16 HA ARG 16 -3.553 0.953 9.379 118 HB2 ARG 16 HB2 ARG 16 -5.150 0.786 11.292 119 HB3 ARG 16 HB1 ARG 16 -4.784 -0.934 11.398 120 HG2 ARG 16 HG2 ARG 16 -2.294 0.091 11.515 121 HG3 ARG 16 HG1 ARG 16 -3.212 1.398 12.264 122 HD2 ARG 16 HD2 ARG 16 -2.484 -0.137 13.973 123 HD3 ARG 16 HD1 ARG 16 -4.234 -0.253 13.793 124 HE ARG 16 HE ARG 16 -2.544 -2.174 12.373 125 HH11 ARG 16 HH11 ARG 16 -4.818 -1.502 14.939 126 HH12 ARG 16 HH12 ARG 16 -5.188 -3.172 15.222 127 HH21 ARG 16 HH21 ARG 16 -3.044 -4.384 12.719 128 HH22 ARG 16 HH22 ARG 16 -4.188 -4.808 13.954 129 H GLN 17 HN GLN 17 -4.555 -2.466 9.461 130 HA GLN 17 HA GLN 17 -1.966 -3.527 9.760 131 HB2 GLN 17 HB2 GLN 17 -4.160 -4.711 10.192 132 HB3 GLN 17 HB1 GLN 17 -4.317 -4.890 8.450 133 HG2 GLN 17 HG2 GLN 17 -3.450 -6.920 9.401 134 HG3 GLN 17 HG1 GLN 17 -2.209 -6.151 8.412 135 HE21 GLN 17 HE21 GLN 17 -0.545 -7.209 9.480 136 HE22 GLN 17 HE22 GLN 17 -0.072 -6.795 11.095 137 H LEU 18 HN LEU 18 -3.778 -2.455 7.030 138 HA LEU 18 HA LEU 18 -2.191 -3.637 4.992 139 HB2 LEU 18 HB2 LEU 18 -4.559 -2.313 5.061 140 HB3 LEU 18 HB1 LEU 18 -3.509 -1.041 4.480 141 HG LEU 18 HG LEU 18 -3.774 -3.732 3.138 142 HD11 LEU 18 HD11 LEU 18 -5.125 -1.124 2.497 143 HD12 LEU 18 HD12 LEU 18 -5.905 -2.594 3.069 144 HD13 LEU 18 HD13 LEU 18 -5.146 -2.557 1.478 145 HD21 LEU 18 HD21 LEU 18 -1.742 -2.764 2.470 146 HD22 LEU 18 HD22 LEU 18 -2.442 -1.155 2.381 147 HD23 LEU 18 HD23 LEU 18 -2.883 -2.377 1.191 148 H SER 19 HN SER 19 -2.115 -0.540 6.691 149 HA SER 19 HA SER 19 0.101 0.557 5.366 150 HB2 SER 19 HB2 SER 19 -0.492 0.838 8.324 151 HB3 SER 19 HB1 SER 19 0.375 1.979 7.299 152 HG SER 19 HG SER 19 -2.183 1.352 6.461 153 H LEU 20 HN LEU 20 -0.199 -1.832 7.861 154 HA LEU 20 HA LEU 20 2.588 -1.939 8.492 155 HB2 LEU 20 HB2 LEU 20 0.252 -3.689 9.207 156 HB3 LEU 20 HB1 LEU 20 1.874 -3.978 9.786 157 HG LEU 20 HG LEU 20 0.335 -1.446 10.322 158 HD11 LEU 20 HD11 LEU 20 -0.495 -3.696 11.284 159 HD12 LEU 20 HD12 LEU 20 -0.317 -2.313 12.360 160 HD13 LEU 20 HD13 LEU 20 0.915 -3.577 12.332 161 HD21 LEU 20 HD21 LEU 20 2.855 -1.373 10.348 162 HD22 LEU 20 HD22 LEU 20 2.797 -2.526 11.679 163 HD23 LEU 20 HD23 LEU 20 2.069 -0.930 11.861 164 H ASP 21 HN ASP 21 0.454 -3.605 6.270 165 HA ASP 21 HA ASP 21 2.292 -5.780 5.897 166 HB2 ASP 21 HB2 ASP 21 0.717 -6.636 4.242 167 HB3 ASP 21 HB1 ASP 21 -0.068 -6.254 5.763 168 H ILE 22 HN ILE 22 1.508 -2.823 4.150 169 HA ILE 22 HA ILE 22 3.211 -3.413 1.928 170 HB ILE 22 HB ILE 22 2.300 -0.738 3.011 171 HG12 ILE 22 HG12 ILE 22 1.264 -2.205 0.588 172 HG13 ILE 22 HG11 ILE 22 0.567 -2.458 2.191 173 HG21 ILE 22 HG21 ILE 22 4.188 -0.279 1.685 174 HG22 ILE 22 HG22 ILE 22 2.781 0.028 0.660 175 HG23 ILE 22 HG23 ILE 22 3.703 -1.461 0.466 176 HD11 ILE 22 HD11 ILE 22 0.126 -0.062 2.308 177 HD12 ILE 22 HD12 ILE 22 -0.733 -0.850 0.996 178 HD13 ILE 22 HD13 ILE 22 0.701 0.124 0.660 179 H ASN 23 HN ASN 23 3.636 -1.863 5.040 180 HA ASN 23 HA ASN 23 6.271 -0.967 4.645 181 HB2 ASN 23 HB2 ASN 23 4.753 -0.109 6.359 182 HB3 ASN 23 HB1 ASN 23 4.764 -1.663 7.171 183 HD21 ASN 23 HD21 ASN 23 6.723 -2.262 8.313 184 HD22 ASN 23 HD22 ASN 23 7.920 -1.076 8.741 185 H LYS 24 HN LYS 24 4.948 -4.084 5.044 186 HA LYS 24 HA LYS 24 7.279 -5.355 6.156 187 HB2 LYS 24 HB2 LYS 24 4.761 -6.380 4.865 188 HB3 LYS 24 HB1 LYS 24 6.098 -7.459 5.240 189 HG2 LYS 24 HG2 LYS 24 5.908 -6.892 7.597 190 HG3 LYS 24 HG1 LYS 24 4.607 -5.756 7.234 191 HD2 LYS 24 HD2 LYS 24 3.261 -7.618 6.340 192 HD3 LYS 24 HD1 LYS 24 4.552 -8.738 6.759 193 HE2 LYS 24 HE2 LYS 24 3.099 -6.998 8.746 194 HE3 LYS 24 HE1 LYS 24 2.690 -8.678 8.406 195 HZ1 LYS 24 HZ1 LYS 24 4.941 -9.299 9.101 196 HZ2 LYS 24 HZ2 LYS 24 4.080 -8.548 10.344 197 HZ3 LYS 24 HZ3 LYS 24 5.265 -7.690 9.502 198 H LEU 25 HN LEU 25 6.058 -4.599 2.975 199 HA LEU 25 HA LEU 25 7.602 -6.438 1.485 200 HB2 LEU 25 HB2 LEU 25 6.535 -3.771 0.624 201 HB3 LEU 25 HB1 LEU 25 7.068 -5.038 -0.438 202 HG LEU 25 HG LEU 25 4.617 -4.989 1.289 203 HD11 LEU 25 HD11 LEU 25 5.107 -5.282 -1.653 204 HD12 LEU 25 HD12 LEU 25 4.427 -3.877 -0.837 205 HD13 LEU 25 HD13 LEU 25 3.530 -5.396 -0.880 206 HD21 LEU 25 HD21 LEU 25 5.884 -7.267 -0.156 207 HD22 LEU 25 HD22 LEU 25 4.212 -7.275 0.387 208 HD23 LEU 25 HD23 LEU 25 5.526 -7.174 1.562 209 HA PRO 26 HA PRO 26 11.677 -4.474 1.673 210 HB2 PRO 26 HB2 PRO 26 12.016 -6.163 -0.752 211 HB3 PRO 26 HB1 PRO 26 13.035 -6.047 0.691 212 HG2 PRO 26 HG2 PRO 26 11.461 -8.167 0.277 213 HG3 PRO 26 HG1 PRO 26 11.708 -7.506 1.903 214 HD2 PRO 26 HD2 PRO 26 9.350 -7.241 0.087 215 HD3 PRO 26 HD1 PRO 26 9.408 -7.396 1.853 216 H GLY 27 HN GLY 27 12.741 -2.921 0.371 217 HA2 GLY 27 HA2 GLY 27 11.224 -1.036 -0.827 218 HA3 GLY 27 HA1 GLY 27 12.918 -1.254 -1.212 219 H GLU 28 HN GLU 28 12.831 -3.642 -2.595 220 HA GLU 28 HA GLU 28 12.203 -2.978 -5.193 221 HB2 GLU 28 HB2 GLU 28 13.655 -4.832 -4.725 222 HB3 GLU 28 HB1 GLU 28 12.435 -5.631 -3.771 223 HG2 GLU 28 HG2 GLU 28 11.126 -5.903 -5.923 224 HG3 GLU 28 HG1 GLU 28 12.613 -5.431 -6.732 225 H LYS 29 HN LYS 29 10.320 -5.190 -3.145 226 HA LYS 29 HA LYS 29 8.080 -5.362 -4.873 227 HB2 LYS 29 HB2 LYS 29 8.389 -5.918 -1.920 228 HB3 LYS 29 HB1 LYS 29 7.018 -6.432 -2.902 229 HG2 LYS 29 HG2 LYS 29 9.836 -7.239 -3.513 230 HG3 LYS 29 HG1 LYS 29 8.803 -8.146 -2.416 231 HD2 LYS 29 HD2 LYS 29 7.164 -8.445 -4.208 232 HD3 LYS 29 HD1 LYS 29 8.219 -7.567 -5.317 233 HE2 LYS 29 HE2 LYS 29 8.352 -10.078 -5.459 234 HE3 LYS 29 HE1 LYS 29 9.887 -9.249 -5.210 235 HZ1 LYS 29 HZ1 LYS 29 9.877 -9.843 -2.927 236 HZ2 LYS 29 HZ2 LYS 29 9.530 -11.252 -3.795 237 HZ3 LYS 29 HZ3 LYS 29 8.292 -10.419 -2.999 238 H LEU 30 HN LEU 30 8.985 -3.357 -2.228 239 HA LEU 30 HA LEU 30 6.500 -2.229 -1.542 240 HB2 LEU 30 HB2 LEU 30 8.505 -2.196 -0.136 241 HB3 LEU 30 HB1 LEU 30 9.310 -1.149 -1.287 242 HG LEU 30 HG LEU 30 7.952 0.686 -0.722 243 HD11 LEU 30 HD11 LEU 30 6.254 -0.746 1.206 244 HD12 LEU 30 HD12 LEU 30 5.906 -1.028 -0.485 245 HD13 LEU 30 HD13 LEU 30 5.873 0.602 0.152 246 HD21 LEU 30 HD21 LEU 30 8.248 0.838 1.722 247 HD22 LEU 30 HD22 LEU 30 9.676 0.201 0.910 248 HD23 LEU 30 HD23 LEU 30 8.590 -0.890 1.770 249 H GLY 31 HN GLY 31 8.930 -1.293 -3.936 250 HA2 GLY 31 HA2 GLY 31 8.106 1.302 -4.484 251 HA3 GLY 31 HA1 GLY 31 8.867 0.239 -5.652 252 H ARG 32 HN ARG 32 6.724 -1.736 -5.644 253 HA ARG 32 HA ARG 32 5.034 -0.683 -7.615 254 HB2 ARG 32 HB2 ARG 32 5.325 -3.074 -7.395 255 HB3 ARG 32 HB1 ARG 32 4.636 -3.040 -5.781 256 HG2 ARG 32 HG2 ARG 32 3.027 -3.922 -7.374 257 HG3 ARG 32 HG1 ARG 32 2.470 -2.386 -6.717 258 HD2 ARG 32 HD2 ARG 32 2.083 -2.515 -9.139 259 HD3 ARG 32 HD1 ARG 32 3.199 -1.219 -8.718 260 HE ARG 32 HE ARG 32 4.779 -3.401 -9.296 261 HH11 ARG 32 HH11 ARG 32 2.339 -1.553 -10.994 262 HH12 ARG 32 HH12 ARG 32 3.098 -1.733 -12.544 263 HH21 ARG 32 HH21 ARG 32 5.780 -3.641 -11.345 264 HH22 ARG 32 HH22 ARG 32 5.047 -2.924 -12.743 265 H VAL 33 HN VAL 33 4.478 -1.088 -4.130 266 HA VAL 33 HA VAL 33 1.718 -0.352 -4.272 267 HB VAL 33 HB VAL 33 3.072 0.043 -1.686 268 HG11 VAL 33 HG11 VAL 33 0.716 -1.610 -2.581 269 HG12 VAL 33 HG12 VAL 33 0.651 0.057 -2.005 270 HG13 VAL 33 HG13 VAL 33 1.158 -1.227 -0.918 271 HG21 VAL 33 HG21 VAL 33 4.449 -1.767 -2.354 272 HG22 VAL 33 HG22 VAL 33 3.097 -2.607 -3.111 273 HG23 VAL 33 HG23 VAL 33 3.172 -2.463 -1.356 274 H VAL 34 HN VAL 34 4.613 1.420 -3.197 275 HA VAL 34 HA VAL 34 3.442 3.873 -2.620 276 HB VAL 34 HB VAL 34 5.606 4.358 -2.270 277 HG11 VAL 34 HG11 VAL 34 6.049 1.997 -2.403 278 HG12 VAL 34 HG12 VAL 34 7.416 2.942 -2.992 279 HG13 VAL 34 HG13 VAL 34 6.339 2.137 -4.134 280 HG21 VAL 34 HG21 VAL 34 5.499 5.765 -4.232 281 HG22 VAL 34 HG22 VAL 34 5.871 4.398 -5.273 282 HG23 VAL 34 HG23 VAL 34 7.086 5.008 -4.151 283 H HIS 35 HN HIS 35 4.357 2.498 -5.712 284 HA HIS 35 HA HIS 35 3.555 4.696 -7.308 285 HB2 HIS 35 HB2 HIS 35 5.081 2.953 -8.121 286 HB3 HIS 35 HB1 HIS 35 3.775 1.777 -8.046 287 HD1 HIS 35 HD1 HIS 35 4.815 4.875 -9.952 288 HD2 HIS 35 HD2 HIS 35 2.182 1.678 -10.281 289 HE1 HIS 35 HE1 HIS 35 3.845 5.030 -12.267 290 HE2 HIS 35 HE2 HIS 35 2.340 3.021 -12.482 291 H ILE 36 HN ILE 36 1.854 1.720 -6.319 292 HA ILE 36 HA ILE 36 -0.472 2.100 -7.823 293 HB ILE 36 HB ILE 36 -0.355 0.812 -5.084 294 HG12 ILE 36 HG12 ILE 36 0.048 -0.352 -7.846 295 HG13 ILE 36 HG11 ILE 36 1.216 -0.310 -6.537 296 HG21 ILE 36 HG21 ILE 36 -2.563 0.546 -5.317 297 HG22 ILE 36 HG22 ILE 36 -2.274 -0.378 -6.792 298 HG23 ILE 36 HG23 ILE 36 -2.512 1.366 -6.878 299 HD11 ILE 36 HD11 ILE 36 -0.314 -1.797 -5.236 300 HD12 ILE 36 HD12 ILE 36 0.369 -2.519 -6.692 301 HD13 ILE 36 HD13 ILE 36 -1.296 -1.946 -6.694 302 H ILE 37 HN ILE 37 0.198 3.126 -4.461 303 HA ILE 37 HA ILE 37 -2.322 4.319 -4.077 304 HB ILE 37 HB ILE 37 0.269 5.041 -2.694 305 HG12 ILE 37 HG12 ILE 37 -1.566 3.670 -1.007 306 HG13 ILE 37 HG11 ILE 37 -1.435 2.742 -2.498 307 HG21 ILE 37 HG21 ILE 37 -1.930 6.553 -2.747 308 HG22 ILE 37 HG22 ILE 37 -0.891 6.429 -1.327 309 HG23 ILE 37 HG23 ILE 37 -2.367 5.467 -1.426 310 HD11 ILE 37 HD11 ILE 37 0.967 2.618 -2.226 311 HD12 ILE 37 HD12 ILE 37 0.140 1.989 -0.801 312 HD13 ILE 37 HD13 ILE 37 0.867 3.596 -0.762 313 H GLN 38 HN GLN 38 0.789 5.790 -4.969 314 HA GLN 38 HA GLN 38 -0.105 8.414 -5.211 315 HB2 GLN 38 HB2 GLN 38 2.136 6.941 -6.577 316 HB3 GLN 38 HB1 GLN 38 1.834 8.643 -6.895 317 HG2 GLN 38 HG2 GLN 38 1.900 8.569 -4.151 318 HG3 GLN 38 HG1 GLN 38 3.083 7.338 -4.595 319 HE21 GLN 38 HE21 GLN 38 4.752 8.646 -3.786 320 HE22 GLN 38 HE22 GLN 38 5.336 10.015 -4.665 321 H SER 39 HN SER 39 -0.252 5.770 -7.522 322 HA SER 39 HA SER 39 -1.055 7.383 -9.726 323 HB2 SER 39 HB2 SER 39 -0.013 5.208 -10.081 324 HB3 SER 39 HB1 SER 39 -1.345 4.406 -9.250 325 HG SER 39 HG SER 39 -1.741 6.014 -11.548 326 H ARG 40 HN ARG 40 -2.818 5.442 -7.330 327 HA ARG 40 HA ARG 40 -5.345 5.955 -8.614 328 HB2 ARG 40 HB2 ARG 40 -4.810 4.754 -5.906 329 HB3 ARG 40 HB1 ARG 40 -6.329 4.698 -6.786 330 HG2 ARG 40 HG2 ARG 40 -4.672 3.589 -8.607 331 HG3 ARG 40 HG1 ARG 40 -3.899 3.076 -7.105 332 HD2 ARG 40 HD2 ARG 40 -5.528 1.438 -7.890 333 HD3 ARG 40 HD1 ARG 40 -5.960 2.128 -6.329 334 HE ARG 40 HE ARG 40 -7.381 3.688 -7.889 335 HH11 ARG 40 HH11 ARG 40 -6.923 0.228 -8.161 336 HH12 ARG 40 HH12 ARG 40 -8.470 -0.041 -8.896 337 HH21 ARG 40 HH21 ARG 40 -9.409 3.332 -8.848 338 HH22 ARG 40 HH22 ARG 40 -9.882 1.721 -9.284 339 H GLU 41 HN GLU 41 -3.575 7.197 -5.857 340 HA GLU 41 HA GLU 41 -5.746 9.120 -5.349 341 HB2 GLU 41 HB2 GLU 41 -3.428 8.433 -3.561 342 HB3 GLU 41 HB1 GLU 41 -4.811 9.426 -3.144 343 HG2 GLU 41 HG2 GLU 41 -4.733 6.462 -3.613 344 HG3 GLU 41 HG1 GLU 41 -5.104 7.319 -2.121 345 HA PRO 42 HA PRO 42 -2.564 11.666 -7.504 346 HB2 PRO 42 HB2 PRO 42 -4.900 13.408 -7.950 347 HB3 PRO 42 HB1 PRO 42 -3.751 12.749 -9.116 348 HG2 PRO 42 HG2 PRO 42 -6.264 11.837 -8.965 349 HG3 PRO 42 HG1 PRO 42 -4.905 10.757 -9.326 350 HD2 PRO 42 HD2 PRO 42 -6.376 11.156 -6.748 351 HD3 PRO 42 HD1 PRO 42 -5.798 9.650 -7.499 352 H SER 43 HN SER 43 -4.681 12.277 -4.863 353 HA SER 43 HA SER 43 -3.967 14.987 -4.379 354 HB2 SER 43 HB2 SER 43 -5.105 12.921 -2.484 355 HB3 SER 43 HB1 SER 43 -5.042 14.659 -2.191 356 HG SER 43 HG SER 43 -6.936 14.610 -3.107 357 H LEU 44 HN LEU 44 -2.355 12.009 -3.785 358 HA LEU 44 HA LEU 44 -0.505 13.425 -1.985 359 HB2 LEU 44 HB2 LEU 44 0.119 11.188 -1.083 360 HB3 LEU 44 HB1 LEU 44 -1.515 11.691 -0.724 361 HG LEU 44 HG LEU 44 -2.077 10.234 -2.860 362 HD11 LEU 44 HD11 LEU 44 0.301 9.756 -3.336 363 HD12 LEU 44 HD12 LEU 44 -0.662 8.302 -3.073 364 HD13 LEU 44 HD13 LEU 44 0.405 8.896 -1.801 365 HD21 LEU 44 HD21 LEU 44 -2.975 9.885 -0.632 366 HD22 LEU 44 HD22 LEU 44 -1.473 9.107 -0.130 367 HD23 LEU 44 HD23 LEU 44 -2.494 8.349 -1.352 368 H LYS 45 HN LYS 45 -0.682 12.940 -5.027 369 HA LYS 45 HA LYS 45 1.660 11.407 -5.612 370 HB2 LYS 45 HB2 LYS 45 1.374 11.993 -7.878 371 HB3 LYS 45 HB1 LYS 45 -0.248 11.840 -7.234 372 HG2 LYS 45 HG2 LYS 45 -0.391 14.278 -7.037 373 HG3 LYS 45 HG1 LYS 45 1.231 14.413 -7.717 374 HD2 LYS 45 HD2 LYS 45 -0.906 12.965 -9.207 375 HD3 LYS 45 HD1 LYS 45 -0.828 14.715 -9.271 376 HE2 LYS 45 HE2 LYS 45 0.354 13.922 -11.142 377 HE3 LYS 45 HE1 LYS 45 1.549 14.433 -9.971 378 HZ1 LYS 45 HZ1 LYS 45 2.083 12.313 -11.071 379 HZ2 LYS 45 HZ2 LYS 45 0.721 11.619 -10.354 380 HZ3 LYS 45 HZ3 LYS 45 1.992 12.177 -9.391 381 H ASN 46 HN ASN 46 1.217 14.461 -4.327 382 HA ASN 46 HA ASN 46 3.563 15.691 -5.480 383 HB2 ASN 46 HB2 ASN 46 3.049 17.600 -4.159 384 HB3 ASN 46 HB1 ASN 46 1.500 16.964 -4.698 385 HD21 ASN 46 HD21 ASN 46 0.127 15.982 -3.196 386 HD22 ASN 46 HD22 ASN 46 0.346 16.178 -1.492 387 H SER 47 HN SER 47 2.931 13.497 -2.981 388 HA SER 47 HA SER 47 4.918 14.233 -1.120 389 HB2 SER 47 HB2 SER 47 3.834 11.451 -1.681 390 HB3 SER 47 HB1 SER 47 4.602 12.017 -0.193 391 HG SER 47 HG SER 47 2.862 13.415 0.131 392 H ASN 48 HN ASN 48 7.072 13.742 -1.001 393 HA ASN 48 HA ASN 48 8.525 13.169 -3.333 394 HB2 ASN 48 HB2 ASN 48 9.422 12.731 -0.468 395 HB3 ASN 48 HB1 ASN 48 10.470 12.874 -1.873 396 HD21 ASN 48 HD21 ASN 48 10.514 14.429 0.519 397 HD22 ASN 48 HD22 ASN 48 10.238 16.070 0.056 398 HA PRO 49 HA PRO 49 7.577 8.922 -3.800 399 HB2 PRO 49 HB2 PRO 49 9.747 8.181 -5.322 400 HB3 PRO 49 HB1 PRO 49 8.288 8.952 -5.946 401 HG2 PRO 49 HG2 PRO 49 10.939 10.158 -5.262 402 HG3 PRO 49 HG1 PRO 49 9.856 10.526 -6.619 403 HD2 PRO 49 HD2 PRO 49 10.022 12.117 -4.452 404 HD3 PRO 49 HD1 PRO 49 8.493 11.880 -5.325 405 H ASP 50 HN ASP 50 10.616 9.951 -2.466 406 HA ASP 50 HA ASP 50 11.437 7.311 -1.686 407 HB2 ASP 50 HB2 ASP 50 12.494 9.898 -0.563 408 HB3 ASP 50 HB1 ASP 50 13.319 8.352 -0.670 409 H GLU 51 HN GLU 51 9.560 9.893 -0.339 410 HA GLU 51 HA GLU 51 9.163 8.401 2.164 411 HB2 GLU 51 HB2 GLU 51 10.010 11.262 1.790 412 HB3 GLU 51 HB1 GLU 51 8.990 10.864 3.163 413 HG2 GLU 51 HG2 GLU 51 10.643 9.356 4.012 414 HG3 GLU 51 HG1 GLU 51 11.620 9.548 2.565 415 H ILE 52 HN ILE 52 7.240 7.877 0.634 416 HA ILE 52 HA ILE 52 5.563 10.075 -0.101 417 HB ILE 52 HB ILE 52 4.245 8.562 -1.305 418 HG12 ILE 52 HG12 ILE 52 5.500 6.220 0.019 419 HG13 ILE 52 HG11 ILE 52 4.048 6.975 0.679 420 HG21 ILE 52 HG21 ILE 52 6.922 7.213 -1.308 421 HG22 ILE 52 HG22 ILE 52 6.654 8.805 -2.031 422 HG23 ILE 52 HG23 ILE 52 5.791 7.399 -2.655 423 HD11 ILE 52 HD11 ILE 52 2.896 6.605 -1.421 424 HD12 ILE 52 HD12 ILE 52 3.507 5.084 -0.766 425 HD13 ILE 52 HD13 ILE 52 4.347 5.868 -2.100 426 H GLU 53 HN GLU 53 3.369 10.365 0.472 427 HA GLU 53 HA GLU 53 2.939 9.766 3.313 428 HB2 GLU 53 HB2 GLU 53 3.165 12.153 2.021 429 HB3 GLU 53 HB1 GLU 53 1.427 11.927 1.978 430 HG2 GLU 53 HG2 GLU 53 3.225 12.151 4.367 431 HG3 GLU 53 HG1 GLU 53 1.918 13.224 3.881 432 H ILE 54 HN ILE 54 1.430 8.204 3.601 433 HA ILE 54 HA ILE 54 -0.756 7.953 1.618 434 HB ILE 54 HB ILE 54 -0.207 5.964 3.808 435 HG12 ILE 54 HG12 ILE 54 1.869 6.169 2.447 436 HG13 ILE 54 HG11 ILE 54 1.100 4.589 2.304 437 HG21 ILE 54 HG21 ILE 54 -1.372 4.438 2.273 438 HG22 ILE 54 HG22 ILE 54 -1.596 5.774 1.146 439 HG23 ILE 54 HG23 ILE 54 -2.357 5.825 2.736 440 HD11 ILE 54 HD11 ILE 54 1.790 5.146 0.172 441 HD12 ILE 54 HD12 ILE 54 1.192 6.805 0.301 442 HD13 ILE 54 HD13 ILE 54 0.052 5.461 0.182 443 H ASP 55 HN ASP 55 -2.867 8.358 2.251 444 HA ASP 55 HA ASP 55 -3.318 8.539 5.160 445 HB2 ASP 55 HB2 ASP 55 -3.493 10.762 3.984 446 HB3 ASP 55 HB1 ASP 55 -4.864 10.103 3.092 447 H PHE 56 HN PHE 56 -4.156 6.580 5.575 448 HA PHE 56 HA PHE 56 -5.439 5.054 3.602 449 HB2 PHE 56 HB2 PHE 56 -4.633 4.696 6.373 450 HB3 PHE 56 HB1 PHE 56 -6.055 3.757 5.917 451 HD1 PHE 56 HD1 PHE 56 -2.536 4.469 5.023 452 HD2 PHE 56 HD2 PHE 56 -5.883 1.905 4.543 453 HE1 PHE 56 HE1 PHE 56 -1.126 2.858 3.815 454 HE2 PHE 56 HE2 PHE 56 -4.493 0.300 3.340 455 HZ PHE 56 HZ PHE 56 -2.107 0.751 2.976 456 H GLU 57 HN GLU 57 -6.761 7.448 5.608 457 HA GLU 57 HA GLU 57 -9.420 6.284 5.522 458 HB2 GLU 57 HB2 GLU 57 -8.309 8.789 6.738 459 HB3 GLU 57 HB1 GLU 57 -10.030 8.428 6.726 460 HG2 GLU 57 HG2 GLU 57 -7.927 6.638 7.916 461 HG3 GLU 57 HG1 GLU 57 -8.872 7.811 8.830 462 H THR 58 HN THR 58 -7.568 7.951 3.374 463 HA THR 58 HA THR 58 -9.968 9.135 2.143 464 HB THR 58 HB THR 58 -8.484 10.846 1.108 465 HG1 THR 58 HG1 THR 58 -6.552 10.078 3.040 466 HG21 THR 58 HG21 THR 58 -8.558 10.686 4.114 467 HG22 THR 58 HG22 THR 58 -9.754 11.447 3.061 468 HG23 THR 58 HG23 THR 58 -8.139 12.144 3.212 469 H LEU 59 HN LEU 59 -7.616 6.790 1.818 470 HA LEU 59 HA LEU 59 -7.275 6.827 -1.022 471 HB2 LEU 59 HB2 LEU 59 -7.293 4.240 0.490 472 HB3 LEU 59 HB1 LEU 59 -6.302 4.727 -0.861 473 HG LEU 59 HG LEU 59 -5.976 5.616 1.994 474 HD11 LEU 59 HD11 LEU 59 -4.437 3.739 0.221 475 HD12 LEU 59 HD12 LEU 59 -5.195 3.408 1.778 476 HD13 LEU 59 HD13 LEU 59 -3.768 4.439 1.695 477 HD21 LEU 59 HD21 LEU 59 -4.632 6.514 -0.522 478 HD22 LEU 59 HD22 LEU 59 -3.802 6.579 1.023 479 HD23 LEU 59 HD23 LEU 59 -5.297 7.482 0.785 480 H LYS 60 HN LYS 60 -8.457 5.741 -2.602 481 HA LYS 60 HA LYS 60 -11.224 5.283 -2.135 482 HB2 LYS 60 HB2 LYS 60 -9.484 4.368 -4.440 483 HB3 LYS 60 HB1 LYS 60 -11.239 4.484 -4.457 484 HG2 LYS 60 HG2 LYS 60 -11.080 6.908 -4.185 485 HG3 LYS 60 HG1 LYS 60 -9.319 6.792 -4.152 486 HD2 LYS 60 HD2 LYS 60 -9.349 5.867 -6.423 487 HD3 LYS 60 HD1 LYS 60 -11.106 6.033 -6.459 488 HE2 LYS 60 HE2 LYS 60 -10.064 7.903 -7.601 489 HE3 LYS 60 HE1 LYS 60 -10.873 8.454 -6.135 490 HZ1 LYS 60 HZ1 LYS 60 -8.763 9.514 -6.264 491 HZ2 LYS 60 HZ2 LYS 60 -7.957 8.049 -6.528 492 HZ3 LYS 60 HZ3 LYS 60 -8.663 8.367 -5.022 493 HA PRO 61 HA PRO 61 -11.389 1.166 -0.522 494 HB2 PRO 61 HB2 PRO 61 -13.565 0.626 -2.455 495 HB3 PRO 61 HB1 PRO 61 -13.586 0.538 -0.694 496 HG2 PRO 61 HG2 PRO 61 -14.804 2.516 -2.071 497 HG3 PRO 61 HG1 PRO 61 -14.114 2.764 -0.459 498 HD2 PRO 61 HD2 PRO 61 -13.099 3.644 -3.112 499 HD3 PRO 61 HD1 PRO 61 -12.882 4.381 -1.512 500 H SER 62 HN SER 62 -11.422 1.676 -3.981 501 HA SER 62 HA SER 62 -10.741 -0.993 -4.704 502 HB2 SER 62 HB2 SER 62 -10.098 0.245 -6.902 503 HB3 SER 62 HB1 SER 62 -11.793 0.232 -6.403 504 HG SER 62 HG SER 62 -11.572 2.330 -6.613 505 H THR 63 HN THR 63 -8.955 1.953 -4.027 506 HA THR 63 HA THR 63 -6.403 1.056 -4.776 507 HB THR 63 HB THR 63 -6.853 2.961 -2.462 508 HG1 THR 63 HG1 THR 63 -7.163 4.599 -4.051 509 HG21 THR 63 HG21 THR 63 -4.548 2.301 -3.098 510 HG22 THR 63 HG22 THR 63 -4.856 4.019 -3.318 511 HG23 THR 63 HG23 THR 63 -4.833 2.940 -4.712 512 H LEU 64 HN LEU 64 -8.076 1.032 -1.644 513 HA LEU 64 HA LEU 64 -6.110 -0.196 -0.113 514 HB2 LEU 64 HB2 LEU 64 -9.113 -0.335 0.061 515 HB3 LEU 64 HB1 LEU 64 -8.063 -1.056 1.265 516 HG LEU 64 HG LEU 64 -8.109 1.880 0.579 517 HD11 LEU 64 HD11 LEU 64 -10.197 1.170 1.665 518 HD12 LEU 64 HD12 LEU 64 -9.217 2.173 2.730 519 HD13 LEU 64 HD13 LEU 64 -9.258 0.428 2.957 520 HD21 LEU 64 HD21 LEU 64 -5.969 1.273 1.389 521 HD22 LEU 64 HD22 LEU 64 -6.671 0.283 2.664 522 HD23 LEU 64 HD23 LEU 64 -6.841 2.037 2.715 523 H ARG 65 HN ARG 65 -8.547 -1.694 -2.187 524 HA ARG 65 HA ARG 65 -7.856 -4.330 -1.258 525 HB2 ARG 65 HB2 ARG 65 -9.855 -3.178 -3.085 526 HB3 ARG 65 HB1 ARG 65 -9.344 -4.800 -3.470 527 HG2 ARG 65 HG2 ARG 65 -10.508 -3.876 -0.867 528 HG3 ARG 65 HG1 ARG 65 -11.353 -4.847 -2.084 529 HD2 ARG 65 HD2 ARG 65 -9.647 -6.633 -1.705 530 HD3 ARG 65 HD1 ARG 65 -8.989 -5.664 -0.384 531 HE ARG 65 HE ARG 65 -11.719 -5.925 0.062 532 HH11 ARG 65 HH11 ARG 65 -8.865 -7.959 0.063 533 HH12 ARG 65 HH12 ARG 65 -9.585 -9.155 1.089 534 HH21 ARG 65 HH21 ARG 65 -12.642 -7.495 1.408 535 HH22 ARG 65 HH22 ARG 65 -11.717 -8.895 1.856 536 H GLU 66 HN GLU 66 -6.687 -2.192 -3.665 537 HA GLU 66 HA GLU 66 -5.430 -4.288 -5.200 538 HB2 GLU 66 HB2 GLU 66 -6.142 -2.279 -6.350 539 HB3 GLU 66 HB1 GLU 66 -5.188 -1.275 -5.269 540 HG2 GLU 66 HG2 GLU 66 -4.079 -1.460 -7.384 541 HG3 GLU 66 HG1 GLU 66 -3.136 -2.321 -6.164 542 H LEU 67 HN LEU 67 -4.633 -1.963 -2.705 543 HA LEU 67 HA LEU 67 -1.839 -2.392 -2.680 544 HB2 LEU 67 HB2 LEU 67 -3.661 -1.515 -0.423 545 HB3 LEU 67 HB1 LEU 67 -1.928 -1.253 -0.500 546 HG LEU 67 HG LEU 67 -4.015 0.015 -2.281 547 HD11 LEU 67 HD11 LEU 67 -2.173 1.247 -0.244 548 HD12 LEU 67 HD12 LEU 67 -3.871 0.866 0.045 549 HD13 LEU 67 HD13 LEU 67 -3.430 2.062 -1.175 550 HD21 LEU 67 HD21 LEU 67 -1.824 -0.526 -3.390 551 HD22 LEU 67 HD22 LEU 67 -1.074 0.588 -2.249 552 HD23 LEU 67 HD23 LEU 67 -2.290 1.172 -3.380 553 H GLU 68 HN GLU 68 -4.534 -3.590 -0.727 554 HA GLU 68 HA GLU 68 -2.992 -5.269 0.944 555 HB2 GLU 68 HB2 GLU 68 -5.247 -4.468 1.535 556 HB3 GLU 68 HB1 GLU 68 -5.932 -5.475 0.267 557 HG2 GLU 68 HG2 GLU 68 -4.530 -7.314 1.619 558 HG3 GLU 68 HG1 GLU 68 -4.915 -6.198 2.926 559 H ARG 69 HN ARG 69 -5.142 -6.082 -1.823 560 HA ARG 69 HA ARG 69 -4.669 -8.820 -1.872 561 HB2 ARG 69 HB2 ARG 69 -6.356 -7.665 -3.257 562 HB3 ARG 69 HB1 ARG 69 -5.066 -7.071 -4.295 563 HG2 ARG 69 HG2 ARG 69 -4.450 -9.551 -4.571 564 HG3 ARG 69 HG1 ARG 69 -6.072 -9.859 -3.948 565 HD2 ARG 69 HD2 ARG 69 -5.988 -9.795 -6.420 566 HD3 ARG 69 HD1 ARG 69 -7.072 -8.592 -5.724 567 HE ARG 69 HE ARG 69 -4.921 -7.110 -6.021 568 HH11 ARG 69 HH11 ARG 69 -6.224 -9.496 -8.218 569 HH12 ARG 69 HH12 ARG 69 -5.653 -8.689 -9.639 570 HH21 ARG 69 HH21 ARG 69 -4.175 -6.015 -7.884 571 HH22 ARG 69 HH22 ARG 69 -4.482 -6.709 -9.451 572 H TYR 70 HN TYR 70 -2.677 -6.246 -3.155 573 HA TYR 70 HA TYR 70 -0.949 -8.001 -4.610 574 HB2 TYR 70 HB2 TYR 70 -1.033 -5.787 -5.429 575 HB3 TYR 70 HB1 TYR 70 -0.782 -5.097 -3.829 576 HD1 TYR 70 HD2 TYR 70 0.915 -7.006 -6.533 577 HD2 TYR 70 HD1 TYR 70 1.354 -4.610 -3.051 578 HE1 TYR 70 HE2 TYR 70 3.334 -6.875 -6.942 579 HE2 TYR 70 HE1 TYR 70 3.782 -4.475 -3.449 580 HH TYR 70 HH TYR 70 5.514 -5.437 -4.612 581 H VAL 71 HN VAL 71 -0.614 -6.230 -1.526 582 HA VAL 71 HA VAL 71 2.004 -7.172 -1.054 583 HB VAL 71 HB VAL 71 1.726 -6.432 1.238 584 HG11 VAL 71 HG11 VAL 71 0.503 -4.125 0.377 585 HG12 VAL 71 HG12 VAL 71 1.187 -4.811 -1.091 586 HG13 VAL 71 HG13 VAL 71 2.222 -4.481 0.298 587 HG21 VAL 71 HG21 VAL 71 -0.343 -6.962 2.013 588 HG22 VAL 71 HG22 VAL 71 -1.152 -6.468 0.523 589 HG23 VAL 71 HG23 VAL 71 -0.577 -5.249 1.662 590 H THR 72 HN THR 72 -1.161 -8.371 -0.015 591 HA THR 72 HA THR 72 -0.238 -10.351 1.725 592 HB THR 72 HB THR 72 -2.646 -9.552 1.419 593 HG1 THR 72 HG1 THR 72 -3.014 -11.207 2.664 594 HG21 THR 72 HG21 THR 72 -2.622 -10.096 -1.055 595 HG22 THR 72 HG22 THR 72 -4.042 -10.609 -0.151 596 HG23 THR 72 HG23 THR 72 -2.799 -11.782 -0.586 597 H SER 73 HN SER 73 -0.446 -10.278 -1.753 598 HA SER 73 HA SER 73 -0.028 -13.034 -2.219 599 HB2 SER 73 HB2 SER 73 0.170 -12.480 -4.467 600 HB3 SER 73 HB1 SER 73 -0.714 -11.079 -3.859 601 HG SER 73 HG SER 73 1.184 -9.908 -3.831 602 H CYS 74 HN CYS 74 2.062 -10.390 -1.413 603 HA CYS 74 HA CYS 74 4.487 -11.843 -2.078 604 HB2 CYS 74 HB2 CYS 74 4.276 -9.436 -2.630 605 HB3 CYS 74 HB1 CYS 74 4.145 -9.065 -0.912 606 HG CYS 74 HG CYS 74 6.720 -9.651 -0.271 607 H LEU 75 HN LEU 75 3.016 -10.351 0.825 608 HA LEU 75 HA LEU 75 4.860 -11.079 2.744 609 HB2 LEU 75 HB2 LEU 75 1.945 -11.369 3.337 610 HB3 LEU 75 HB1 LEU 75 3.218 -10.730 4.351 611 HG LEU 75 HG LEU 75 2.169 -9.309 1.926 612 HD11 LEU 75 HD11 LEU 75 1.550 -8.606 4.758 613 HD12 LEU 75 HD12 LEU 75 0.555 -9.767 3.884 614 HD13 LEU 75 HD13 LEU 75 0.721 -8.123 3.279 615 HD21 LEU 75 HD21 LEU 75 4.462 -8.793 2.699 616 HD22 LEU 75 HD22 LEU 75 3.794 -8.342 4.267 617 HD23 LEU 75 HD23 LEU 75 3.351 -7.428 2.823 618 H ARG 76 HN ARG 76 2.166 -12.954 1.464 619 HA ARG 76 HA ARG 76 2.790 -15.198 3.193 620 HB2 ARG 76 HB2 ARG 76 0.586 -14.732 1.181 621 HB3 ARG 76 HB1 ARG 76 0.749 -16.195 2.147 622 HG2 ARG 76 HG2 ARG 76 0.307 -15.058 4.144 623 HG3 ARG 76 HG1 ARG 76 0.583 -13.481 3.405 624 HD2 ARG 76 HD2 ARG 76 -1.415 -13.751 2.045 625 HD3 ARG 76 HD1 ARG 76 -1.682 -15.354 2.738 626 HE ARG 76 HE ARG 76 -1.537 -13.364 4.768 627 HH11 ARG 76 HH11 ARG 76 -3.660 -14.647 2.300 628 HH12 ARG 76 HH12 ARG 76 -5.111 -14.194 3.134 629 HH21 ARG 76 HH21 ARG 76 -3.447 -12.754 5.860 630 HH22 ARG 76 HH22 ARG 76 -4.990 -13.127 5.164 631 H LYS 77 HN LYS 77 4.573 -14.315 1.011 632 HA LYS 77 HA LYS 77 6.034 -15.226 -0.432 633 HB2 LYS 77 HB2 LYS 77 4.903 -17.639 0.887 634 HB3 LYS 77 HB1 LYS 77 6.026 -17.835 -0.454 635 HG2 LYS 77 HG2 LYS 77 7.763 -16.757 0.724 636 HG3 LYS 77 HG1 LYS 77 6.650 -16.150 1.951 637 HD2 LYS 77 HD2 LYS 77 6.235 -18.470 2.679 638 HD3 LYS 77 HD1 LYS 77 7.400 -19.035 1.478 639 HE2 LYS 77 HE2 LYS 77 8.410 -18.895 3.699 640 HE3 LYS 77 HE1 LYS 77 9.167 -17.769 2.575 641 HZ1 LYS 77 HZ1 LYS 77 8.736 -16.788 4.761 642 HZ2 LYS 77 HZ2 LYS 77 7.078 -17.034 4.553 643 HZ3 LYS 77 HZ3 LYS 77 7.914 -15.977 3.531 644 H LYS 78 HN LYS 78 3.705 -17.822 -0.907 645 HA LYS 78 HA LYS 78 2.817 -18.664 -2.816 646 HB2 LYS 78 HB2 LYS 78 1.194 -17.020 -1.764 647 HB3 LYS 78 HB1 LYS 78 1.664 -15.910 -3.047 648 HG2 LYS 78 HG2 LYS 78 -0.316 -16.981 -3.767 649 HG3 LYS 78 HG1 LYS 78 1.029 -17.673 -4.674 650 HD2 LYS 78 HD2 LYS 78 1.070 -19.603 -3.192 651 HD3 LYS 78 HD1 LYS 78 -0.258 -18.918 -2.255 652 HE2 LYS 78 HE2 LYS 78 -0.411 -19.627 -5.180 653 HE3 LYS 78 HE1 LYS 78 -0.961 -20.670 -3.871 654 HZ1 LYS 78 HZ1 LYS 78 -2.517 -18.919 -3.213 655 HZ2 LYS 78 HZ2 LYS 78 -2.802 -19.454 -4.790 656 HZ3 LYS 78 HZ3 LYS 78 -2.026 -17.978 -4.529 657 H ARG 79 HN ARG 79 2.728 -15.462 -4.175 658 HA ARG 79 HA ARG 79 4.801 -16.200 -6.082 659 HB2 ARG 79 HB2 ARG 79 3.333 -14.919 -7.816 660 HB3 ARG 79 HB1 ARG 79 3.001 -16.605 -7.464 661 HG2 ARG 79 HG2 ARG 79 0.890 -15.739 -7.434 662 HG3 ARG 79 HG1 ARG 79 1.313 -15.595 -5.729 663 HD2 ARG 79 HD2 ARG 79 0.257 -13.558 -6.540 664 HD3 ARG 79 HD1 ARG 79 1.934 -13.263 -6.079 665 HE ARG 79 HE ARG 79 1.422 -13.817 -8.892 666 HH11 ARG 79 HH11 ARG 79 2.027 -11.419 -6.409 667 HH12 ARG 79 HH12 ARG 79 2.499 -10.193 -7.543 668 HH21 ARG 79 HH21 ARG 79 2.072 -12.225 -10.369 669 HH22 ARG 79 HH22 ARG 79 2.535 -10.655 -9.797 670 H LYS 80 HN LYS 80 6.344 -14.902 -5.372 671 HA LYS 80 HA LYS 80 5.745 -12.026 -5.316 672 HB2 LYS 80 HB2 LYS 80 7.473 -11.806 -3.525 673 HB3 LYS 80 HB1 LYS 80 6.029 -12.673 -3.035 674 HG2 LYS 80 HG2 LYS 80 7.175 -14.777 -3.180 675 HG3 LYS 80 HG1 LYS 80 8.606 -13.994 -3.855 676 HD2 LYS 80 HD2 LYS 80 8.863 -12.709 -1.773 677 HD3 LYS 80 HD1 LYS 80 7.458 -13.539 -1.101 678 HE2 LYS 80 HE2 LYS 80 8.604 -15.662 -1.239 679 HE3 LYS 80 HE1 LYS 80 9.981 -14.901 -2.034 680 HZ1 LYS 80 HZ1 LYS 80 10.381 -13.617 -0.023 681 HZ2 LYS 80 HZ2 LYS 80 10.412 -15.273 0.308 682 HZ3 LYS 80 HZ3 LYS 80 9.061 -14.351 0.740 683 HA PRO 81 HA PRO 81 9.265 -12.962 -8.216 684 HB2 PRO 81 HB2 PRO 81 8.175 -12.086 -10.501 685 HB3 PRO 81 HB1 PRO 81 7.822 -13.700 -9.871 686 HG2 PRO 81 HG2 PRO 81 6.182 -11.207 -9.713 687 HG3 PRO 81 HG1 PRO 81 5.661 -12.865 -10.057 688 HD2 PRO 81 HD2 PRO 81 5.443 -11.654 -7.596 689 HD3 PRO 81 HD1 PRO 81 5.540 -13.414 -7.835 690 H GLN 82 HN GLN 82 10.396 -11.342 -9.702 691 HA GLN 82 HA GLN 82 9.881 -8.594 -8.811 692 HB2 GLN 82 HB2 GLN 82 12.278 -8.156 -8.570 693 HB3 GLN 82 HB1 GLN 82 11.721 -9.382 -7.453 694 HG2 GLN 82 HG2 GLN 82 13.181 -9.982 -10.016 695 HG3 GLN 82 HG1 GLN 82 13.968 -9.788 -8.452 696 HE21 GLN 82 HE21 GLN 82 12.200 -11.873 -10.514 697 HE22 GLN 82 HE22 GLN 82 12.194 -13.258 -9.477 698 H ALA 83 HN ALA 83 8.776 -8.883 -10.960 699 HA ALA 83 HA ALA 83 10.650 -8.152 -13.111 700 HB1 ALA 83 HB1 ALA 83 8.059 -9.669 -13.445 701 HB2 ALA 83 HB2 ALA 83 9.672 -10.380 -13.501 702 HB3 ALA 83 HB3 ALA 83 9.180 -9.210 -14.725 703 H1 GLU 201 HT1 GLU 201 -7.086 11.201 8.203 704 H2 GLU 201 HT2 GLU 201 -7.569 9.606 7.954 705 H3 GLU 201 HT3 GLU 201 -6.283 10.244 7.059 706 HA GLU 201 HA GLU 201 -4.998 10.499 9.090 707 HB2 GLU 201 HB2 GLU 201 -7.357 9.056 10.311 708 HB3 GLU 201 HB1 GLU 201 -5.815 9.305 11.116 709 HG2 GLU 201 HG2 GLU 201 -6.155 11.746 10.914 710 HG3 GLU 201 HG1 GLU 201 -7.752 11.431 10.240 711 H ILE 202 HN ILE 202 -4.404 8.260 10.487 712 HA ILE 202 HA ILE 202 -3.214 6.348 10.262 713 HB ILE 202 HB ILE 202 -5.285 5.669 8.161 714 HG12 ILE 202 HG12 ILE 202 -6.176 6.081 10.452 715 HG13 ILE 202 HG11 ILE 202 -6.408 4.425 9.901 716 HG21 ILE 202 HG21 ILE 202 -3.242 4.321 7.920 717 HG22 ILE 202 HG22 ILE 202 -4.604 3.346 8.470 718 HG23 ILE 202 HG23 ILE 202 -3.362 3.850 9.615 719 HD11 ILE 202 HD11 ILE 202 -4.482 3.719 11.234 720 HD12 ILE 202 HD12 ILE 202 -5.729 4.480 12.222 721 HD13 ILE 202 HD13 ILE 202 -4.274 5.378 11.797 722 H LYS 203 HN LYS 203 -1.493 7.644 9.519 723 HA LYS 203 HA LYS 203 -1.104 7.892 6.653 724 HB2 LYS 203 HB2 LYS 203 0.543 8.911 8.971 725 HB3 LYS 203 HB1 LYS 203 0.892 9.227 7.278 726 HG2 LYS 203 HG2 LYS 203 -1.309 10.350 7.085 727 HG3 LYS 203 HG1 LYS 203 -1.531 10.128 8.821 728 HD2 LYS 203 HD2 LYS 203 0.733 11.648 7.526 729 HD3 LYS 203 HD1 LYS 203 -0.695 12.376 8.262 730 HE2 LYS 203 HE2 LYS 203 -0.087 11.447 10.417 731 HE3 LYS 203 HE1 LYS 203 1.298 10.631 9.696 732 HZ1 LYS 203 HZ1 LYS 203 0.929 13.573 9.741 733 HZ2 LYS 203 HZ2 LYS 203 2.296 12.732 9.211 734 HZ3 LYS 203 HZ3 LYS 203 1.872 12.712 10.847 735 H LEU 204 HN LEU 204 0.871 7.279 5.649 736 HA LEU 204 HA LEU 204 2.483 5.241 7.002 737 HB2 LEU 204 HB2 LEU 204 0.511 4.327 5.500 738 HB3 LEU 204 HB1 LEU 204 1.574 4.773 4.185 739 HG LEU 204 HG LEU 204 1.971 2.630 6.265 740 HD11 LEU 204 HD11 LEU 204 2.070 2.635 3.248 741 HD12 LEU 204 HD12 LEU 204 0.717 2.083 4.240 742 HD13 LEU 204 HD13 LEU 204 2.258 1.226 4.297 743 HD21 LEU 204 HD21 LEU 204 4.074 3.639 4.355 744 HD22 LEU 204 HD22 LEU 204 4.212 2.255 5.439 745 HD23 LEU 204 HD23 LEU 204 4.083 3.885 6.101 746 H LYS 205 HN LYS 205 4.397 6.324 6.919 747 HA LYS 205 HA LYS 205 5.175 7.696 4.488 748 HB2 LYS 205 HB2 LYS 205 6.434 7.375 7.190 749 HB3 LYS 205 HB1 LYS 205 7.387 7.948 5.828 750 HG2 LYS 205 HG2 LYS 205 4.889 9.229 6.909 751 HG3 LYS 205 HG1 LYS 205 6.544 9.803 7.135 752 HD2 LYS 205 HD2 LYS 205 6.704 9.960 4.622 753 HD3 LYS 205 HD1 LYS 205 4.966 9.655 4.573 754 HE2 LYS 205 HE2 LYS 205 6.389 11.965 5.868 755 HE3 LYS 205 HE1 LYS 205 5.318 12.015 4.469 756 HZ1 LYS 205 HZ1 LYS 205 4.537 11.347 7.256 757 HZ2 LYS 205 HZ2 LYS 205 3.492 11.263 5.925 758 HZ3 LYS 205 HZ3 LYS 205 4.140 12.754 6.406 759 H ILE 206 HN ILE 206 5.065 5.814 3.144 760 HA ILE 206 HA ILE 206 6.765 3.581 3.523 761 HB ILE 206 HB ILE 206 5.902 4.591 0.810 762 HG12 ILE 206 HG12 ILE 206 4.329 2.843 2.707 763 HG13 ILE 206 HG11 ILE 206 3.872 4.460 2.179 764 HG21 ILE 206 HG21 ILE 206 6.000 1.746 1.613 765 HG22 ILE 206 HG22 ILE 206 7.537 2.613 1.394 766 HG23 ILE 206 HG23 ILE 206 6.387 2.513 0.060 767 HD11 ILE 206 HD11 ILE 206 4.360 2.638 -0.031 768 HD12 ILE 206 HD12 ILE 206 2.969 3.676 0.302 769 HD13 ILE 206 HD13 ILE 206 3.080 2.088 1.052 770 H THR 207 HN THR 207 8.926 3.712 3.619 771 HA THR 207 HA THR 207 10.263 5.819 2.072 772 HB THR 207 HB THR 207 12.221 5.248 3.636 773 HG1 THR 207 HG1 THR 207 11.221 3.276 4.423 774 HG21 THR 207 HG21 THR 207 11.325 6.677 5.415 775 HG22 THR 207 HG22 THR 207 9.697 6.447 4.777 776 HG23 THR 207 HG23 THR 207 10.907 7.299 3.818 777 H LYS 208 HN LYS 208 11.149 5.212 0.238 778 HA LYS 208 HA LYS 208 13.083 3.263 -0.018 779 HB2 LYS 208 HB2 LYS 208 12.096 1.435 -1.158 780 HB3 LYS 208 HB1 LYS 208 11.121 1.704 0.269 781 HG2 LYS 208 HG2 LYS 208 10.415 2.503 -2.546 782 HG3 LYS 208 HG1 LYS 208 9.740 1.156 -1.639 783 HD2 LYS 208 HD2 LYS 208 8.103 2.636 -1.188 784 HD3 LYS 208 HD1 LYS 208 9.228 3.202 0.048 785 HE2 LYS 208 HE2 LYS 208 10.119 4.839 -1.560 786 HE3 LYS 208 HE1 LYS 208 8.918 4.309 -2.734 787 HZ1 LYS 208 HZ1 LYS 208 7.183 5.032 -1.257 788 HZ2 LYS 208 HZ2 LYS 208 8.253 6.306 -1.570 789 HZ3 LYS 208 HZ3 LYS 208 8.317 5.492 -0.085 790 H THR 209 HN THR 209 12.747 2.501 -2.708 791 HA THR 209 HA THR 209 13.265 3.193 -4.779 792 HB THR 209 HB THR 209 12.015 5.020 -5.824 793 HG1 THR 209 HG1 THR 209 11.827 5.952 -3.336 794 HG21 THR 209 HG21 THR 209 10.126 3.516 -4.047 795 HG22 THR 209 HG22 THR 209 10.989 2.744 -5.375 796 HG23 THR 209 HG23 THR 209 9.864 4.064 -5.702 797 H ILE 210 HN ILE 210 14.807 4.244 -2.433 798 HA ILE 210 HA ILE 210 15.763 6.806 -3.367 799 HB ILE 210 HB ILE 210 17.411 6.632 -1.509 800 HG12 ILE 210 HG12 ILE 210 15.903 4.112 -0.778 801 HG13 ILE 210 HG11 ILE 210 17.522 4.139 -1.470 802 HG21 ILE 210 HG21 ILE 210 15.760 6.884 0.294 803 HG22 ILE 210 HG22 ILE 210 14.521 6.218 -0.769 804 HG23 ILE 210 HG23 ILE 210 15.296 7.751 -1.169 805 HD11 ILE 210 HD11 ILE 210 17.570 3.818 0.945 806 HD12 ILE 210 HD12 ILE 210 16.725 5.349 1.167 807 HD13 ILE 210 HD13 ILE 210 18.348 5.330 0.480 808 H GLN 211 HN GLN 211 17.405 7.127 -4.705 809 HA GLN 211 HA GLN 211 19.320 4.949 -5.127 810 HB2 GLN 211 HB2 GLN 211 19.322 5.309 -7.519 811 HB3 GLN 211 HB1 GLN 211 17.688 4.951 -6.987 812 HG2 GLN 211 HG2 GLN 211 18.677 7.748 -7.462 813 HG3 GLN 211 HG1 GLN 211 17.937 6.762 -8.717 814 HE21 GLN 211 HE21 GLN 211 15.738 6.315 -8.615 815 HE22 GLN 211 HE22 GLN 211 14.667 7.185 -7.574 816 H ASN 212 HN ASN 212 21.415 5.558 -5.465 817 HA ASN 212 HA ASN 212 22.135 8.311 -5.888 818 HB2 ASN 212 HB2 ASN 212 21.718 8.282 -3.450 819 HB3 ASN 212 HB1 ASN 212 22.873 6.964 -3.278 820 HD21 ASN 212 HD21 ASN 212 22.471 10.345 -3.987 821 HD22 ASN 212 HD22 ASN 212 24.124 10.795 -3.759 Start of MODEL 9 1 H1 SER 1 HT1 SER 1 -10.946 -7.616 -11.814 2 H2 SER 1 HT2 SER 1 -11.072 -8.663 -13.134 3 H3 SER 1 HT3 SER 1 -12.461 -7.930 -12.502 4 HA SER 1 HA SER 1 -10.195 -6.516 -13.765 5 HB2 SER 1 HB2 SER 1 -12.143 -6.070 -15.520 6 HB3 SER 1 HB1 SER 1 -11.243 -7.592 -15.564 7 HG SER 1 HG SER 1 -13.669 -7.626 -15.590 8 H GLU 2 HN GLU 2 -13.716 -6.093 -13.139 9 HA GLU 2 HA GLU 2 -13.141 -3.297 -12.454 10 HB2 GLU 2 HB2 GLU 2 -15.556 -2.917 -12.711 11 HB3 GLU 2 HB1 GLU 2 -14.839 -3.598 -14.163 12 HG2 GLU 2 HG2 GLU 2 -15.734 -5.759 -13.672 13 HG3 GLU 2 HG1 GLU 2 -16.295 -5.216 -12.090 14 H GLU 3 HN GLU 3 -13.690 -6.225 -10.927 15 HA GLU 3 HA GLU 3 -15.555 -5.664 -8.951 16 HB2 GLU 3 HB2 GLU 3 -13.126 -7.417 -8.576 17 HB3 GLU 3 HB1 GLU 3 -14.628 -7.493 -7.671 18 HG2 GLU 3 HG2 GLU 3 -14.893 -9.239 -9.117 19 HG3 GLU 3 HG1 GLU 3 -15.680 -7.944 -10.017 20 H GLU 4 HN GLU 4 -12.126 -4.899 -9.042 21 HA GLU 4 HA GLU 4 -11.927 -4.153 -6.301 22 HB2 GLU 4 HB2 GLU 4 -9.797 -3.024 -6.955 23 HB3 GLU 4 HB1 GLU 4 -9.892 -4.693 -7.507 24 HG2 GLU 4 HG2 GLU 4 -10.488 -3.938 -9.744 25 HG3 GLU 4 HG1 GLU 4 -10.438 -2.263 -9.201 26 H ASP 5 HN ASP 5 -12.777 -2.381 -9.232 27 HA ASP 5 HA ASP 5 -12.698 0.189 -7.952 28 HB2 ASP 5 HB2 ASP 5 -13.836 -0.689 -10.619 29 HB3 ASP 5 HB1 ASP 5 -13.853 0.980 -10.053 30 H LYS 6 HN LYS 6 -14.856 -2.393 -7.944 31 HA LYS 6 HA LYS 6 -17.107 -0.640 -7.215 32 HB2 LYS 6 HB2 LYS 6 -17.290 -2.259 -9.200 33 HB3 LYS 6 HB1 LYS 6 -17.323 -3.543 -8.000 34 HG2 LYS 6 HG2 LYS 6 -19.570 -3.071 -8.578 35 HG3 LYS 6 HG1 LYS 6 -19.311 -2.373 -6.975 36 HD2 LYS 6 HD2 LYS 6 -18.965 -0.173 -7.990 37 HD3 LYS 6 HD1 LYS 6 -19.219 -0.870 -9.590 38 HE2 LYS 6 HE2 LYS 6 -21.229 -0.748 -7.351 39 HE3 LYS 6 HE1 LYS 6 -21.231 0.237 -8.810 40 HZ1 LYS 6 HZ1 LYS 6 -22.783 -1.573 -9.023 41 HZ2 LYS 6 HZ2 LYS 6 -21.580 -2.708 -8.681 42 HZ3 LYS 6 HZ3 LYS 6 -21.507 -1.807 -10.111 43 H CYS 7 HN CYS 7 -14.736 -1.804 -5.679 44 HA CYS 7 HA CYS 7 -15.939 -3.738 -3.894 45 HB2 CYS 7 HB2 CYS 7 -13.476 -3.665 -4.752 46 HB3 CYS 7 HB1 CYS 7 -13.247 -2.465 -3.486 47 HG CYS 7 HG CYS 7 -14.188 -5.723 -3.042 48 H LYS 8 HN LYS 8 -15.990 -3.458 -1.596 49 HA LYS 8 HA LYS 8 -16.683 -0.732 -0.827 50 HB2 LYS 8 HB2 LYS 8 -17.342 -3.453 0.218 51 HB3 LYS 8 HB1 LYS 8 -17.403 -2.091 1.324 52 HG2 LYS 8 HG2 LYS 8 -19.592 -2.553 0.398 53 HG3 LYS 8 HG1 LYS 8 -19.012 -0.973 -0.123 54 HD2 LYS 8 HD2 LYS 8 -18.297 -2.000 -2.266 55 HD3 LYS 8 HD1 LYS 8 -19.017 -3.521 -1.735 56 HE2 LYS 8 HE2 LYS 8 -20.485 -0.911 -2.087 57 HE3 LYS 8 HE1 LYS 8 -20.507 -2.258 -3.223 58 HZ1 LYS 8 HZ1 LYS 8 -22.459 -2.240 -1.796 59 HZ2 LYS 8 HZ2 LYS 8 -21.481 -2.362 -0.422 60 HZ3 LYS 8 HZ3 LYS 8 -21.534 -3.632 -1.537 61 HA PRO 9 HA PRO 9 -13.089 0.066 1.573 62 HB2 PRO 9 HB2 PRO 9 -14.733 0.923 3.844 63 HB3 PRO 9 HB1 PRO 9 -13.596 1.848 2.861 64 HG2 PRO 9 HG2 PRO 9 -16.266 2.198 2.695 65 HG3 PRO 9 HG1 PRO 9 -15.185 2.415 1.308 66 HD2 PRO 9 HD2 PRO 9 -17.013 0.152 1.958 67 HD3 PRO 9 HD1 PRO 9 -16.574 0.837 0.381 68 H MET 10 HN MET 10 -11.837 -0.640 3.272 69 HA MET 10 HA MET 10 -12.916 -2.898 4.778 70 HB2 MET 10 HB2 MET 10 -10.578 -3.534 5.186 71 HB3 MET 10 HB1 MET 10 -10.926 -3.415 3.472 72 HG2 MET 10 HG2 MET 10 -9.867 -1.221 3.408 73 HG3 MET 10 HG1 MET 10 -9.501 -1.362 5.124 74 HE1 MET 10 HE1 MET 10 -8.990 -2.965 1.607 75 HE2 MET 10 HE2 MET 10 -9.338 -4.396 2.577 76 HE3 MET 10 HE3 MET 10 -7.724 -4.153 1.912 77 H SER 11 HN SER 11 -12.129 -3.114 7.016 78 HA SER 11 HA SER 11 -13.035 -0.839 8.429 79 HB2 SER 11 HB2 SER 11 -12.566 -2.240 10.443 80 HB3 SER 11 HB1 SER 11 -13.548 -3.051 9.224 81 HG SER 11 HG SER 11 -11.666 -4.134 8.510 82 H TYR 12 HN TYR 12 -11.889 -0.040 10.440 83 HA TYR 12 HA TYR 12 -9.504 1.302 9.821 84 HB2 TYR 12 HB2 TYR 12 -11.094 1.995 11.585 85 HB3 TYR 12 HB1 TYR 12 -10.623 0.600 12.552 86 HD1 TYR 12 HD1 TYR 12 -8.119 0.469 13.202 87 HD2 TYR 12 HD2 TYR 12 -10.013 4.029 11.889 88 HE1 TYR 12 HE1 TYR 12 -6.366 1.791 14.310 89 HE2 TYR 12 HE2 TYR 12 -8.262 5.365 12.981 90 HH TYR 12 HH TYR 12 -5.371 3.986 14.191 91 H GLU 13 HN GLU 13 -10.081 -1.739 11.507 92 HA GLU 13 HA GLU 13 -7.489 -2.312 12.361 93 HB2 GLU 13 HB2 GLU 13 -9.667 -3.540 12.887 94 HB3 GLU 13 HB1 GLU 13 -9.474 -4.353 11.344 95 HG2 GLU 13 HG2 GLU 13 -7.446 -4.468 13.567 96 HG3 GLU 13 HG1 GLU 13 -8.724 -5.654 13.333 97 H GLU 14 HN GLU 14 -9.136 -3.081 9.326 98 HA GLU 14 HA GLU 14 -6.967 -4.552 8.225 99 HB2 GLU 14 HB2 GLU 14 -9.430 -3.350 6.973 100 HB3 GLU 14 HB1 GLU 14 -8.274 -4.334 6.085 101 HG2 GLU 14 HG2 GLU 14 -8.789 -6.258 7.329 102 HG3 GLU 14 HG1 GLU 14 -9.635 -5.324 8.567 103 H LYS 15 HN LYS 15 -8.157 -1.238 7.713 104 HA LYS 15 HA LYS 15 -6.295 -0.430 5.810 105 HB2 LYS 15 HB2 LYS 15 -7.737 1.093 7.976 106 HB3 LYS 15 HB1 LYS 15 -6.684 1.882 6.813 107 HG2 LYS 15 HG2 LYS 15 -8.085 1.349 5.004 108 HG3 LYS 15 HG1 LYS 15 -8.976 0.163 5.964 109 HD2 LYS 15 HD2 LYS 15 -10.210 1.750 7.054 110 HD3 LYS 15 HD1 LYS 15 -8.973 2.996 6.888 111 HE2 LYS 15 HE2 LYS 15 -9.502 3.296 4.574 112 HE3 LYS 15 HE1 LYS 15 -10.596 1.913 4.585 113 HZ1 LYS 15 HZ1 LYS 15 -12.009 3.133 6.155 114 HZ2 LYS 15 HZ2 LYS 15 -11.821 3.979 4.702 115 HZ3 LYS 15 HZ3 LYS 15 -10.962 4.459 6.079 116 H ARG 16 HN ARG 16 -6.093 -0.328 9.349 117 HA ARG 16 HA ARG 16 -3.503 0.760 9.529 118 HB2 ARG 16 HB2 ARG 16 -4.932 0.652 11.476 119 HB3 ARG 16 HB1 ARG 16 -4.975 -1.107 11.402 120 HG2 ARG 16 HG2 ARG 16 -2.364 -0.849 11.633 121 HG3 ARG 16 HG1 ARG 16 -2.819 0.701 12.349 122 HD2 ARG 16 HD2 ARG 16 -2.617 -1.019 14.059 123 HD3 ARG 16 HD1 ARG 16 -4.283 -0.452 13.918 124 HE ARG 16 HE ARG 16 -4.458 -2.555 12.382 125 HH11 ARG 16 HH11 ARG 16 -2.690 -2.272 15.386 126 HH12 ARG 16 HH12 ARG 16 -2.890 -3.943 15.804 127 HH21 ARG 16 HH21 ARG 16 -4.741 -4.759 12.932 128 HH22 ARG 16 HH22 ARG 16 -4.047 -5.351 14.415 129 H GLN 17 HN GLN 17 -4.611 -2.616 9.416 130 HA GLN 17 HA GLN 17 -2.080 -3.790 9.697 131 HB2 GLN 17 HB2 GLN 17 -4.339 -4.907 9.979 132 HB3 GLN 17 HB1 GLN 17 -4.407 -5.004 8.224 133 HG2 GLN 17 HG2 GLN 17 -3.642 -7.097 9.139 134 HG3 GLN 17 HG1 GLN 17 -2.340 -6.327 8.231 135 HE21 GLN 17 HE21 GLN 17 -0.739 -7.442 9.331 136 HE22 GLN 17 HE22 GLN 17 -0.335 -7.105 10.978 137 H LEU 18 HN LEU 18 -3.737 -2.455 6.996 138 HA LEU 18 HA LEU 18 -2.154 -3.635 4.940 139 HB2 LEU 18 HB2 LEU 18 -4.484 -2.214 5.037 140 HB3 LEU 18 HB1 LEU 18 -3.372 -0.991 4.460 141 HG LEU 18 HG LEU 18 -3.735 -3.663 3.111 142 HD11 LEU 18 HD11 LEU 18 -5.039 -1.025 2.507 143 HD12 LEU 18 HD12 LEU 18 -5.843 -2.491 3.054 144 HD13 LEU 18 HD13 LEU 18 -5.087 -2.437 1.462 145 HD21 LEU 18 HD21 LEU 18 -1.676 -2.727 2.459 146 HD22 LEU 18 HD22 LEU 18 -2.357 -1.109 2.346 147 HD23 LEU 18 HD23 LEU 18 -2.806 -2.341 1.170 148 H SER 19 HN SER 19 -2.036 -0.587 6.731 149 HA SER 19 HA SER 19 0.261 0.460 5.501 150 HB2 SER 19 HB2 SER 19 -1.024 1.852 7.005 151 HB3 SER 19 HB1 SER 19 -0.768 0.729 8.340 152 HG SER 19 HG SER 19 1.619 1.336 7.559 153 H LEU 20 HN LEU 20 -0.218 -2.015 7.863 154 HA LEU 20 HA LEU 20 2.545 -2.207 8.622 155 HB2 LEU 20 HB2 LEU 20 0.118 -3.861 9.218 156 HB3 LEU 20 HB1 LEU 20 1.702 -4.228 9.860 157 HG LEU 20 HG LEU 20 0.121 -1.711 10.375 158 HD11 LEU 20 HD11 LEU 20 -0.585 -3.863 11.461 159 HD12 LEU 20 HD12 LEU 20 -0.203 -2.535 12.556 160 HD13 LEU 20 HD13 LEU 20 0.956 -3.846 12.314 161 HD21 LEU 20 HD21 LEU 20 2.909 -2.531 11.084 162 HD22 LEU 20 HD22 LEU 20 2.004 -1.410 12.099 163 HD23 LEU 20 HD23 LEU 20 2.338 -1.003 10.416 164 H ASP 21 HN ASP 21 0.387 -3.819 6.355 165 HA ASP 21 HA ASP 21 2.205 -5.994 5.909 166 HB2 ASP 21 HB2 ASP 21 0.643 -6.716 4.154 167 HB3 ASP 21 HB1 ASP 21 -0.158 -6.416 5.685 168 H ILE 22 HN ILE 22 1.496 -2.947 4.265 169 HA ILE 22 HA ILE 22 3.257 -3.436 2.086 170 HB ILE 22 HB ILE 22 2.322 -0.831 3.296 171 HG12 ILE 22 HG12 ILE 22 1.551 -2.067 0.650 172 HG13 ILE 22 HG11 ILE 22 0.669 -2.423 2.140 173 HG21 ILE 22 HG21 ILE 22 4.269 -0.173 2.252 174 HG22 ILE 22 HG22 ILE 22 3.045 0.068 1.003 175 HG23 ILE 22 HG23 ILE 22 4.088 -1.351 0.956 176 HD11 ILE 22 HD11 ILE 22 0.198 -0.059 2.378 177 HD12 ILE 22 HD12 ILE 22 -0.435 -0.699 0.870 178 HD13 ILE 22 HD13 ILE 22 1.036 0.278 0.873 179 H ASN 23 HN ASN 23 3.667 -2.140 5.308 180 HA ASN 23 HA ASN 23 6.298 -1.208 5.088 181 HB2 ASN 23 HB2 ASN 23 4.561 -1.089 7.092 182 HB3 ASN 23 HB1 ASN 23 5.368 -2.570 7.597 183 HD21 ASN 23 HD21 ASN 23 6.272 -1.659 9.415 184 HD22 ASN 23 HD22 ASN 23 7.565 -0.515 9.344 185 H LYS 24 HN LYS 24 5.002 -4.402 5.154 186 HA LYS 24 HA LYS 24 7.381 -5.728 6.080 187 HB2 LYS 24 HB2 LYS 24 4.802 -6.696 4.868 188 HB3 LYS 24 HB1 LYS 24 6.129 -7.789 5.239 189 HG2 LYS 24 HG2 LYS 24 5.983 -7.159 7.591 190 HG3 LYS 24 HG1 LYS 24 4.673 -6.037 7.212 191 HD2 LYS 24 HD2 LYS 24 3.330 -7.928 6.378 192 HD3 LYS 24 HD1 LYS 24 4.626 -9.034 6.837 193 HE2 LYS 24 HE2 LYS 24 2.999 -7.288 8.680 194 HE3 LYS 24 HE1 LYS 24 2.920 -9.042 8.540 195 HZ1 LYS 24 HZ1 LYS 24 5.253 -9.119 9.295 196 HZ2 LYS 24 HZ2 LYS 24 4.206 -8.466 10.452 197 HZ3 LYS 24 HZ3 LYS 24 5.209 -7.447 9.548 198 H LEU 25 HN LEU 25 6.090 -4.728 3.013 199 HA LEU 25 HA LEU 25 7.428 -6.617 1.375 200 HB2 LEU 25 HB2 LEU 25 6.558 -3.832 0.692 201 HB3 LEU 25 HB1 LEU 25 6.990 -5.058 -0.463 202 HG LEU 25 HG LEU 25 4.570 -4.934 1.296 203 HD11 LEU 25 HD11 LEU 25 5.031 -5.124 -1.661 204 HD12 LEU 25 HD12 LEU 25 4.408 -3.735 -0.775 205 HD13 LEU 25 HD13 LEU 25 3.449 -5.211 -0.892 206 HD21 LEU 25 HD21 LEU 25 5.686 -7.256 -0.209 207 HD22 LEU 25 HD22 LEU 25 3.998 -7.153 0.277 208 HD23 LEU 25 HD23 LEU 25 5.272 -7.184 1.498 209 HA PRO 26 HA PRO 26 11.661 -5.044 1.518 210 HB2 PRO 26 HB2 PRO 26 11.778 -6.644 -0.996 211 HB3 PRO 26 HB1 PRO 26 12.851 -6.678 0.416 212 HG2 PRO 26 HG2 PRO 26 11.097 -8.637 -0.007 213 HG3 PRO 26 HG1 PRO 26 11.406 -8.033 1.632 214 HD2 PRO 26 HD2 PRO 26 9.089 -7.487 -0.185 215 HD3 PRO 26 HD1 PRO 26 9.110 -7.757 1.570 216 H GLY 27 HN GLY 27 12.887 -3.593 0.197 217 HA2 GLY 27 HA2 GLY 27 11.477 -1.461 -0.676 218 HA3 GLY 27 HA1 GLY 27 13.117 -1.776 -1.178 219 H GLU 28 HN GLU 28 12.637 -4.033 -2.881 220 HA GLU 28 HA GLU 28 11.886 -2.646 -5.227 221 HB2 GLU 28 HB2 GLU 28 13.424 -4.553 -5.345 222 HB3 GLU 28 HB1 GLU 28 12.170 -5.628 -4.763 223 HG2 GLU 28 HG2 GLU 28 10.891 -4.733 -6.886 224 HG3 GLU 28 HG1 GLU 28 12.536 -4.442 -7.438 225 H LYS 29 HN LYS 29 10.246 -5.246 -3.451 226 HA LYS 29 HA LYS 29 7.864 -5.242 -4.954 227 HB2 LYS 29 HB2 LYS 29 8.418 -6.036 -2.094 228 HB3 LYS 29 HB1 LYS 29 6.914 -6.379 -2.938 229 HG2 LYS 29 HG2 LYS 29 9.595 -7.338 -3.892 230 HG3 LYS 29 HG1 LYS 29 8.558 -8.263 -2.813 231 HD2 LYS 29 HD2 LYS 29 6.771 -8.190 -4.511 232 HD3 LYS 29 HD1 LYS 29 7.875 -7.366 -5.609 233 HE2 LYS 29 HE2 LYS 29 7.721 -9.798 -6.033 234 HE3 LYS 29 HE1 LYS 29 9.355 -9.272 -5.636 235 HZ1 LYS 29 HZ1 LYS 29 8.930 -10.016 -3.335 236 HZ2 LYS 29 HZ2 LYS 29 8.870 -11.280 -4.453 237 HZ3 LYS 29 HZ3 LYS 29 7.437 -10.637 -3.824 238 H LEU 30 HN LEU 30 8.970 -3.446 -2.198 239 HA LEU 30 HA LEU 30 6.570 -2.194 -1.421 240 HB2 LEU 30 HB2 LEU 30 8.600 -2.257 -0.050 241 HB3 LEU 30 HB1 LEU 30 9.437 -1.250 -1.209 242 HG LEU 30 HG LEU 30 8.196 0.649 -0.614 243 HD11 LEU 30 HD11 LEU 30 6.417 -0.771 1.285 244 HD12 LEU 30 HD12 LEU 30 6.033 -0.857 -0.422 245 HD13 LEU 30 HD13 LEU 30 6.142 0.701 0.373 246 HD21 LEU 30 HD21 LEU 30 8.497 0.772 1.832 247 HD22 LEU 30 HD22 LEU 30 9.892 0.077 1.006 248 HD23 LEU 30 HD23 LEU 30 8.762 -0.971 1.863 249 H GLY 31 HN GLY 31 9.028 -1.272 -3.814 250 HA2 GLY 31 HA2 GLY 31 8.152 1.341 -4.301 251 HA3 GLY 31 HA1 GLY 31 8.999 0.340 -5.461 252 H ARG 32 HN ARG 32 6.642 -1.634 -5.167 253 HA ARG 32 HA ARG 32 5.116 -0.639 -7.355 254 HB2 ARG 32 HB2 ARG 32 5.464 -3.053 -6.996 255 HB3 ARG 32 HB1 ARG 32 4.541 -2.951 -5.505 256 HG2 ARG 32 HG2 ARG 32 3.196 -3.878 -7.315 257 HG3 ARG 32 HG1 ARG 32 2.548 -2.335 -6.765 258 HD2 ARG 32 HD2 ARG 32 2.569 -2.551 -9.247 259 HD3 ARG 32 HD1 ARG 32 3.502 -1.180 -8.647 260 HE ARG 32 HE ARG 32 5.239 -3.347 -8.918 261 HH11 ARG 32 HH11 ARG 32 3.266 -1.308 -10.969 262 HH12 ARG 32 HH12 ARG 32 4.359 -1.395 -12.315 263 HH21 ARG 32 HH21 ARG 32 6.683 -3.448 -10.687 264 HH22 ARG 32 HH22 ARG 32 6.300 -2.609 -12.155 265 H VAL 33 HN VAL 33 4.397 -1.110 -3.899 266 HA VAL 33 HA VAL 33 1.694 -0.253 -4.119 267 HB VAL 33 HB VAL 33 2.419 0.222 -1.464 268 HG11 VAL 33 HG11 VAL 33 1.102 -2.026 -2.957 269 HG12 VAL 33 HG12 VAL 33 0.386 -0.817 -1.894 270 HG13 VAL 33 HG13 VAL 33 1.345 -2.127 -1.217 271 HG21 VAL 33 HG21 VAL 33 3.850 -2.222 -2.515 272 HG22 VAL 33 HG22 VAL 33 3.611 -1.823 -0.819 273 HG23 VAL 33 HG23 VAL 33 4.602 -0.781 -1.838 274 H VAL 34 HN VAL 34 4.628 1.442 -3.006 275 HA VAL 34 HA VAL 34 3.483 3.922 -2.464 276 HB VAL 34 HB VAL 34 5.646 4.324 -2.017 277 HG11 VAL 34 HG11 VAL 34 6.104 1.982 -2.243 278 HG12 VAL 34 HG12 VAL 34 7.474 2.949 -2.796 279 HG13 VAL 34 HG13 VAL 34 6.397 2.186 -3.968 280 HG21 VAL 34 HG21 VAL 34 5.524 5.803 -3.958 281 HG22 VAL 34 HG22 VAL 34 6.037 4.485 -5.003 282 HG23 VAL 34 HG23 VAL 34 7.140 5.124 -3.786 283 H HIS 35 HN HIS 35 4.479 2.529 -5.526 284 HA HIS 35 HA HIS 35 3.755 4.743 -7.140 285 HB2 HIS 35 HB2 HIS 35 5.312 2.962 -7.869 286 HB3 HIS 35 HB1 HIS 35 3.964 1.835 -7.918 287 HD1 HIS 35 HD1 HIS 35 5.282 4.910 -9.666 288 HD2 HIS 35 HD2 HIS 35 2.469 1.906 -10.241 289 HE1 HIS 35 HE1 HIS 35 4.480 5.177 -12.031 290 HE2 HIS 35 HE2 HIS 35 2.673 3.450 -12.305 291 H ILE 36 HN ILE 36 2.032 1.776 -6.206 292 HA ILE 36 HA ILE 36 -0.237 2.105 -7.790 293 HB ILE 36 HB ILE 36 -0.167 0.881 -5.026 294 HG12 ILE 36 HG12 ILE 36 0.253 -0.309 -7.770 295 HG13 ILE 36 HG11 ILE 36 1.397 -0.276 -6.438 296 HG21 ILE 36 HG21 ILE 36 -2.375 0.690 -5.248 297 HG22 ILE 36 HG22 ILE 36 -2.096 -0.350 -6.645 298 HG23 ILE 36 HG23 ILE 36 -2.310 1.385 -6.868 299 HD11 ILE 36 HD11 ILE 36 -0.153 -1.749 -5.167 300 HD12 ILE 36 HD12 ILE 36 0.519 -2.479 -6.622 301 HD13 ILE 36 HD13 ILE 36 -1.136 -1.877 -6.623 302 H ILE 37 HN ILE 37 0.207 3.131 -4.382 303 HA ILE 37 HA ILE 37 -2.311 4.324 -4.134 304 HB ILE 37 HB ILE 37 0.221 5.181 -2.713 305 HG12 ILE 37 HG12 ILE 37 -1.598 3.782 -1.027 306 HG13 ILE 37 HG11 ILE 37 -1.374 2.813 -2.476 307 HG21 ILE 37 HG21 ILE 37 -1.997 6.623 -2.867 308 HG22 ILE 37 HG22 ILE 37 -1.050 6.523 -1.376 309 HG23 ILE 37 HG23 ILE 37 -2.497 5.531 -1.571 310 HD11 ILE 37 HD11 ILE 37 1.004 2.762 -2.126 311 HD12 ILE 37 HD12 ILE 37 0.172 2.223 -0.667 312 HD13 ILE 37 HD13 ILE 37 0.852 3.847 -0.746 313 H GLN 38 HN GLN 38 0.799 5.826 -4.938 314 HA GLN 38 HA GLN 38 -0.148 8.426 -5.282 315 HB2 GLN 38 HB2 GLN 38 2.219 6.995 -6.474 316 HB3 GLN 38 HB1 GLN 38 1.930 8.709 -6.741 317 HG2 GLN 38 HG2 GLN 38 1.762 8.457 -3.989 318 HG3 GLN 38 HG1 GLN 38 3.036 7.327 -4.431 319 HE21 GLN 38 HE21 GLN 38 4.572 8.637 -3.409 320 HE22 GLN 38 HE22 GLN 38 5.142 10.100 -4.130 321 H SER 39 HN SER 39 -0.157 5.714 -7.493 322 HA SER 39 HA SER 39 -0.814 7.319 -9.779 323 HB2 SER 39 HB2 SER 39 0.410 5.198 -10.014 324 HB3 SER 39 HB1 SER 39 -0.997 4.322 -9.408 325 HG SER 39 HG SER 39 -2.096 5.476 -11.276 326 H ARG 40 HN ARG 40 -2.637 5.603 -7.311 327 HA ARG 40 HA ARG 40 -5.087 5.799 -8.882 328 HB2 ARG 40 HB2 ARG 40 -4.734 4.782 -6.068 329 HB3 ARG 40 HB1 ARG 40 -6.148 4.569 -7.090 330 HG2 ARG 40 HG2 ARG 40 -4.444 3.372 -8.683 331 HG3 ARG 40 HG1 ARG 40 -3.506 3.202 -7.198 332 HD2 ARG 40 HD2 ARG 40 -4.833 1.243 -7.505 333 HD3 ARG 40 HD1 ARG 40 -5.428 2.159 -6.128 334 HE ARG 40 HE ARG 40 -7.129 3.045 -7.847 335 HH11 ARG 40 HH11 ARG 40 -5.808 -0.197 -7.789 336 HH12 ARG 40 HH12 ARG 40 -7.184 -0.919 -8.573 337 HH21 ARG 40 HH21 ARG 40 -8.943 2.103 -8.886 338 HH22 ARG 40 HH22 ARG 40 -8.959 0.393 -9.195 339 H GLU 41 HN GLU 41 -3.482 7.229 -6.157 340 HA GLU 41 HA GLU 41 -5.711 9.099 -5.816 341 HB2 GLU 41 HB2 GLU 41 -3.538 8.511 -3.853 342 HB3 GLU 41 HB1 GLU 41 -5.108 9.247 -3.561 343 HG2 GLU 41 HG2 GLU 41 -5.319 6.709 -4.812 344 HG3 GLU 41 HG1 GLU 41 -4.473 6.600 -3.301 345 HA PRO 42 HA PRO 42 -2.432 11.687 -7.808 346 HB2 PRO 42 HB2 PRO 42 -4.830 13.371 -8.256 347 HB3 PRO 42 HB1 PRO 42 -3.583 12.862 -9.398 348 HG2 PRO 42 HG2 PRO 42 -6.023 11.789 -9.463 349 HG3 PRO 42 HG1 PRO 42 -4.580 10.802 -9.769 350 HD2 PRO 42 HD2 PRO 42 -6.261 10.990 -7.300 351 HD3 PRO 42 HD1 PRO 42 -5.516 9.562 -8.052 352 H SER 43 HN SER 43 -4.859 12.333 -5.405 353 HA SER 43 HA SER 43 -4.194 14.985 -4.754 354 HB2 SER 43 HB2 SER 43 -5.369 12.867 -2.944 355 HB3 SER 43 HB1 SER 43 -5.505 14.613 -2.747 356 HG SER 43 HG SER 43 -6.484 14.461 -4.987 357 H LEU 44 HN LEU 44 -2.542 12.056 -4.136 358 HA LEU 44 HA LEU 44 -0.817 13.448 -2.205 359 HB2 LEU 44 HB2 LEU 44 -0.275 11.209 -1.248 360 HB3 LEU 44 HB1 LEU 44 -1.912 11.752 -0.967 361 HG LEU 44 HG LEU 44 -2.443 10.259 -3.083 362 HD11 LEU 44 HD11 LEU 44 0.001 9.813 -3.442 363 HD12 LEU 44 HD12 LEU 44 -1.024 8.383 -3.344 364 HD13 LEU 44 HD13 LEU 44 -0.030 8.851 -1.964 365 HD21 LEU 44 HD21 LEU 44 -3.361 9.936 -0.854 366 HD22 LEU 44 HD22 LEU 44 -1.868 9.154 -0.335 367 HD23 LEU 44 HD23 LEU 44 -2.883 8.394 -1.561 368 H LYS 45 HN LYS 45 -0.809 13.057 -5.209 369 HA LYS 45 HA LYS 45 1.542 11.430 -5.605 370 HB2 LYS 45 HB2 LYS 45 0.283 11.107 -7.464 371 HB3 LYS 45 HB1 LYS 45 -0.434 12.704 -7.425 372 HG2 LYS 45 HG2 LYS 45 1.649 13.617 -8.353 373 HG3 LYS 45 HG1 LYS 45 2.312 11.981 -8.440 374 HD2 LYS 45 HD2 LYS 45 1.500 12.340 -10.586 375 HD3 LYS 45 HD1 LYS 45 0.157 11.492 -9.810 376 HE2 LYS 45 HE2 LYS 45 -0.864 13.303 -10.880 377 HE3 LYS 45 HE1 LYS 45 -0.699 13.806 -9.197 378 HZ1 LYS 45 HZ1 LYS 45 -0.039 15.588 -10.622 379 HZ2 LYS 45 HZ2 LYS 45 1.063 14.604 -11.439 380 HZ3 LYS 45 HZ3 LYS 45 1.328 15.005 -9.815 381 H ASN 46 HN ASN 46 1.200 14.385 -4.308 382 HA ASN 46 HA ASN 46 3.463 15.644 -5.653 383 HB2 ASN 46 HB2 ASN 46 1.674 16.564 -3.389 384 HB3 ASN 46 HB1 ASN 46 3.045 17.490 -3.987 385 HD21 ASN 46 HD21 ASN 46 0.174 18.106 -3.941 386 HD22 ASN 46 HD22 ASN 46 -0.242 18.464 -5.582 387 H SER 47 HN SER 47 2.875 13.445 -3.256 388 HA SER 47 HA SER 47 4.742 14.213 -1.273 389 HB2 SER 47 HB2 SER 47 3.746 11.407 -1.842 390 HB3 SER 47 HB1 SER 47 4.301 12.069 -0.301 391 HG SER 47 HG SER 47 1.848 12.238 -1.517 392 H ASN 48 HN ASN 48 6.899 13.848 -1.145 393 HA ASN 48 HA ASN 48 8.429 13.165 -3.401 394 HB2 ASN 48 HB2 ASN 48 9.291 12.995 -0.493 395 HB3 ASN 48 HB1 ASN 48 10.346 13.166 -1.891 396 HD21 ASN 48 HD21 ASN 48 10.021 14.828 0.494 397 HD22 ASN 48 HD22 ASN 48 9.684 16.416 -0.101 398 HA PRO 49 HA PRO 49 7.801 8.829 -3.507 399 HB2 PRO 49 HB2 PRO 49 10.142 8.112 -4.800 400 HB3 PRO 49 HB1 PRO 49 8.655 8.644 -5.583 401 HG2 PRO 49 HG2 PRO 49 11.140 10.168 -4.987 402 HG3 PRO 49 HG1 PRO 49 10.046 10.300 -6.374 403 HD2 PRO 49 HD2 PRO 49 10.067 12.099 -4.352 404 HD3 PRO 49 HD1 PRO 49 8.591 11.693 -5.251 405 H ASP 50 HN ASP 50 10.717 10.137 -2.077 406 HA ASP 50 HA ASP 50 11.495 7.616 -0.928 407 HB2 ASP 50 HB2 ASP 50 12.474 10.431 -0.418 408 HB3 ASP 50 HB1 ASP 50 13.121 9.009 0.388 409 H GLU 51 HN GLU 51 9.586 10.364 0.009 410 HA GLU 51 HA GLU 51 8.969 9.088 2.590 411 HB2 GLU 51 HB2 GLU 51 9.915 11.837 2.036 412 HB3 GLU 51 HB1 GLU 51 8.511 11.750 3.090 413 HG2 GLU 51 HG2 GLU 51 9.800 10.158 4.524 414 HG3 GLU 51 HG1 GLU 51 11.208 10.504 3.525 415 H ILE 52 HN ILE 52 7.180 8.243 1.105 416 HA ILE 52 HA ILE 52 5.397 10.270 0.085 417 HB ILE 52 HB ILE 52 4.295 8.634 -1.141 418 HG12 ILE 52 HG12 ILE 52 5.541 6.414 0.402 419 HG13 ILE 52 HG11 ILE 52 4.002 7.130 0.892 420 HG21 ILE 52 HG21 ILE 52 6.997 7.374 -0.903 421 HG22 ILE 52 HG22 ILE 52 6.761 8.945 -1.678 422 HG23 ILE 52 HG23 ILE 52 5.971 7.510 -2.335 423 HD11 ILE 52 HD11 ILE 52 3.052 6.585 -1.268 424 HD12 ILE 52 HD12 ILE 52 3.695 5.137 -0.491 425 HD13 ILE 52 HD13 ILE 52 4.592 5.912 -1.792 426 H GLU 53 HN GLU 53 3.264 10.556 0.654 427 HA GLU 53 HA GLU 53 2.727 9.861 3.452 428 HB2 GLU 53 HB2 GLU 53 2.900 12.288 2.300 429 HB3 GLU 53 HB1 GLU 53 1.195 11.976 2.029 430 HG2 GLU 53 HG2 GLU 53 2.674 12.268 4.613 431 HG3 GLU 53 HG1 GLU 53 1.297 13.188 4.017 432 H ILE 54 HN ILE 54 1.290 8.243 3.681 433 HA ILE 54 HA ILE 54 -0.809 7.905 1.627 434 HB ILE 54 HB ILE 54 -0.277 5.956 3.855 435 HG12 ILE 54 HG12 ILE 54 1.825 6.156 2.582 436 HG13 ILE 54 HG11 ILE 54 1.063 4.587 2.348 437 HG21 ILE 54 HG21 ILE 54 -1.460 4.410 2.449 438 HG22 ILE 54 HG22 ILE 54 -1.515 5.585 1.139 439 HG23 ILE 54 HG23 ILE 54 -2.412 5.881 2.628 440 HD11 ILE 54 HD11 ILE 54 1.864 5.218 0.280 441 HD12 ILE 54 HD12 ILE 54 1.248 6.870 0.431 442 HD13 ILE 54 HD13 ILE 54 0.124 5.527 0.207 443 H ASP 55 HN ASP 55 -2.943 8.171 2.169 444 HA ASP 55 HA ASP 55 -3.497 8.693 5.019 445 HB2 ASP 55 HB2 ASP 55 -3.661 10.700 3.492 446 HB3 ASP 55 HB1 ASP 55 -5.009 9.893 2.700 447 H PHE 56 HN PHE 56 -4.104 6.623 5.500 448 HA PHE 56 HA PHE 56 -5.602 5.003 3.745 449 HB2 PHE 56 HB2 PHE 56 -4.516 4.771 6.464 450 HB3 PHE 56 HB1 PHE 56 -5.915 3.755 6.126 451 HD1 PHE 56 HD1 PHE 56 -2.411 4.437 5.270 452 HD2 PHE 56 HD2 PHE 56 -5.806 2.013 4.500 453 HE1 PHE 56 HE1 PHE 56 -1.002 2.839 4.028 454 HE2 PHE 56 HE2 PHE 56 -4.419 0.430 3.276 455 HZ PHE 56 HZ PHE 56 -2.011 0.818 3.038 456 H GLU 57 HN GLU 57 -6.619 7.552 5.652 457 HA GLU 57 HA GLU 57 -9.302 6.483 6.024 458 HB2 GLU 57 HB2 GLU 57 -7.946 9.008 6.919 459 HB3 GLU 57 HB1 GLU 57 -9.665 8.722 7.156 460 HG2 GLU 57 HG2 GLU 57 -7.531 6.868 8.170 461 HG3 GLU 57 HG1 GLU 57 -8.178 8.210 9.112 462 H THR 58 HN THR 58 -7.703 7.760 3.510 463 HA THR 58 HA THR 58 -10.159 9.001 2.477 464 HB THR 58 HB THR 58 -8.761 10.567 1.131 465 HG1 THR 58 HG1 THR 58 -6.725 9.388 2.718 466 HG21 THR 58 HG21 THR 58 -8.518 10.724 4.129 467 HG22 THR 58 HG22 THR 58 -9.823 11.379 3.137 468 HG23 THR 58 HG23 THR 58 -8.203 12.069 3.032 469 H LEU 59 HN LEU 59 -7.514 6.853 1.935 470 HA LEU 59 HA LEU 59 -7.438 6.739 -0.855 471 HB2 LEU 59 HB2 LEU 59 -7.234 4.189 0.708 472 HB3 LEU 59 HB1 LEU 59 -6.380 4.676 -0.728 473 HG LEU 59 HG LEU 59 -5.860 5.678 2.062 474 HD11 LEU 59 HD11 LEU 59 -4.378 3.805 0.227 475 HD12 LEU 59 HD12 LEU 59 -5.039 3.472 1.828 476 HD13 LEU 59 HD13 LEU 59 -3.659 4.553 1.653 477 HD21 LEU 59 HD21 LEU 59 -4.804 6.532 -0.600 478 HD22 LEU 59 HD22 LEU 59 -3.802 6.655 0.838 479 HD23 LEU 59 HD23 LEU 59 -5.336 7.519 0.754 480 H LYS 60 HN LYS 60 -8.605 5.771 -2.361 481 HA LYS 60 HA LYS 60 -11.320 5.159 -1.940 482 HB2 LYS 60 HB2 LYS 60 -9.539 4.340 -4.246 483 HB3 LYS 60 HB1 LYS 60 -11.291 4.509 -4.290 484 HG2 LYS 60 HG2 LYS 60 -11.087 6.905 -3.954 485 HG3 LYS 60 HG1 LYS 60 -9.333 6.756 -3.817 486 HD2 LYS 60 HD2 LYS 60 -9.279 5.858 -6.126 487 HD3 LYS 60 HD1 LYS 60 -11.013 6.167 -6.250 488 HE2 LYS 60 HE2 LYS 60 -9.804 7.992 -7.260 489 HE3 LYS 60 HE1 LYS 60 -10.587 8.553 -5.785 490 HZ1 LYS 60 HZ1 LYS 60 -8.436 8.255 -4.634 491 HZ2 LYS 60 HZ2 LYS 60 -8.372 9.412 -5.864 492 HZ3 LYS 60 HZ3 LYS 60 -7.713 7.876 -6.119 493 HA PRO 61 HA PRO 61 -11.363 0.978 -0.497 494 HB2 PRO 61 HB2 PRO 61 -13.522 0.471 -2.452 495 HB3 PRO 61 HB1 PRO 61 -13.541 0.309 -0.697 496 HG2 PRO 61 HG2 PRO 61 -14.808 2.310 -1.998 497 HG3 PRO 61 HG1 PRO 61 -14.139 2.501 -0.372 498 HD2 PRO 61 HD2 PRO 61 -13.133 3.540 -2.964 499 HD3 PRO 61 HD1 PRO 61 -12.939 4.195 -1.327 500 H SER 62 HN SER 62 -11.363 1.687 -3.909 501 HA SER 62 HA SER 62 -10.631 -0.927 -4.776 502 HB2 SER 62 HB2 SER 62 -10.033 0.366 -6.907 503 HB3 SER 62 HB1 SER 62 -11.711 0.425 -6.380 504 HG SER 62 HG SER 62 -10.439 2.484 -6.960 505 H THR 63 HN THR 63 -8.906 2.038 -3.989 506 HA THR 63 HA THR 63 -6.322 1.226 -4.730 507 HB THR 63 HB THR 63 -6.832 3.025 -2.346 508 HG1 THR 63 HG1 THR 63 -7.266 4.711 -3.811 509 HG21 THR 63 HG21 THR 63 -4.510 2.440 -3.107 510 HG22 THR 63 HG22 THR 63 -4.871 4.161 -3.101 511 HG23 THR 63 HG23 THR 63 -4.858 3.267 -4.619 512 H LEU 64 HN LEU 64 -8.037 1.059 -1.629 513 HA LEU 64 HA LEU 64 -6.028 -0.182 -0.137 514 HB2 LEU 64 HB2 LEU 64 -9.031 -0.341 0.104 515 HB3 LEU 64 HB1 LEU 64 -7.931 -1.008 1.293 516 HG LEU 64 HG LEU 64 -8.052 1.912 0.545 517 HD11 LEU 64 HD11 LEU 64 -10.110 1.170 1.687 518 HD12 LEU 64 HD12 LEU 64 -9.144 2.254 2.680 519 HD13 LEU 64 HD13 LEU 64 -9.122 0.521 2.993 520 HD21 LEU 64 HD21 LEU 64 -5.885 1.318 1.347 521 HD22 LEU 64 HD22 LEU 64 -6.580 0.407 2.682 522 HD23 LEU 64 HD23 LEU 64 -6.744 2.161 2.631 523 H ARG 65 HN ARG 65 -8.462 -1.577 -2.263 524 HA ARG 65 HA ARG 65 -7.860 -4.265 -1.410 525 HB2 ARG 65 HB2 ARG 65 -9.803 -2.985 -3.218 526 HB3 ARG 65 HB1 ARG 65 -9.333 -4.605 -3.655 527 HG2 ARG 65 HG2 ARG 65 -10.505 -3.742 -1.032 528 HG3 ARG 65 HG1 ARG 65 -11.372 -4.620 -2.301 529 HD2 ARG 65 HD2 ARG 65 -9.545 -6.426 -1.935 530 HD3 ARG 65 HD1 ARG 65 -9.246 -5.584 -0.412 531 HE ARG 65 HE ARG 65 -11.976 -6.405 -1.082 532 HH11 ARG 65 HH11 ARG 65 -9.149 -6.819 0.975 533 HH12 ARG 65 HH12 ARG 65 -10.031 -7.726 2.168 534 HH21 ARG 65 HH21 ARG 65 -13.088 -7.594 0.480 535 HH22 ARG 65 HH22 ARG 65 -12.255 -8.169 1.887 536 H GLU 66 HN GLU 66 -6.564 -2.075 -3.679 537 HA GLU 66 HA GLU 66 -5.313 -4.160 -5.250 538 HB2 GLU 66 HB2 GLU 66 -5.951 -2.192 -6.446 539 HB3 GLU 66 HB1 GLU 66 -5.145 -1.145 -5.285 540 HG2 GLU 66 HG2 GLU 66 -3.826 -1.207 -7.245 541 HG3 GLU 66 HG1 GLU 66 -2.981 -2.139 -6.012 542 H LEU 67 HN LEU 67 -4.505 -1.833 -2.735 543 HA LEU 67 HA LEU 67 -1.720 -2.326 -2.652 544 HB2 LEU 67 HB2 LEU 67 -3.581 -1.460 -0.418 545 HB3 LEU 67 HB1 LEU 67 -1.841 -1.232 -0.445 546 HG LEU 67 HG LEU 67 -3.845 0.099 -2.274 547 HD11 LEU 67 HD11 LEU 67 -2.133 1.243 -0.066 548 HD12 LEU 67 HD12 LEU 67 -3.867 0.932 0.033 549 HD13 LEU 67 HD13 LEU 67 -3.251 2.132 -1.102 550 HD21 LEU 67 HD21 LEU 67 -1.620 -0.435 -3.300 551 HD22 LEU 67 HD22 LEU 67 -0.893 0.628 -2.093 552 HD23 LEU 67 HD23 LEU 67 -2.050 1.271 -3.257 553 H GLU 68 HN GLU 68 -4.468 -3.474 -0.745 554 HA GLU 68 HA GLU 68 -3.021 -5.215 0.942 555 HB2 GLU 68 HB2 GLU 68 -5.259 -4.323 1.464 556 HB3 GLU 68 HB1 GLU 68 -5.946 -5.314 0.186 557 HG2 GLU 68 HG2 GLU 68 -4.707 -7.216 1.568 558 HG3 GLU 68 HG1 GLU 68 -4.981 -6.065 2.873 559 H ARG 69 HN ARG 69 -5.132 -5.962 -1.879 560 HA ARG 69 HA ARG 69 -4.726 -8.705 -1.935 561 HB2 ARG 69 HB2 ARG 69 -6.337 -7.546 -3.385 562 HB3 ARG 69 HB1 ARG 69 -5.009 -6.918 -4.351 563 HG2 ARG 69 HG2 ARG 69 -4.387 -9.453 -4.561 564 HG3 ARG 69 HG1 ARG 69 -6.096 -9.675 -4.188 565 HD2 ARG 69 HD2 ARG 69 -5.641 -9.570 -6.620 566 HD3 ARG 69 HD1 ARG 69 -6.739 -8.308 -6.064 567 HE ARG 69 HE ARG 69 -4.827 -6.769 -6.151 568 HH11 ARG 69 HH11 ARG 69 -4.583 -9.763 -7.955 569 HH12 ARG 69 HH12 ARG 69 -3.439 -9.129 -9.089 570 HH21 ARG 69 HH21 ARG 69 -3.334 -5.921 -7.642 571 HH22 ARG 69 HH22 ARG 69 -2.729 -6.947 -8.914 572 H TYR 70 HN TYR 70 -2.625 -6.186 -3.166 573 HA TYR 70 HA TYR 70 -0.944 -8.026 -4.589 574 HB2 TYR 70 HB2 TYR 70 -0.985 -5.876 -5.526 575 HB3 TYR 70 HB1 TYR 70 -0.796 -5.093 -3.960 576 HD1 TYR 70 HD2 TYR 70 1.016 -7.029 -6.565 577 HD2 TYR 70 HD1 TYR 70 1.300 -4.610 -3.090 578 HE1 TYR 70 HE2 TYR 70 3.444 -6.850 -6.907 579 HE2 TYR 70 HE1 TYR 70 3.739 -4.408 -3.420 580 HH TYR 70 HH TYR 70 5.521 -5.338 -4.514 581 H VAL 71 HN VAL 71 -0.654 -6.212 -1.534 582 HA VAL 71 HA VAL 71 1.970 -7.117 -1.009 583 HB VAL 71 HB VAL 71 1.617 -6.395 1.296 584 HG11 VAL 71 HG11 VAL 71 0.459 -4.069 0.350 585 HG12 VAL 71 HG12 VAL 71 1.253 -4.773 -1.054 586 HG13 VAL 71 HG13 VAL 71 2.176 -4.439 0.412 587 HG21 VAL 71 HG21 VAL 71 -0.504 -6.912 1.942 588 HG22 VAL 71 HG22 VAL 71 -1.227 -6.336 0.440 589 HG23 VAL 71 HG23 VAL 71 -0.663 -5.180 1.649 590 H THR 72 HN THR 72 -1.200 -8.315 0.062 591 HA THR 72 HA THR 72 -0.268 -10.312 1.770 592 HB THR 72 HB THR 72 -2.666 -9.513 1.530 593 HG1 THR 72 HG1 THR 72 -2.865 -11.188 2.797 594 HG21 THR 72 HG21 THR 72 -2.775 -9.879 -0.929 595 HG22 THR 72 HG22 THR 72 -4.105 -10.614 -0.036 596 HG23 THR 72 HG23 THR 72 -2.779 -11.616 -0.628 597 H SER 73 HN SER 73 -0.563 -10.235 -1.693 598 HA SER 73 HA SER 73 -0.171 -12.994 -2.153 599 HB2 SER 73 HB2 SER 73 -0.063 -12.454 -4.421 600 HB3 SER 73 HB1 SER 73 -0.972 -11.087 -3.773 601 HG SER 73 HG SER 73 0.900 -9.855 -3.797 602 H CYS 74 HN CYS 74 1.943 -10.354 -1.432 603 HA CYS 74 HA CYS 74 4.347 -11.791 -2.213 604 HB2 CYS 74 HB2 CYS 74 4.167 -9.377 -2.675 605 HB3 CYS 74 HB1 CYS 74 4.015 -9.057 -0.948 606 HG CYS 74 HG CYS 74 6.668 -10.487 -0.697 607 H LEU 75 HN LEU 75 2.930 -10.445 0.777 608 HA LEU 75 HA LEU 75 4.802 -11.304 2.626 609 HB2 LEU 75 HB2 LEU 75 1.892 -11.562 3.258 610 HB3 LEU 75 HB1 LEU 75 3.194 -10.982 4.269 611 HG LEU 75 HG LEU 75 2.125 -9.452 1.921 612 HD11 LEU 75 HD11 LEU 75 1.562 -8.842 4.788 613 HD12 LEU 75 HD12 LEU 75 0.533 -9.951 3.885 614 HD13 LEU 75 HD13 LEU 75 0.722 -8.288 3.340 615 HD21 LEU 75 HD21 LEU 75 4.441 -9.008 2.667 616 HD22 LEU 75 HD22 LEU 75 3.811 -8.591 4.261 617 HD23 LEU 75 HD23 LEU 75 3.361 -7.627 2.852 618 H ARG 76 HN ARG 76 2.175 -13.066 1.123 619 HA ARG 76 HA ARG 76 2.611 -15.423 2.731 620 HB2 ARG 76 HB2 ARG 76 0.710 -14.773 0.488 621 HB3 ARG 76 HB1 ARG 76 0.763 -16.345 1.284 622 HG2 ARG 76 HG2 ARG 76 0.069 -15.442 3.339 623 HG3 ARG 76 HG1 ARG 76 0.388 -13.791 2.811 624 HD2 ARG 76 HD2 ARG 76 -1.970 -14.153 2.805 625 HD3 ARG 76 HD1 ARG 76 -1.420 -14.033 1.137 626 HE ARG 76 HE ARG 76 -1.409 -16.679 1.514 627 HH11 ARG 76 HH11 ARG 76 -3.792 -14.243 2.277 628 HH12 ARG 76 HH12 ARG 76 -5.146 -15.307 2.076 629 HH21 ARG 76 HH21 ARG 76 -3.186 -18.101 1.259 630 HH22 ARG 76 HH22 ARG 76 -4.798 -17.508 1.491 631 H LYS 77 HN LYS 77 4.483 -14.237 0.541 632 HA LYS 77 HA LYS 77 5.147 -16.871 -0.587 633 HB2 LYS 77 HB2 LYS 77 5.469 -14.128 -1.759 634 HB3 LYS 77 HB1 LYS 77 6.497 -15.459 -2.281 635 HG2 LYS 77 HG2 LYS 77 4.617 -16.703 -3.047 636 HG3 LYS 77 HG1 LYS 77 3.499 -15.541 -2.337 637 HD2 LYS 77 HD2 LYS 77 4.370 -13.811 -3.865 638 HD3 LYS 77 HD1 LYS 77 5.442 -15.010 -4.588 639 HE2 LYS 77 HE2 LYS 77 3.506 -16.309 -5.315 640 HE3 LYS 77 HE1 LYS 77 2.429 -15.127 -4.568 641 HZ1 LYS 77 HZ1 LYS 77 4.298 -14.619 -6.818 642 HZ2 LYS 77 HZ2 LYS 77 3.337 -13.446 -6.075 643 HZ3 LYS 77 HZ3 LYS 77 2.613 -14.716 -6.921 644 H LYS 78 HN LYS 78 7.432 -17.381 -0.653 645 HA LYS 78 HA LYS 78 9.104 -15.714 1.065 646 HB2 LYS 78 HB2 LYS 78 8.589 -18.658 1.462 647 HB3 LYS 78 HB1 LYS 78 9.940 -17.808 2.199 648 HG2 LYS 78 HG2 LYS 78 7.052 -17.083 2.608 649 HG3 LYS 78 HG1 LYS 78 7.991 -18.105 3.700 650 HD2 LYS 78 HD2 LYS 78 9.527 -16.270 4.122 651 HD3 LYS 78 HD1 LYS 78 8.665 -15.255 2.965 652 HE2 LYS 78 HE2 LYS 78 6.648 -15.422 4.366 653 HE3 LYS 78 HE1 LYS 78 7.558 -16.375 5.536 654 HZ1 LYS 78 HZ1 LYS 78 7.415 -14.041 6.168 655 HZ2 LYS 78 HZ2 LYS 78 8.190 -13.588 4.735 656 HZ3 LYS 78 HZ3 LYS 78 9.019 -14.500 5.892 657 H ARG 79 HN ARG 79 11.339 -15.993 0.819 658 HA ARG 79 HA ARG 79 13.273 -16.298 -0.289 659 HB2 ARG 79 HB2 ARG 79 11.897 -18.879 -0.940 660 HB3 ARG 79 HB1 ARG 79 13.464 -18.502 -1.637 661 HG2 ARG 79 HG2 ARG 79 13.827 -19.835 0.297 662 HG3 ARG 79 HG1 ARG 79 14.342 -18.192 0.675 663 HD2 ARG 79 HD2 ARG 79 12.124 -17.821 1.744 664 HD3 ARG 79 HD1 ARG 79 11.771 -19.529 1.491 665 HE ARG 79 HE ARG 79 14.215 -18.957 2.939 666 HH11 ARG 79 HH11 ARG 79 10.814 -19.726 3.112 667 HH12 ARG 79 HH12 ARG 79 10.888 -20.285 4.752 668 HH21 ARG 79 HH21 ARG 79 14.323 -19.666 5.110 669 HH22 ARG 79 HH22 ARG 79 12.883 -20.243 5.890 670 H LYS 80 HN LYS 80 11.284 -14.734 -1.520 671 HA LYS 80 HA LYS 80 12.542 -14.518 -4.085 672 HB2 LYS 80 HB2 LYS 80 10.404 -14.575 -5.389 673 HB3 LYS 80 HB1 LYS 80 10.927 -16.130 -4.765 674 HG2 LYS 80 HG2 LYS 80 9.299 -15.967 -2.958 675 HG3 LYS 80 HG1 LYS 80 8.786 -14.389 -3.556 676 HD2 LYS 80 HD2 LYS 80 7.230 -16.077 -4.309 677 HD3 LYS 80 HD1 LYS 80 8.127 -15.447 -5.691 678 HE2 LYS 80 HE2 LYS 80 9.627 -17.408 -5.562 679 HE3 LYS 80 HE1 LYS 80 8.647 -18.043 -4.242 680 HZ1 LYS 80 HZ1 LYS 80 6.736 -18.033 -5.791 681 HZ2 LYS 80 HZ2 LYS 80 7.976 -19.077 -6.267 682 HZ3 LYS 80 HZ3 LYS 80 7.780 -17.590 -7.045 683 HA PRO 81 HA PRO 81 10.807 -10.601 -2.118 684 HB2 PRO 81 HB2 PRO 81 13.152 -9.399 -1.509 685 HB3 PRO 81 HB1 PRO 81 12.337 -10.507 -0.399 686 HG2 PRO 81 HG2 PRO 81 14.625 -11.029 -2.255 687 HG3 PRO 81 HG1 PRO 81 14.408 -11.549 -0.574 688 HD2 PRO 81 HD2 PRO 81 13.935 -13.185 -2.686 689 HD3 PRO 81 HD1 PRO 81 13.036 -13.302 -1.161 690 H GLN 82 HN GLN 82 13.476 -11.240 -4.308 691 HA GLN 82 HA GLN 82 12.987 -8.706 -5.711 692 HB2 GLN 82 HB2 GLN 82 15.308 -9.200 -5.047 693 HB3 GLN 82 HB1 GLN 82 15.253 -10.700 -5.956 694 HG2 GLN 82 HG2 GLN 82 14.962 -9.424 -8.023 695 HG3 GLN 82 HG1 GLN 82 15.062 -7.926 -7.099 696 HE21 GLN 82 HE21 GLN 82 16.803 -10.678 -8.304 697 HE22 GLN 82 HE22 GLN 82 18.393 -10.062 -8.008 698 H ALA 83 HN ALA 83 11.358 -8.963 -7.142 699 HA ALA 83 HA ALA 83 11.630 -10.989 -9.205 700 HB1 ALA 83 HB1 ALA 83 9.160 -10.920 -7.474 701 HB2 ALA 83 HB2 ALA 83 10.394 -12.179 -7.452 702 HB3 ALA 83 HB3 ALA 83 9.412 -11.934 -8.894 703 H1 GLU 201 HT1 GLU 201 -5.662 8.658 13.653 704 H2 GLU 201 HT2 GLU 201 -6.977 7.847 12.968 705 H3 GLU 201 HT3 GLU 201 -7.012 9.527 13.125 706 HA GLU 201 HA GLU 201 -6.577 8.832 10.843 707 HB2 GLU 201 HB2 GLU 201 -4.206 10.150 12.181 708 HB3 GLU 201 HB1 GLU 201 -4.617 10.252 10.478 709 HG2 GLU 201 HG2 GLU 201 -6.686 11.424 11.056 710 HG3 GLU 201 HG1 GLU 201 -6.243 11.342 12.761 711 H ILE 202 HN ILE 202 -5.238 7.750 9.357 712 HA ILE 202 HA ILE 202 -3.122 6.063 10.514 713 HB ILE 202 HB ILE 202 -5.183 5.167 8.490 714 HG12 ILE 202 HG12 ILE 202 -5.911 5.127 10.872 715 HG13 ILE 202 HG11 ILE 202 -5.845 3.527 10.141 716 HG21 ILE 202 HG21 ILE 202 -4.009 3.021 8.467 717 HG22 ILE 202 HG22 ILE 202 -2.773 3.683 9.538 718 HG23 ILE 202 HG23 ILE 202 -2.962 4.326 7.907 719 HD11 ILE 202 HD11 ILE 202 -3.680 3.142 11.233 720 HD12 ILE 202 HD12 ILE 202 -4.973 3.465 12.388 721 HD13 ILE 202 HD13 ILE 202 -3.803 4.725 11.999 722 H LYS 203 HN LYS 203 -1.362 7.010 9.727 723 HA LYS 203 HA LYS 203 -1.267 7.637 6.849 724 HB2 LYS 203 HB2 LYS 203 0.357 8.758 9.141 725 HB3 LYS 203 HB1 LYS 203 0.684 9.095 7.449 726 HG2 LYS 203 HG2 LYS 203 -1.526 10.129 7.239 727 HG3 LYS 203 HG1 LYS 203 -1.827 9.811 8.949 728 HD2 LYS 203 HD2 LYS 203 0.084 11.215 9.546 729 HD3 LYS 203 HD1 LYS 203 0.404 11.513 7.836 730 HE2 LYS 203 HE2 LYS 203 -0.790 13.381 8.875 731 HE3 LYS 203 HE1 LYS 203 -1.747 12.620 7.607 732 HZ1 LYS 203 HZ1 LYS 203 -2.059 12.040 10.500 733 HZ2 LYS 203 HZ2 LYS 203 -3.048 11.499 9.238 734 HZ3 LYS 203 HZ3 LYS 203 -3.017 13.138 9.641 735 H LEU 204 HN LEU 204 0.556 6.982 5.661 736 HA LEU 204 HA LEU 204 2.330 5.043 6.997 737 HB2 LEU 204 HB2 LEU 204 0.393 4.169 5.401 738 HB3 LEU 204 HB1 LEU 204 1.523 4.639 4.153 739 HG LEU 204 HG LEU 204 1.782 2.444 6.186 740 HD11 LEU 204 HD11 LEU 204 2.072 2.586 3.188 741 HD12 LEU 204 HD12 LEU 204 0.723 1.893 4.093 742 HD13 LEU 204 HD13 LEU 204 2.315 1.138 4.170 743 HD21 LEU 204 HD21 LEU 204 4.053 3.437 4.477 744 HD22 LEU 204 HD22 LEU 204 4.083 2.114 5.642 745 HD23 LEU 204 HD23 LEU 204 3.896 3.776 6.200 746 H LYS 205 HN LYS 205 4.053 6.501 7.063 747 HA LYS 205 HA LYS 205 4.942 7.803 4.649 748 HB2 LYS 205 HB2 LYS 205 6.166 7.500 7.389 749 HB3 LYS 205 HB1 LYS 205 6.999 8.301 6.065 750 HG2 LYS 205 HG2 LYS 205 4.326 9.140 7.169 751 HG3 LYS 205 HG1 LYS 205 5.877 9.862 7.606 752 HD2 LYS 205 HD2 LYS 205 6.197 10.356 5.152 753 HD3 LYS 205 HD1 LYS 205 4.515 9.871 4.921 754 HE2 LYS 205 HE2 LYS 205 5.552 12.125 6.622 755 HE3 LYS 205 HE1 LYS 205 4.606 12.258 5.141 756 HZ1 LYS 205 HZ1 LYS 205 3.677 11.153 7.738 757 HZ2 LYS 205 HZ2 LYS 205 2.768 11.107 6.309 758 HZ3 LYS 205 HZ3 LYS 205 3.172 12.593 7.013 759 H ILE 206 HN ILE 206 4.993 5.791 3.360 760 HA ILE 206 HA ILE 206 6.866 3.744 3.946 761 HB ILE 206 HB ILE 206 6.204 4.436 1.091 762 HG12 ILE 206 HG12 ILE 206 4.433 2.760 2.870 763 HG13 ILE 206 HG11 ILE 206 4.029 4.407 2.382 764 HG21 ILE 206 HG21 ILE 206 6.122 1.690 2.121 765 HG22 ILE 206 HG22 ILE 206 7.690 2.513 2.274 766 HG23 ILE 206 HG23 ILE 206 6.931 2.360 0.689 767 HD11 ILE 206 HD11 ILE 206 4.690 2.771 0.101 768 HD12 ILE 206 HD12 ILE 206 3.203 3.660 0.460 769 HD13 ILE 206 HD13 ILE 206 3.420 2.028 1.076 770 H THR 207 HN THR 207 9.036 3.852 3.893 771 HA THR 207 HA THR 207 10.260 6.061 2.381 772 HB THR 207 HB THR 207 12.232 5.612 3.976 773 HG1 THR 207 HG1 THR 207 11.883 3.967 5.262 774 HG21 THR 207 HG21 THR 207 9.637 6.715 5.061 775 HG22 THR 207 HG22 THR 207 10.828 7.606 4.115 776 HG23 THR 207 HG23 THR 207 11.240 7.023 5.727 777 H LYS 208 HN LYS 208 11.162 5.426 0.523 778 HA LYS 208 HA LYS 208 13.141 3.493 0.333 779 HB2 LYS 208 HB2 LYS 208 12.158 1.628 -0.742 780 HB3 LYS 208 HB1 LYS 208 11.183 1.946 0.676 781 HG2 LYS 208 HG2 LYS 208 10.465 2.681 -2.155 782 HG3 LYS 208 HG1 LYS 208 9.839 1.309 -1.256 783 HD2 LYS 208 HD2 LYS 208 8.137 2.734 -0.836 784 HD3 LYS 208 HD1 LYS 208 9.212 3.304 0.440 785 HE2 LYS 208 HE2 LYS 208 10.108 4.973 -1.187 786 HE3 LYS 208 HE1 LYS 208 8.842 4.473 -2.301 787 HZ1 LYS 208 HZ1 LYS 208 8.293 6.460 -1.028 788 HZ2 LYS 208 HZ2 LYS 208 8.350 5.562 0.409 789 HZ3 LYS 208 HZ3 LYS 208 7.189 5.204 -0.772 790 H THR 209 HN THR 209 12.569 2.618 -2.361 791 HA THR 209 HA THR 209 12.832 3.152 -4.507 792 HB THR 209 HB THR 209 11.942 5.186 -5.497 793 HG1 THR 209 HG1 THR 209 12.181 6.169 -2.984 794 HG21 THR 209 HG21 THR 209 10.151 3.897 -3.454 795 HG22 THR 209 HG22 THR 209 10.399 3.392 -5.125 796 HG23 THR 209 HG23 THR 209 9.583 4.915 -4.775 797 H ILE 210 HN ILE 210 14.757 3.187 -5.204 798 HA ILE 210 HA ILE 210 16.837 3.824 -5.794 799 HB ILE 210 HB ILE 210 15.889 6.652 -5.316 800 HG12 ILE 210 HG12 ILE 210 14.401 5.481 -6.875 801 HG13 ILE 210 HG11 ILE 210 15.362 6.688 -7.721 802 HG21 ILE 210 HG21 ILE 210 18.140 5.565 -7.008 803 HG22 ILE 210 HG22 ILE 210 18.310 6.462 -5.498 804 HG23 ILE 210 HG23 ILE 210 17.643 7.255 -6.923 805 HD11 ILE 210 HD11 ILE 210 15.871 3.721 -7.685 806 HD12 ILE 210 HD12 ILE 210 16.854 4.922 -8.521 807 HD13 ILE 210 HD13 ILE 210 15.184 4.649 -9.016 808 H GLN 211 HN GLN 211 17.722 2.823 -3.950 809 HA GLN 211 HA GLN 211 18.315 4.428 -1.636 810 HB2 GLN 211 HB2 GLN 211 19.731 2.436 -0.981 811 HB3 GLN 211 HB1 GLN 211 18.014 2.127 -1.179 812 HG2 GLN 211 HG2 GLN 211 18.456 1.208 -3.411 813 HG3 GLN 211 HG1 GLN 211 20.180 1.476 -3.162 814 HE21 GLN 211 HE21 GLN 211 18.062 0.454 -0.585 815 HE22 GLN 211 HE22 GLN 211 18.690 -1.152 -0.451 816 H ASN 212 HN ASN 212 20.012 5.689 -1.346 817 HA ASN 212 HA ASN 212 21.858 6.001 -3.552 818 HB2 ASN 212 HB2 ASN 212 21.402 7.593 -1.027 819 HB3 ASN 212 HB1 ASN 212 22.680 7.968 -2.178 820 HD21 ASN 212 HD21 ASN 212 19.250 7.923 -1.616 821 HD22 ASN 212 HD22 ASN 212 18.812 8.907 -2.968 Start of MODEL 10 1 H1 SER 1 HT1 SER 1 -12.893 -8.852 -10.052 2 H2 SER 1 HT2 SER 1 -13.043 -10.153 -11.120 3 H3 SER 1 HT3 SER 1 -14.303 -9.784 -10.061 4 HA SER 1 HA SER 1 -13.327 -7.987 -12.183 5 HB2 SER 1 HB2 SER 1 -15.831 -9.685 -12.224 6 HB3 SER 1 HB1 SER 1 -15.197 -8.681 -13.529 7 HG SER 1 HG SER 1 -14.319 -10.517 -14.104 8 H GLU 2 HN GLU 2 -16.422 -8.762 -10.522 9 HA GLU 2 HA GLU 2 -17.152 -5.985 -10.620 10 HB2 GLU 2 HB2 GLU 2 -18.552 -8.236 -9.165 11 HB3 GLU 2 HB1 GLU 2 -19.227 -6.664 -9.567 12 HG2 GLU 2 HG2 GLU 2 -18.998 -7.193 -11.955 13 HG3 GLU 2 HG1 GLU 2 -18.395 -8.791 -11.524 14 H GLU 3 HN GLU 3 -16.308 -8.254 -8.023 15 HA GLU 3 HA GLU 3 -16.856 -6.437 -5.932 16 HB2 GLU 3 HB2 GLU 3 -15.797 -8.069 -4.467 17 HB3 GLU 3 HB1 GLU 3 -16.927 -8.834 -5.580 18 HG2 GLU 3 HG2 GLU 3 -15.199 -9.666 -6.925 19 HG3 GLU 3 HG1 GLU 3 -14.019 -8.626 -6.139 20 H GLU 4 HN GLU 4 -14.208 -6.598 -8.033 21 HA GLU 4 HA GLU 4 -12.347 -5.469 -6.104 22 HB2 GLU 4 HB2 GLU 4 -10.693 -5.516 -7.915 23 HB3 GLU 4 HB1 GLU 4 -11.479 -7.080 -7.731 24 HG2 GLU 4 HG2 GLU 4 -12.970 -6.496 -9.624 25 HG3 GLU 4 HG1 GLU 4 -12.034 -5.019 -9.848 26 H ASP 5 HN ASP 5 -14.227 -4.415 -8.913 27 HA ASP 5 HA ASP 5 -13.072 -1.750 -8.740 28 HB2 ASP 5 HB2 ASP 5 -15.114 -2.914 -10.660 29 HB3 ASP 5 HB1 ASP 5 -14.560 -1.240 -10.708 30 H LYS 6 HN LYS 6 -15.708 -3.459 -7.458 31 HA LYS 6 HA LYS 6 -16.930 -0.920 -6.620 32 HB2 LYS 6 HB2 LYS 6 -18.319 -2.334 -8.214 33 HB3 LYS 6 HB1 LYS 6 -18.418 -3.529 -6.923 34 HG2 LYS 6 HG2 LYS 6 -19.570 -1.974 -5.503 35 HG3 LYS 6 HG1 LYS 6 -19.334 -0.670 -6.664 36 HD2 LYS 6 HD2 LYS 6 -20.800 -1.731 -8.247 37 HD3 LYS 6 HD1 LYS 6 -20.919 -3.174 -7.228 38 HE2 LYS 6 HE2 LYS 6 -21.881 -0.406 -6.513 39 HE3 LYS 6 HE1 LYS 6 -22.900 -1.752 -7.013 40 HZ1 LYS 6 HZ1 LYS 6 -22.928 -1.547 -4.635 41 HZ2 LYS 6 HZ2 LYS 6 -21.243 -1.617 -4.556 42 HZ3 LYS 6 HZ3 LYS 6 -22.122 -2.975 -5.046 43 H CYS 7 HN CYS 7 -14.789 -2.274 -5.449 44 HA CYS 7 HA CYS 7 -15.509 -3.990 -3.318 45 HB2 CYS 7 HB2 CYS 7 -13.216 -3.704 -4.320 46 HB3 CYS 7 HB1 CYS 7 -13.089 -2.182 -3.448 47 HG CYS 7 HG CYS 7 -13.222 -3.329 -0.911 48 H LYS 8 HN LYS 8 -15.718 -3.588 -1.119 49 HA LYS 8 HA LYS 8 -16.626 -0.917 -0.406 50 HB2 LYS 8 HB2 LYS 8 -16.897 -3.642 0.764 51 HB3 LYS 8 HB1 LYS 8 -16.935 -2.281 1.874 52 HG2 LYS 8 HG2 LYS 8 -19.174 -2.915 1.241 53 HG3 LYS 8 HG1 LYS 8 -18.793 -1.310 0.625 54 HD2 LYS 8 HD2 LYS 8 -18.360 -2.251 -1.584 55 HD3 LYS 8 HD1 LYS 8 -18.701 -3.869 -0.969 56 HE2 LYS 8 HE2 LYS 8 -20.660 -1.577 -0.995 57 HE3 LYS 8 HE1 LYS 8 -20.608 -2.873 -2.187 58 HZ1 LYS 8 HZ1 LYS 8 -21.046 -4.464 -0.416 59 HZ2 LYS 8 HZ2 LYS 8 -22.275 -3.307 -0.506 60 HZ3 LYS 8 HZ3 LYS 8 -21.115 -3.213 0.720 61 HA PRO 9 HA PRO 9 -12.877 0.211 1.655 62 HB2 PRO 9 HB2 PRO 9 -14.337 1.457 3.833 63 HB3 PRO 9 HB1 PRO 9 -13.367 2.211 2.565 64 HG2 PRO 9 HG2 PRO 9 -16.087 2.413 2.712 65 HG3 PRO 9 HG1 PRO 9 -15.167 2.544 1.205 66 HD2 PRO 9 HD2 PRO 9 -16.777 0.272 2.257 67 HD3 PRO 9 HD1 PRO 9 -16.505 0.786 0.581 68 H MET 10 HN MET 10 -11.666 -1.126 2.819 69 HA MET 10 HA MET 10 -12.716 -2.830 4.828 70 HB2 MET 10 HB2 MET 10 -10.346 -3.392 5.286 71 HB3 MET 10 HB1 MET 10 -10.772 -3.525 3.593 72 HG2 MET 10 HG2 MET 10 -9.723 -1.361 3.163 73 HG3 MET 10 HG1 MET 10 -9.253 -1.281 4.859 74 HE1 MET 10 HE1 MET 10 -8.938 -3.444 1.556 75 HE2 MET 10 HE2 MET 10 -9.314 -4.641 2.796 76 HE3 MET 10 HE3 MET 10 -7.718 -4.617 2.051 77 H SER 11 HN SER 11 -12.123 -2.806 7.077 78 HA SER 11 HA SER 11 -12.862 -0.274 8.150 79 HB2 SER 11 HB2 SER 11 -12.824 -1.509 10.333 80 HB3 SER 11 HB1 SER 11 -13.824 -2.257 9.090 81 HG SER 11 HG SER 11 -12.034 -3.677 8.654 82 H TYR 12 HN TYR 12 -11.792 0.253 10.425 83 HA TYR 12 HA TYR 12 -9.358 1.534 9.836 84 HB2 TYR 12 HB2 TYR 12 -11.067 2.162 11.592 85 HB3 TYR 12 HB1 TYR 12 -10.417 0.868 12.596 86 HD1 TYR 12 HD1 TYR 12 -7.897 1.023 13.173 87 HD2 TYR 12 HD2 TYR 12 -10.177 4.292 11.714 88 HE1 TYR 12 HE1 TYR 12 -6.260 2.581 14.139 89 HE2 TYR 12 HE2 TYR 12 -8.545 5.864 12.663 90 HH TYR 12 HH TYR 12 -6.850 5.905 14.453 91 H GLU 13 HN GLU 13 -10.035 -1.486 11.565 92 HA GLU 13 HA GLU 13 -7.433 -2.041 12.480 93 HB2 GLU 13 HB2 GLU 13 -9.795 -3.221 12.863 94 HB3 GLU 13 HB1 GLU 13 -9.229 -4.262 11.571 95 HG2 GLU 13 HG2 GLU 13 -7.955 -3.847 14.271 96 HG3 GLU 13 HG1 GLU 13 -8.749 -5.293 13.668 97 H GLU 14 HN GLU 14 -9.089 -2.719 9.464 98 HA GLU 14 HA GLU 14 -7.034 -4.404 8.394 99 HB2 GLU 14 HB2 GLU 14 -9.430 -3.078 7.120 100 HB3 GLU 14 HB1 GLU 14 -8.367 -4.196 6.279 101 HG2 GLU 14 HG2 GLU 14 -9.016 -6.006 7.666 102 HG3 GLU 14 HG1 GLU 14 -9.850 -4.924 8.790 103 H LYS 15 HN LYS 15 -8.106 -1.074 7.762 104 HA LYS 15 HA LYS 15 -6.237 -0.399 5.824 105 HB2 LYS 15 HB2 LYS 15 -7.656 1.237 7.915 106 HB3 LYS 15 HB1 LYS 15 -6.575 1.962 6.736 107 HG2 LYS 15 HG2 LYS 15 -7.949 1.374 4.931 108 HG3 LYS 15 HG1 LYS 15 -8.883 0.248 5.921 109 HD2 LYS 15 HD2 LYS 15 -10.194 1.874 6.772 110 HD3 LYS 15 HD1 LYS 15 -8.884 3.053 6.846 111 HE2 LYS 15 HE2 LYS 15 -9.045 3.386 4.432 112 HE3 LYS 15 HE1 LYS 15 -10.332 2.181 4.338 113 HZ1 LYS 15 HZ1 LYS 15 -11.745 3.589 5.631 114 HZ2 LYS 15 HZ2 LYS 15 -11.119 4.515 4.365 115 HZ3 LYS 15 HZ3 LYS 15 -10.492 4.687 5.933 116 H ARG 16 HN ARG 16 -5.993 -0.210 9.357 117 HA ARG 16 HA ARG 16 -3.389 0.876 9.441 118 HB2 ARG 16 HB2 ARG 16 -4.866 0.850 11.392 119 HB3 ARG 16 HB1 ARG 16 -4.775 -0.909 11.457 120 HG2 ARG 16 HG2 ARG 16 -2.209 -0.494 11.645 121 HG3 ARG 16 HG1 ARG 16 -2.709 1.118 12.163 122 HD2 ARG 16 HD2 ARG 16 -2.426 -0.297 14.097 123 HD3 ARG 16 HD1 ARG 16 -4.134 0.087 13.888 124 HE ARG 16 HE ARG 16 -4.413 -2.151 12.938 125 HH11 ARG 16 HH11 ARG 16 -1.547 -1.549 14.869 126 HH12 ARG 16 HH12 ARG 16 -1.338 -3.215 15.295 127 HH21 ARG 16 HH21 ARG 16 -4.158 -4.329 13.516 128 HH22 ARG 16 HH22 ARG 16 -2.819 -4.796 14.530 129 H GLN 17 HN GLN 17 -4.543 -2.490 9.466 130 HA GLN 17 HA GLN 17 -2.009 -3.668 9.754 131 HB2 GLN 17 HB2 GLN 17 -4.190 -4.813 10.170 132 HB3 GLN 17 HB1 GLN 17 -4.431 -4.878 8.428 133 HG2 GLN 17 HG2 GLN 17 -3.601 -6.993 9.222 134 HG3 GLN 17 HG1 GLN 17 -2.385 -6.212 8.211 135 HE21 GLN 17 HE21 GLN 17 -0.715 -7.397 9.126 136 HE22 GLN 17 HE22 GLN 17 -0.136 -7.094 10.727 137 H LEU 18 HN LEU 18 -3.695 -2.401 7.036 138 HA LEU 18 HA LEU 18 -2.159 -3.661 4.993 139 HB2 LEU 18 HB2 LEU 18 -4.437 -2.166 5.064 140 HB3 LEU 18 HB1 LEU 18 -3.290 -0.978 4.484 141 HG LEU 18 HG LEU 18 -3.706 -3.647 3.145 142 HD11 LEU 18 HD11 LEU 18 -4.967 -0.993 2.516 143 HD12 LEU 18 HD12 LEU 18 -5.799 -2.424 3.112 144 HD13 LEU 18 HD13 LEU 18 -5.066 -2.431 1.508 145 HD21 LEU 18 HD21 LEU 18 -1.643 -2.735 2.480 146 HD22 LEU 18 HD22 LEU 18 -2.304 -1.111 2.371 147 HD23 LEU 18 HD23 LEU 18 -2.774 -2.337 1.196 148 H SER 19 HN SER 19 -1.925 -0.570 6.713 149 HA SER 19 HA SER 19 0.411 0.339 5.438 150 HB2 SER 19 HB2 SER 19 -0.365 0.763 8.337 151 HB3 SER 19 HB1 SER 19 0.722 1.771 7.382 152 HG SER 19 HG SER 19 -1.788 1.398 6.294 153 H LEU 20 HN LEU 20 -0.152 -2.042 7.900 154 HA LEU 20 HA LEU 20 2.606 -2.306 8.647 155 HB2 LEU 20 HB2 LEU 20 0.157 -3.924 9.284 156 HB3 LEU 20 HB1 LEU 20 1.748 -4.318 9.893 157 HG LEU 20 HG LEU 20 0.347 -1.706 10.436 158 HD11 LEU 20 HD11 LEU 20 -0.635 -3.910 11.356 159 HD12 LEU 20 HD12 LEU 20 -0.378 -2.561 12.460 160 HD13 LEU 20 HD13 LEU 20 0.768 -3.902 12.420 161 HD21 LEU 20 HD21 LEU 20 2.864 -1.775 10.509 162 HD22 LEU 20 HD22 LEU 20 2.718 -2.942 11.820 163 HD23 LEU 20 HD23 LEU 20 2.075 -1.313 12.014 164 H ASP 21 HN ASP 21 0.397 -3.932 6.441 165 HA ASP 21 HA ASP 21 2.162 -6.150 6.018 166 HB2 ASP 21 HB2 ASP 21 0.572 -6.876 4.302 167 HB3 ASP 21 HB1 ASP 21 -0.227 -6.484 5.812 168 H ILE 22 HN ILE 22 1.545 -3.109 4.356 169 HA ILE 22 HA ILE 22 3.275 -3.625 2.170 170 HB ILE 22 HB ILE 22 2.417 -1.003 3.394 171 HG12 ILE 22 HG12 ILE 22 1.525 -2.229 0.786 172 HG13 ILE 22 HG11 ILE 22 0.711 -2.603 2.308 173 HG21 ILE 22 HG21 ILE 22 4.413 -0.514 2.232 174 HG22 ILE 22 HG22 ILE 22 3.088 -0.066 1.154 175 HG23 ILE 22 HG23 ILE 22 3.969 -1.569 0.889 176 HD11 ILE 22 HD11 ILE 22 0.074 -0.358 2.587 177 HD12 ILE 22 HD12 ILE 22 -0.348 -0.813 0.943 178 HD13 ILE 22 HD13 ILE 22 1.078 0.183 1.252 179 H ASN 23 HN ASN 23 3.745 -2.343 5.386 180 HA ASN 23 HA ASN 23 6.402 -1.479 5.133 181 HB2 ASN 23 HB2 ASN 23 5.077 -0.770 6.993 182 HB3 ASN 23 HB1 ASN 23 4.778 -2.427 7.486 183 HD21 ASN 23 HD21 ASN 23 7.065 0.177 7.420 184 HD22 ASN 23 HD22 ASN 23 8.162 -0.485 8.580 185 H LYS 24 HN LYS 24 5.057 -4.620 5.220 186 HA LYS 24 HA LYS 24 7.411 -5.962 6.212 187 HB2 LYS 24 HB2 LYS 24 4.859 -6.926 4.938 188 HB3 LYS 24 HB1 LYS 24 6.154 -8.019 5.416 189 HG2 LYS 24 HG2 LYS 24 5.901 -7.341 7.727 190 HG3 LYS 24 HG1 LYS 24 4.681 -6.150 7.267 191 HD2 LYS 24 HD2 LYS 24 3.258 -7.976 6.419 192 HD3 LYS 24 HD1 LYS 24 4.465 -9.144 6.953 193 HE2 LYS 24 HE2 LYS 24 2.997 -7.209 8.740 194 HE3 LYS 24 HE1 LYS 24 2.606 -8.917 8.550 195 HZ1 LYS 24 HZ1 LYS 24 5.136 -7.807 9.629 196 HZ2 LYS 24 HZ2 LYS 24 4.834 -9.449 9.381 197 HZ3 LYS 24 HZ3 LYS 24 3.926 -8.586 10.515 198 H LEU 25 HN LEU 25 6.090 -5.055 3.126 199 HA LEU 25 HA LEU 25 7.379 -6.863 1.433 200 HB2 LEU 25 HB2 LEU 25 6.610 -4.008 0.938 201 HB3 LEU 25 HB1 LEU 25 7.030 -5.142 -0.314 202 HG LEU 25 HG LEU 25 4.602 -5.109 1.430 203 HD11 LEU 25 HD11 LEU 25 5.110 -5.073 -1.522 204 HD12 LEU 25 HD12 LEU 25 4.443 -3.778 -0.536 205 HD13 LEU 25 HD13 LEU 25 3.515 -5.253 -0.807 206 HD21 LEU 25 HD21 LEU 25 5.701 -7.351 -0.196 207 HD22 LEU 25 HD22 LEU 25 4.005 -7.249 0.257 208 HD23 LEU 25 HD23 LEU 25 5.251 -7.377 1.502 209 HA PRO 26 HA PRO 26 11.699 -5.499 1.410 210 HB2 PRO 26 HB2 PRO 26 11.578 -6.924 -1.206 211 HB3 PRO 26 HB1 PRO 26 12.733 -7.106 0.125 212 HG2 PRO 26 HG2 PRO 26 10.873 -8.955 -0.301 213 HG3 PRO 26 HG1 PRO 26 11.292 -8.464 1.352 214 HD2 PRO 26 HD2 PRO 26 8.924 -7.693 -0.317 215 HD3 PRO 26 HD1 PRO 26 9.002 -8.102 1.413 216 H GLY 27 HN GLY 27 12.888 -3.988 0.143 217 HA2 GLY 27 HA2 GLY 27 11.479 -1.786 -0.605 218 HA3 GLY 27 HA1 GLY 27 13.114 -2.096 -1.134 219 H GLU 28 HN GLU 28 12.690 -4.231 -2.914 220 HA GLU 28 HA GLU 28 11.944 -2.839 -5.236 221 HB2 GLU 28 HB2 GLU 28 13.457 -4.802 -5.204 222 HB3 GLU 28 HB1 GLU 28 12.080 -5.834 -4.848 223 HG2 GLU 28 HG2 GLU 28 12.673 -5.945 -7.198 224 HG3 GLU 28 HG1 GLU 28 11.069 -5.244 -6.983 225 H LYS 29 HN LYS 29 10.209 -5.338 -3.415 226 HA LYS 29 HA LYS 29 7.847 -5.281 -4.962 227 HB2 LYS 29 HB2 LYS 29 8.490 -6.188 -2.166 228 HB3 LYS 29 HB1 LYS 29 6.870 -6.320 -2.835 229 HG2 LYS 29 HG2 LYS 29 9.314 -7.581 -4.054 230 HG3 LYS 29 HG1 LYS 29 8.184 -8.409 -2.982 231 HD2 LYS 29 HD2 LYS 29 6.373 -7.715 -4.633 232 HD3 LYS 29 HD1 LYS 29 7.687 -7.319 -5.737 233 HE2 LYS 29 HE2 LYS 29 6.873 -9.543 -6.200 234 HE3 LYS 29 HE1 LYS 29 8.512 -9.627 -5.558 235 HZ1 LYS 29 HZ1 LYS 29 7.092 -11.300 -4.570 236 HZ2 LYS 29 HZ2 LYS 29 6.022 -10.118 -4.021 237 HZ3 LYS 29 HZ3 LYS 29 7.592 -10.193 -3.396 238 H LEU 30 HN LEU 30 8.942 -3.554 -2.151 239 HA LEU 30 HA LEU 30 6.552 -2.309 -1.353 240 HB2 LEU 30 HB2 LEU 30 8.533 -2.411 0.047 241 HB3 LEU 30 HB1 LEU 30 9.446 -1.466 -1.112 242 HG LEU 30 HG LEU 30 8.334 0.521 -0.546 243 HD11 LEU 30 HD11 LEU 30 6.391 -0.843 1.263 244 HD12 LEU 30 HD12 LEU 30 6.058 -0.744 -0.460 245 HD13 LEU 30 HD13 LEU 30 6.280 0.726 0.478 246 HD21 LEU 30 HD21 LEU 30 8.579 0.622 1.915 247 HD22 LEU 30 HD22 LEU 30 9.946 -0.153 1.112 248 HD23 LEU 30 HD23 LEU 30 8.737 -1.134 1.941 249 H GLY 31 HN GLY 31 9.044 -1.234 -3.657 250 HA2 GLY 31 HA2 GLY 31 8.186 1.365 -4.084 251 HA3 GLY 31 HA1 GLY 31 8.974 0.379 -5.301 252 H ARG 32 HN ARG 32 6.761 -1.594 -5.278 253 HA ARG 32 HA ARG 32 5.155 -0.500 -7.308 254 HB2 ARG 32 HB2 ARG 32 5.488 -2.907 -7.097 255 HB3 ARG 32 HB1 ARG 32 4.674 -2.895 -5.542 256 HG2 ARG 32 HG2 ARG 32 3.183 -3.755 -7.240 257 HG3 ARG 32 HG1 ARG 32 2.596 -2.201 -6.658 258 HD2 ARG 32 HD2 ARG 32 2.390 -2.282 -9.065 259 HD3 ARG 32 HD1 ARG 32 3.618 -1.101 -8.614 260 HE ARG 32 HE ARG 32 4.757 -3.664 -9.140 261 HH11 ARG 32 HH11 ARG 32 3.505 -0.775 -10.666 262 HH12 ARG 32 HH12 ARG 32 4.428 -0.984 -12.120 263 HH21 ARG 32 HH21 ARG 32 5.983 -3.943 -11.056 264 HH22 ARG 32 HH22 ARG 32 5.845 -2.781 -12.338 265 H VAL 33 HN VAL 33 4.502 -1.034 -3.848 266 HA VAL 33 HA VAL 33 1.758 -0.268 -4.021 267 HB VAL 33 HB VAL 33 3.030 0.097 -1.394 268 HG11 VAL 33 HG11 VAL 33 0.739 -1.593 -2.396 269 HG12 VAL 33 HG12 VAL 33 0.619 0.056 -1.777 270 HG13 VAL 33 HG13 VAL 33 1.121 -1.248 -0.710 271 HG21 VAL 33 HG21 VAL 33 4.470 -1.674 -2.057 272 HG22 VAL 33 HG22 VAL 33 3.149 -2.547 -2.833 273 HG23 VAL 33 HG23 VAL 33 3.196 -2.399 -1.078 274 H VAL 34 HN VAL 34 4.633 1.430 -2.810 275 HA VAL 34 HA VAL 34 3.483 3.879 -2.166 276 HB VAL 34 HB VAL 34 5.663 4.261 -1.738 277 HG11 VAL 34 HG11 VAL 34 6.073 1.897 -2.056 278 HG12 VAL 34 HG12 VAL 34 7.460 2.868 -2.537 279 HG13 VAL 34 HG13 VAL 34 6.396 2.181 -3.763 280 HG21 VAL 34 HG21 VAL 34 5.553 5.795 -3.641 281 HG22 VAL 34 HG22 VAL 34 6.036 4.495 -4.724 282 HG23 VAL 34 HG23 VAL 34 7.158 5.084 -3.498 283 H HIS 35 HN HIS 35 4.477 2.606 -5.287 284 HA HIS 35 HA HIS 35 3.800 4.882 -6.837 285 HB2 HIS 35 HB2 HIS 35 5.385 3.090 -7.526 286 HB3 HIS 35 HB1 HIS 35 4.016 2.008 -7.717 287 HD1 HIS 35 HD1 HIS 35 5.571 5.081 -9.237 288 HD2 HIS 35 HD2 HIS 35 2.652 2.256 -10.113 289 HE1 HIS 35 HE1 HIS 35 4.981 5.448 -11.651 290 HE2 HIS 35 HE2 HIS 35 3.329 3.629 -12.197 291 H ILE 36 HN ILE 36 2.059 1.881 -6.046 292 HA ILE 36 HA ILE 36 -0.170 2.256 -7.678 293 HB ILE 36 HB ILE 36 -0.198 0.968 -4.937 294 HG12 ILE 36 HG12 ILE 36 0.315 -0.189 -7.680 295 HG13 ILE 36 HG11 ILE 36 1.417 -0.169 -6.316 296 HG21 ILE 36 HG21 ILE 36 -2.390 0.700 -5.251 297 HG22 ILE 36 HG22 ILE 36 -2.054 -0.196 -6.731 298 HG23 ILE 36 HG23 ILE 36 -2.281 1.549 -6.793 299 HD11 ILE 36 HD11 ILE 36 -0.171 -1.653 -5.101 300 HD12 ILE 36 HD12 ILE 36 0.542 -2.368 -6.545 301 HD13 ILE 36 HD13 ILE 36 -1.112 -1.763 -6.587 302 H ILE 37 HN ILE 37 0.210 3.193 -4.238 303 HA ILE 37 HA ILE 37 -2.321 4.356 -3.995 304 HB ILE 37 HB ILE 37 0.183 5.153 -2.503 305 HG12 ILE 37 HG12 ILE 37 -1.660 3.772 -0.862 306 HG13 ILE 37 HG11 ILE 37 -1.511 2.829 -2.340 307 HG21 ILE 37 HG21 ILE 37 -2.061 6.605 -2.675 308 HG22 ILE 37 HG22 ILE 37 -1.057 6.543 -1.225 309 HG23 ILE 37 HG23 ILE 37 -2.502 5.536 -1.341 310 HD11 ILE 37 HD11 ILE 37 0.870 2.694 -2.051 311 HD12 ILE 37 HD12 ILE 37 0.051 2.119 -0.599 312 HD13 ILE 37 HD13 ILE 37 0.786 3.722 -0.623 313 H GLN 38 HN GLN 38 0.790 5.904 -4.713 314 HA GLN 38 HA GLN 38 -0.118 8.510 -5.010 315 HB2 GLN 38 HB2 GLN 38 2.183 7.048 -6.291 316 HB3 GLN 38 HB1 GLN 38 1.895 8.755 -6.591 317 HG2 GLN 38 HG2 GLN 38 1.848 8.537 -3.820 318 HG3 GLN 38 HG1 GLN 38 3.126 7.441 -4.324 319 HE21 GLN 38 HE21 GLN 38 4.711 8.790 -3.433 320 HE22 GLN 38 HE22 GLN 38 5.180 10.275 -4.188 321 H SER 39 HN SER 39 -0.042 5.891 -7.385 322 HA SER 39 HA SER 39 -0.778 7.583 -9.562 323 HB2 SER 39 HB2 SER 39 0.501 5.438 -9.804 324 HB3 SER 39 HB1 SER 39 -0.984 4.569 -9.416 325 HG SER 39 HG SER 39 -1.916 5.329 -11.279 326 H ARG 40 HN ARG 40 -2.551 5.592 -7.270 327 HA ARG 40 HA ARG 40 -4.998 5.818 -8.819 328 HB2 ARG 40 HB2 ARG 40 -4.618 4.654 -6.066 329 HB3 ARG 40 HB1 ARG 40 -6.011 4.431 -7.109 330 HG2 ARG 40 HG2 ARG 40 -4.314 3.393 -8.763 331 HG3 ARG 40 HG1 ARG 40 -3.276 3.255 -7.342 332 HD2 ARG 40 HD2 ARG 40 -4.528 1.209 -7.732 333 HD3 ARG 40 HD1 ARG 40 -4.946 1.972 -6.204 334 HE ARG 40 HE ARG 40 -6.924 2.893 -7.507 335 HH11 ARG 40 HH11 ARG 40 -5.454 -0.203 -8.217 336 HH12 ARG 40 HH12 ARG 40 -6.921 -0.896 -8.823 337 HH21 ARG 40 HH21 ARG 40 -8.841 1.990 -8.302 338 HH22 ARG 40 HH22 ARG 40 -8.852 0.355 -8.884 339 H GLU 41 HN GLU 41 -3.577 7.160 -5.901 340 HA GLU 41 HA GLU 41 -5.952 8.847 -5.524 341 HB2 GLU 41 HB2 GLU 41 -3.659 8.290 -3.659 342 HB3 GLU 41 HB1 GLU 41 -5.043 9.305 -3.287 343 HG2 GLU 41 HG2 GLU 41 -4.957 6.339 -3.701 344 HG3 GLU 41 HG1 GLU 41 -5.423 7.232 -2.258 345 HA PRO 42 HA PRO 42 -3.206 11.864 -7.617 346 HB2 PRO 42 HB2 PRO 42 -5.737 13.400 -7.528 347 HB3 PRO 42 HB1 PRO 42 -4.660 13.079 -8.892 348 HG2 PRO 42 HG2 PRO 42 -7.014 11.839 -8.673 349 HG3 PRO 42 HG1 PRO 42 -5.585 11.000 -9.305 350 HD2 PRO 42 HD2 PRO 42 -6.853 10.815 -6.605 351 HD3 PRO 42 HD1 PRO 42 -6.127 9.539 -7.604 352 H SER 43 HN SER 43 -5.218 12.117 -4.806 353 HA SER 43 HA SER 43 -4.777 14.754 -4.023 354 HB2 SER 43 HB2 SER 43 -5.106 12.413 -2.143 355 HB3 SER 43 HB1 SER 43 -5.591 14.086 -1.876 356 HG SER 43 HG SER 43 -7.099 12.198 -2.785 357 H LEU 44 HN LEU 44 -2.811 11.880 -3.552 358 HA LEU 44 HA LEU 44 -0.932 13.454 -1.929 359 HB2 LEU 44 HB2 LEU 44 -0.146 11.283 -1.040 360 HB3 LEU 44 HB1 LEU 44 -1.821 11.629 -0.669 361 HG LEU 44 HG LEU 44 -2.153 10.169 -2.900 362 HD11 LEU 44 HD11 LEU 44 0.278 9.805 -3.112 363 HD12 LEU 44 HD12 LEU 44 -0.631 8.306 -2.915 364 HD13 LEU 44 HD13 LEU 44 0.265 8.979 -1.554 365 HD21 LEU 44 HD21 LEU 44 -3.263 9.826 -0.762 366 HD22 LEU 44 HD22 LEU 44 -1.793 9.114 -0.100 367 HD23 LEU 44 HD23 LEU 44 -2.657 8.300 -1.403 368 H LYS 45 HN LYS 45 -1.221 12.998 -4.938 369 HA LYS 45 HA LYS 45 1.086 11.489 -5.703 370 HB2 LYS 45 HB2 LYS 45 -1.083 12.290 -7.114 371 HB3 LYS 45 HB1 LYS 45 0.051 13.528 -7.641 372 HG2 LYS 45 HG2 LYS 45 1.458 11.982 -8.659 373 HG3 LYS 45 HG1 LYS 45 0.719 10.607 -7.817 374 HD2 LYS 45 HD2 LYS 45 -0.048 10.613 -10.087 375 HD3 LYS 45 HD1 LYS 45 -1.395 11.128 -9.065 376 HE2 LYS 45 HE2 LYS 45 -0.872 13.467 -9.579 377 HE3 LYS 45 HE1 LYS 45 0.452 12.934 -10.609 378 HZ1 LYS 45 HZ1 LYS 45 -1.467 13.445 -11.933 379 HZ2 LYS 45 HZ2 LYS 45 -2.434 12.392 -11.033 380 HZ3 LYS 45 HZ3 LYS 45 -1.188 11.780 -11.996 381 H ASN 46 HN ASN 46 0.987 14.313 -4.098 382 HA ASN 46 HA ASN 46 3.220 15.530 -5.558 383 HB2 ASN 46 HB2 ASN 46 1.438 16.622 -3.377 384 HB3 ASN 46 HB1 ASN 46 2.833 17.477 -4.020 385 HD21 ASN 46 HD21 ASN 46 2.786 18.186 -6.185 386 HD22 ASN 46 HD22 ASN 46 1.285 18.404 -7.020 387 H SER 47 HN SER 47 2.646 13.421 -3.078 388 HA SER 47 HA SER 47 4.597 14.192 -1.178 389 HB2 SER 47 HB2 SER 47 3.596 11.388 -1.799 390 HB3 SER 47 HB1 SER 47 4.351 11.939 -0.300 391 HG SER 47 HG SER 47 1.765 12.278 -1.223 392 H ASN 48 HN ASN 48 6.794 13.895 -1.169 393 HA ASN 48 HA ASN 48 8.182 13.321 -3.541 394 HB2 ASN 48 HB2 ASN 48 9.270 13.013 -0.725 395 HB3 ASN 48 HB1 ASN 48 10.210 13.249 -2.193 396 HD21 ASN 48 HD21 ASN 48 10.204 14.790 0.234 397 HD22 ASN 48 HD22 ASN 48 9.777 16.406 -0.205 398 HA PRO 49 HA PRO 49 7.427 9.008 -3.760 399 HB2 PRO 49 HB2 PRO 49 9.570 8.342 -5.388 400 HB3 PRO 49 HB1 PRO 49 7.984 8.883 -5.934 401 HG2 PRO 49 HG2 PRO 49 10.528 10.400 -5.680 402 HG3 PRO 49 HG1 PRO 49 9.215 10.596 -6.853 403 HD2 PRO 49 HD2 PRO 49 9.597 12.290 -4.766 404 HD3 PRO 49 HD1 PRO 49 7.996 11.953 -5.451 405 H ASP 50 HN ASP 50 10.465 10.252 -2.608 406 HA ASP 50 HA ASP 50 11.404 7.673 -1.729 407 HB2 ASP 50 HB2 ASP 50 12.412 10.457 -1.142 408 HB3 ASP 50 HB1 ASP 50 13.169 8.998 -0.535 409 H GLU 51 HN GLU 51 9.615 10.350 -0.383 410 HA GLU 51 HA GLU 51 9.324 8.901 2.174 411 HB2 GLU 51 HB2 GLU 51 9.976 11.772 1.661 412 HB3 GLU 51 HB1 GLU 51 8.873 11.434 2.984 413 HG2 GLU 51 HG2 GLU 51 10.630 9.882 3.891 414 HG3 GLU 51 HG1 GLU 51 11.713 10.531 2.665 415 H ILE 52 HN ILE 52 7.360 8.076 0.932 416 HA ILE 52 HA ILE 52 5.549 10.097 0.011 417 HB ILE 52 HB ILE 52 4.302 8.443 -1.018 418 HG12 ILE 52 HG12 ILE 52 5.612 6.244 0.499 419 HG13 ILE 52 HG11 ILE 52 4.171 7.053 1.126 420 HG21 ILE 52 HG21 ILE 52 6.989 7.111 -0.930 421 HG22 ILE 52 HG22 ILE 52 6.742 8.661 -1.747 422 HG23 ILE 52 HG23 ILE 52 5.863 7.230 -2.288 423 HD11 ILE 52 HD11 ILE 52 3.012 6.535 -0.971 424 HD12 ILE 52 HD12 ILE 52 3.533 5.085 -0.105 425 HD13 ILE 52 HD13 ILE 52 4.433 5.645 -1.513 426 H GLU 53 HN GLU 53 3.467 10.439 0.652 427 HA GLU 53 HA GLU 53 2.961 9.847 3.483 428 HB2 GLU 53 HB2 GLU 53 3.304 12.249 2.132 429 HB3 GLU 53 HB1 GLU 53 1.564 12.113 2.230 430 HG2 GLU 53 HG2 GLU 53 3.584 12.370 4.410 431 HG3 GLU 53 HG1 GLU 53 2.190 13.378 4.074 432 H ILE 54 HN ILE 54 1.235 8.408 3.678 433 HA ILE 54 HA ILE 54 -0.742 8.365 1.465 434 HB ILE 54 HB ILE 54 -0.983 6.395 3.679 435 HG12 ILE 54 HG12 ILE 54 1.461 6.272 2.974 436 HG13 ILE 54 HG11 ILE 54 0.532 4.787 2.788 437 HG21 ILE 54 HG21 ILE 54 -1.733 4.955 1.798 438 HG22 ILE 54 HG22 ILE 54 -1.525 6.347 0.735 439 HG23 ILE 54 HG23 ILE 54 -2.682 6.416 2.063 440 HD11 ILE 54 HD11 ILE 54 1.866 4.892 0.913 441 HD12 ILE 54 HD12 ILE 54 1.545 6.629 0.671 442 HD13 ILE 54 HD13 ILE 54 0.269 5.448 0.362 443 H ASP 55 HN ASP 55 -2.961 8.641 1.913 444 HA ASP 55 HA ASP 55 -3.579 9.208 4.737 445 HB2 ASP 55 HB2 ASP 55 -3.787 11.193 3.114 446 HB3 ASP 55 HB1 ASP 55 -5.179 10.343 2.450 447 H PHE 56 HN PHE 56 -4.106 7.100 5.192 448 HA PHE 56 HA PHE 56 -5.267 5.369 3.331 449 HB2 PHE 56 HB2 PHE 56 -4.310 5.217 6.043 450 HB3 PHE 56 HB1 PHE 56 -5.757 4.235 5.824 451 HD1 PHE 56 HD1 PHE 56 -2.244 4.680 4.848 452 HD2 PHE 56 HD2 PHE 56 -5.766 2.368 4.322 453 HE1 PHE 56 HE1 PHE 56 -0.928 2.911 3.735 454 HE2 PHE 56 HE2 PHE 56 -4.476 0.619 3.223 455 HZ PHE 56 HZ PHE 56 -2.054 0.866 2.928 456 H GLU 57 HN GLU 57 -6.804 7.719 5.235 457 HA GLU 57 HA GLU 57 -9.338 6.313 5.292 458 HB2 GLU 57 HB2 GLU 57 -8.423 8.970 6.324 459 HB3 GLU 57 HB1 GLU 57 -10.118 8.504 6.332 460 HG2 GLU 57 HG2 GLU 57 -7.975 6.836 7.599 461 HG3 GLU 57 HG1 GLU 57 -8.821 8.120 8.461 462 H THR 58 HN THR 58 -7.685 8.126 3.062 463 HA THR 58 HA THR 58 -10.179 9.149 1.880 464 HB THR 58 HB THR 58 -8.812 10.734 0.613 465 HG1 THR 58 HG1 THR 58 -6.653 9.546 2.058 466 HG21 THR 58 HG21 THR 58 -8.410 10.674 3.598 467 HG22 THR 58 HG22 THR 58 -9.628 11.565 2.680 468 HG23 THR 58 HG23 THR 58 -7.935 12.047 2.595 469 H LEU 59 HN LEU 59 -7.602 6.928 1.459 470 HA LEU 59 HA LEU 59 -7.426 6.738 -1.329 471 HB2 LEU 59 HB2 LEU 59 -7.332 4.238 0.306 472 HB3 LEU 59 HB1 LEU 59 -6.340 4.722 -1.048 473 HG LEU 59 HG LEU 59 -6.123 5.717 1.780 474 HD11 LEU 59 HD11 LEU 59 -4.439 3.914 0.063 475 HD12 LEU 59 HD12 LEU 59 -5.166 3.578 1.634 476 HD13 LEU 59 HD13 LEU 59 -3.819 4.708 1.510 477 HD21 LEU 59 HD21 LEU 59 -4.727 6.615 -0.720 478 HD22 LEU 59 HD22 LEU 59 -4.079 6.896 0.884 479 HD23 LEU 59 HD23 LEU 59 -5.633 7.587 0.427 480 H LYS 60 HN LYS 60 -8.749 5.852 -2.838 481 HA LYS 60 HA LYS 60 -11.414 5.187 -2.278 482 HB2 LYS 60 HB2 LYS 60 -9.735 4.366 -4.654 483 HB3 LYS 60 HB1 LYS 60 -11.495 4.449 -4.609 484 HG2 LYS 60 HG2 LYS 60 -11.331 6.880 -4.231 485 HG3 LYS 60 HG1 LYS 60 -9.575 6.761 -4.371 486 HD2 LYS 60 HD2 LYS 60 -9.968 5.745 -6.651 487 HD3 LYS 60 HD1 LYS 60 -11.647 6.255 -6.487 488 HE2 LYS 60 HE2 LYS 60 -10.388 7.918 -7.718 489 HE3 LYS 60 HE1 LYS 60 -10.896 8.569 -6.162 490 HZ1 LYS 60 HZ1 LYS 60 -8.638 9.177 -6.542 491 HZ2 LYS 60 HZ2 LYS 60 -8.189 7.584 -6.885 492 HZ3 LYS 60 HZ3 LYS 60 -8.645 8.012 -5.313 493 HA PRO 61 HA PRO 61 -11.249 1.094 -0.686 494 HB2 PRO 61 HB2 PRO 61 -13.534 0.353 -2.387 495 HB3 PRO 61 HB1 PRO 61 -13.414 0.404 -0.626 496 HG2 PRO 61 HG2 PRO 61 -14.831 2.209 -2.070 497 HG3 PRO 61 HG1 PRO 61 -14.083 2.581 -0.511 498 HD2 PRO 61 HD2 PRO 61 -13.246 3.364 -3.254 499 HD3 PRO 61 HD1 PRO 61 -13.006 4.209 -1.711 500 H SER 62 HN SER 62 -11.451 1.579 -4.131 501 HA SER 62 HA SER 62 -10.679 -1.061 -4.883 502 HB2 SER 62 HB2 SER 62 -10.127 0.152 -7.084 503 HB3 SER 62 HB1 SER 62 -11.807 0.178 -6.548 504 HG SER 62 HG SER 62 -11.635 2.263 -6.629 505 H THR 63 HN THR 63 -9.010 1.937 -4.159 506 HA THR 63 HA THR 63 -6.420 1.153 -4.945 507 HB THR 63 HB THR 63 -7.037 3.065 -2.673 508 HG1 THR 63 HG1 THR 63 -7.162 4.660 -4.411 509 HG21 THR 63 HG21 THR 63 -4.665 2.419 -3.176 510 HG22 THR 63 HG22 THR 63 -5.009 4.140 -3.307 511 HG23 THR 63 HG23 THR 63 -4.865 3.157 -4.761 512 H LEU 64 HN LEU 64 -8.041 1.116 -1.772 513 HA LEU 64 HA LEU 64 -6.001 -0.046 -0.271 514 HB2 LEU 64 HB2 LEU 64 -8.997 -0.286 0.011 515 HB3 LEU 64 HB1 LEU 64 -7.864 -0.885 1.207 516 HG LEU 64 HG LEU 64 -8.044 2.006 0.378 517 HD11 LEU 64 HD11 LEU 64 -10.123 1.261 1.475 518 HD12 LEU 64 HD12 LEU 64 -9.203 2.375 2.481 519 HD13 LEU 64 HD13 LEU 64 -9.169 0.647 2.822 520 HD21 LEU 64 HD21 LEU 64 -5.886 1.420 1.253 521 HD22 LEU 64 HD22 LEU 64 -6.630 0.590 2.617 522 HD23 LEU 64 HD23 LEU 64 -6.775 2.339 2.464 523 H ARG 65 HN ARG 65 -8.580 -1.607 -2.122 524 HA ARG 65 HA ARG 65 -7.977 -4.233 -1.313 525 HB2 ARG 65 HB2 ARG 65 -10.118 -3.496 -2.342 526 HB3 ARG 65 HB1 ARG 65 -9.270 -3.262 -3.855 527 HG2 ARG 65 HG2 ARG 65 -10.654 -5.416 -3.499 528 HG3 ARG 65 HG1 ARG 65 -9.102 -5.494 -4.311 529 HD2 ARG 65 HD2 ARG 65 -8.053 -6.380 -2.323 530 HD3 ARG 65 HD1 ARG 65 -9.529 -6.160 -1.372 531 HE ARG 65 HE ARG 65 -10.201 -7.722 -3.554 532 HH11 ARG 65 HH11 ARG 65 -8.061 -8.006 -0.787 533 HH12 ARG 65 HH12 ARG 65 -8.165 -9.740 -0.756 534 HH21 ARG 65 HH21 ARG 65 -10.323 -9.983 -3.501 535 HH22 ARG 65 HH22 ARG 65 -9.452 -10.859 -2.285 536 H GLU 66 HN GLU 66 -6.687 -2.155 -3.800 537 HA GLU 66 HA GLU 66 -5.305 -4.219 -5.229 538 HB2 GLU 66 HB2 GLU 66 -5.927 -2.276 -6.444 539 HB3 GLU 66 HB1 GLU 66 -5.191 -1.207 -5.258 540 HG2 GLU 66 HG2 GLU 66 -3.795 -1.194 -7.145 541 HG3 GLU 66 HG1 GLU 66 -2.971 -2.163 -5.930 542 H LEU 67 HN LEU 67 -4.557 -1.938 -2.684 543 HA LEU 67 HA LEU 67 -1.759 -2.334 -2.640 544 HB2 LEU 67 HB2 LEU 67 -3.614 -1.499 -0.400 545 HB3 LEU 67 HB1 LEU 67 -1.891 -1.188 -0.471 546 HG LEU 67 HG LEU 67 -3.987 -0.009 -2.304 547 HD11 LEU 67 HD11 LEU 67 -2.291 1.309 -0.198 548 HD12 LEU 67 HD12 LEU 67 -3.978 0.848 0.024 549 HD13 LEU 67 HD13 LEU 67 -3.547 2.064 -1.179 550 HD21 LEU 67 HD21 LEU 67 -1.756 -0.432 -3.345 551 HD22 LEU 67 HD22 LEU 67 -1.068 0.670 -2.154 552 HD23 LEU 67 HD23 LEU 67 -2.261 1.254 -3.308 553 H GLU 68 HN GLU 68 -4.445 -3.557 -0.708 554 HA GLU 68 HA GLU 68 -2.939 -5.249 0.986 555 HB2 GLU 68 HB2 GLU 68 -5.108 -4.443 1.643 556 HB3 GLU 68 HB1 GLU 68 -5.868 -5.195 0.251 557 HG2 GLU 68 HG2 GLU 68 -4.423 -6.968 2.118 558 HG3 GLU 68 HG1 GLU 68 -5.923 -6.248 2.681 559 H ARG 69 HN ARG 69 -4.934 -5.979 -1.881 560 HA ARG 69 HA ARG 69 -4.547 -8.764 -1.822 561 HB2 ARG 69 HB2 ARG 69 -6.271 -7.529 -3.157 562 HB3 ARG 69 HB1 ARG 69 -5.001 -7.104 -4.296 563 HG2 ARG 69 HG2 ARG 69 -4.589 -9.617 -4.483 564 HG3 ARG 69 HG1 ARG 69 -6.158 -9.798 -3.694 565 HD2 ARG 69 HD2 ARG 69 -6.333 -9.877 -6.149 566 HD3 ARG 69 HD1 ARG 69 -7.254 -8.556 -5.432 567 HE ARG 69 HE ARG 69 -4.592 -7.863 -6.333 568 HH11 ARG 69 HH11 ARG 69 -7.998 -8.020 -7.127 569 HH12 ARG 69 HH12 ARG 69 -7.880 -6.855 -8.406 570 HH21 ARG 69 HH21 ARG 69 -4.444 -6.308 -8.011 571 HH22 ARG 69 HH22 ARG 69 -5.870 -5.886 -8.908 572 H TYR 70 HN TYR 70 -2.576 -6.182 -3.001 573 HA TYR 70 HA TYR 70 -0.881 -7.872 -4.607 574 HB2 TYR 70 HB2 TYR 70 -0.988 -5.630 -5.350 575 HB3 TYR 70 HB1 TYR 70 -0.714 -4.993 -3.733 576 HD1 TYR 70 HD2 TYR 70 0.931 -6.766 -6.548 577 HD2 TYR 70 HD1 TYR 70 1.441 -4.559 -2.954 578 HE1 TYR 70 HE2 TYR 70 3.336 -6.615 -7.001 579 HE2 TYR 70 HE1 TYR 70 3.860 -4.393 -3.396 580 HH TYR 70 HH TYR 70 5.566 -5.312 -4.643 581 H VAL 71 HN VAL 71 -0.553 -6.241 -1.457 582 HA VAL 71 HA VAL 71 2.084 -7.164 -1.014 583 HB VAL 71 HB VAL 71 1.769 -6.511 1.307 584 HG11 VAL 71 HG11 VAL 71 0.547 -4.174 0.455 585 HG12 VAL 71 HG12 VAL 71 1.326 -4.821 -0.980 586 HG13 VAL 71 HG13 VAL 71 2.270 -4.514 0.478 587 HG21 VAL 71 HG21 VAL 71 -0.325 -7.071 2.010 588 HG22 VAL 71 HG22 VAL 71 -1.097 -6.493 0.531 589 HG23 VAL 71 HG23 VAL 71 -0.531 -5.340 1.740 590 H THR 72 HN THR 72 -1.073 -8.402 -0.002 591 HA THR 72 HA THR 72 -0.144 -10.446 1.650 592 HB THR 72 HB THR 72 -2.518 -9.633 1.487 593 HG1 THR 72 HG1 THR 72 -2.524 -11.435 2.660 594 HG21 THR 72 HG21 THR 72 -2.684 -9.751 -0.964 595 HG22 THR 72 HG22 THR 72 -3.983 -10.618 -0.149 596 HG23 THR 72 HG23 THR 72 -2.643 -11.511 -0.869 597 H SER 73 HN SER 73 -0.443 -10.257 -1.833 598 HA SER 73 HA SER 73 -0.042 -12.984 -2.413 599 HB2 SER 73 HB2 SER 73 0.185 -12.337 -4.635 600 HB3 SER 73 HB1 SER 73 -0.680 -10.949 -3.970 601 HG SER 73 HG SER 73 1.145 -9.760 -4.003 602 H CYS 74 HN CYS 74 2.087 -10.439 -1.450 603 HA CYS 74 HA CYS 74 4.501 -11.871 -2.199 604 HB2 CYS 74 HB2 CYS 74 4.413 -9.452 -2.545 605 HB3 CYS 74 HB1 CYS 74 4.100 -9.196 -0.830 606 HG CYS 74 HG CYS 74 6.862 -10.952 -1.167 607 H LEU 75 HN LEU 75 3.028 -10.592 0.789 608 HA LEU 75 HA LEU 75 4.793 -11.570 2.666 609 HB2 LEU 75 HB2 LEU 75 1.841 -11.675 3.161 610 HB3 LEU 75 HB1 LEU 75 3.124 -11.219 4.257 611 HG LEU 75 HG LEU 75 2.305 -9.552 1.899 612 HD11 LEU 75 HD11 LEU 75 1.616 -8.986 4.750 613 HD12 LEU 75 HD12 LEU 75 0.551 -9.940 3.724 614 HD13 LEU 75 HD13 LEU 75 0.947 -8.283 3.279 615 HD21 LEU 75 HD21 LEU 75 4.597 -9.295 2.771 616 HD22 LEU 75 HD22 LEU 75 3.922 -8.887 4.347 617 HD23 LEU 75 HD23 LEU 75 3.612 -7.845 2.956 618 H ARG 76 HN ARG 76 2.244 -13.237 0.947 619 HA ARG 76 HA ARG 76 2.590 -15.645 2.542 620 HB2 ARG 76 HB2 ARG 76 0.641 -14.874 0.379 621 HB3 ARG 76 HB1 ARG 76 0.691 -16.478 1.102 622 HG2 ARG 76 HG2 ARG 76 -0.057 -15.720 3.151 623 HG3 ARG 76 HG1 ARG 76 0.456 -14.060 2.835 624 HD2 ARG 76 HD2 ARG 76 -1.981 -14.326 2.760 625 HD3 ARG 76 HD1 ARG 76 -1.308 -13.778 1.227 626 HE ARG 76 HE ARG 76 -1.570 -16.602 1.270 627 HH11 ARG 76 HH11 ARG 76 -3.413 -13.644 0.963 628 HH12 ARG 76 HH12 ARG 76 -4.662 -14.370 -0.001 629 HH21 ARG 76 HH21 ARG 76 -3.191 -17.560 -0.015 630 HH22 ARG 76 HH22 ARG 76 -4.531 -16.602 -0.562 631 H LYS 77 HN LYS 77 4.453 -14.449 0.338 632 HA LYS 77 HA LYS 77 5.014 -17.105 -0.822 633 HB2 LYS 77 HB2 LYS 77 4.775 -14.497 -2.239 634 HB3 LYS 77 HB1 LYS 77 6.013 -15.622 -2.784 635 HG2 LYS 77 HG2 LYS 77 4.367 -17.308 -3.233 636 HG3 LYS 77 HG1 LYS 77 3.097 -16.314 -2.521 637 HD2 LYS 77 HD2 LYS 77 3.302 -14.689 -4.276 638 HD3 LYS 77 HD1 LYS 77 4.738 -15.489 -4.912 639 HE2 LYS 77 HE2 LYS 77 3.381 -17.451 -5.487 640 HE3 LYS 77 HE1 LYS 77 1.942 -16.639 -4.872 641 HZ1 LYS 77 HZ1 LYS 77 3.622 -15.712 -7.135 642 HZ2 LYS 77 HZ2 LYS 77 2.251 -14.917 -6.543 643 HZ3 LYS 77 HZ3 LYS 77 2.100 -16.438 -7.264 644 H LYS 78 HN LYS 78 6.737 -17.658 0.458 645 HA LYS 78 HA LYS 78 8.627 -15.625 1.263 646 HB2 LYS 78 HB2 LYS 78 8.144 -18.474 2.009 647 HB3 LYS 78 HB1 LYS 78 9.717 -17.766 2.338 648 HG2 LYS 78 HG2 LYS 78 8.340 -17.601 4.298 649 HG3 LYS 78 HG1 LYS 78 8.611 -15.988 3.643 650 HD2 LYS 78 HD2 LYS 78 6.396 -16.074 2.573 651 HD3 LYS 78 HD1 LYS 78 6.128 -17.666 3.290 652 HE2 LYS 78 HE2 LYS 78 5.028 -15.972 4.623 653 HE3 LYS 78 HE1 LYS 78 6.367 -16.670 5.532 654 HZ1 LYS 78 HZ1 LYS 78 7.710 -14.745 4.983 655 HZ2 LYS 78 HZ2 LYS 78 6.283 -14.261 5.748 656 HZ3 LYS 78 HZ3 LYS 78 6.444 -14.081 4.074 657 H ARG 79 HN ARG 79 8.801 -18.715 -0.506 658 HA ARG 79 HA ARG 79 11.514 -17.932 -1.337 659 HB2 ARG 79 HB2 ARG 79 10.400 -20.738 -1.581 660 HB3 ARG 79 HB1 ARG 79 12.067 -20.220 -1.717 661 HG2 ARG 79 HG2 ARG 79 12.076 -21.137 0.369 662 HG3 ARG 79 HG1 ARG 79 11.744 -19.448 0.754 663 HD2 ARG 79 HD2 ARG 79 9.306 -20.023 0.750 664 HD3 ARG 79 HD1 ARG 79 9.769 -21.717 0.595 665 HE ARG 79 HE ARG 79 10.830 -20.174 2.844 666 HH11 ARG 79 HH11 ARG 79 8.680 -22.677 1.666 667 HH12 ARG 79 HH12 ARG 79 8.385 -23.337 3.245 668 HH21 ARG 79 HH21 ARG 79 10.418 -21.028 4.918 669 HH22 ARG 79 HH22 ARG 79 9.365 -22.395 5.089 670 H LYS 80 HN LYS 80 9.196 -16.873 -2.507 671 HA LYS 80 HA LYS 80 9.698 -17.647 -5.280 672 HB2 LYS 80 HB2 LYS 80 6.933 -17.388 -4.074 673 HB3 LYS 80 HB1 LYS 80 7.263 -17.517 -5.795 674 HG2 LYS 80 HG2 LYS 80 8.224 -19.735 -5.447 675 HG3 LYS 80 HG1 LYS 80 7.896 -19.604 -3.718 676 HD2 LYS 80 HD2 LYS 80 5.496 -19.408 -4.207 677 HD3 LYS 80 HD1 LYS 80 5.840 -19.579 -5.928 678 HE2 LYS 80 HE2 LYS 80 5.112 -21.701 -5.024 679 HE3 LYS 80 HE1 LYS 80 6.808 -21.801 -5.489 680 HZ1 LYS 80 HZ1 LYS 80 7.426 -21.507 -3.172 681 HZ2 LYS 80 HZ2 LYS 80 6.417 -22.850 -3.354 682 HZ3 LYS 80 HZ3 LYS 80 5.798 -21.409 -2.726 683 HA PRO 81 HA PRO 81 9.543 -13.049 -4.434 684 HB2 PRO 81 HB2 PRO 81 12.025 -12.421 -5.241 685 HB3 PRO 81 HB1 PRO 81 11.702 -13.042 -3.617 686 HG2 PRO 81 HG2 PRO 81 12.717 -14.493 -6.029 687 HG3 PRO 81 HG1 PRO 81 13.281 -14.588 -4.352 688 HD2 PRO 81 HD2 PRO 81 11.612 -16.429 -5.476 689 HD3 PRO 81 HD1 PRO 81 11.606 -16.042 -3.741 690 H GLN 82 HN GLN 82 10.009 -11.231 -6.005 691 HA GLN 82 HA GLN 82 10.184 -11.905 -8.807 692 HB2 GLN 82 HB2 GLN 82 7.847 -12.481 -8.400 693 HB3 GLN 82 HB1 GLN 82 7.563 -10.916 -7.654 694 HG2 GLN 82 HG2 GLN 82 6.657 -10.915 -9.869 695 HG3 GLN 82 HG1 GLN 82 8.044 -9.831 -9.815 696 HE21 GLN 82 HE21 GLN 82 6.787 -11.167 -12.082 697 HE22 GLN 82 HE22 GLN 82 8.035 -12.095 -12.839 698 H ALA 83 HN ALA 83 10.976 -10.205 -9.921 699 HA ALA 83 HA ALA 83 11.358 -7.708 -8.471 700 HB1 ALA 83 HB1 ALA 83 13.289 -8.739 -9.576 701 HB2 ALA 83 HB2 ALA 83 12.938 -7.141 -10.234 702 HB3 ALA 83 HB3 ALA 83 12.474 -8.587 -11.132 703 H1 GLU 201 HT1 GLU 201 -7.797 10.143 10.284 704 H2 GLU 201 HT2 GLU 201 -7.564 8.529 9.849 705 H3 GLU 201 HT3 GLU 201 -6.617 9.738 9.141 706 HA GLU 201 HA GLU 201 -5.705 10.268 11.347 707 HB2 GLU 201 HB2 GLU 201 -7.046 7.673 12.121 708 HB3 GLU 201 HB1 GLU 201 -6.002 8.650 13.140 709 HG2 GLU 201 HG2 GLU 201 -7.604 10.382 13.285 710 HG3 GLU 201 HG1 GLU 201 -8.590 9.668 12.008 711 H ILE 202 HN ILE 202 -6.146 7.143 9.707 712 HA ILE 202 HA ILE 202 -3.508 6.236 10.329 713 HB ILE 202 HB ILE 202 -5.446 5.231 8.236 714 HG12 ILE 202 HG12 ILE 202 -6.242 5.040 10.578 715 HG13 ILE 202 HG11 ILE 202 -5.955 3.468 9.838 716 HG21 ILE 202 HG21 ILE 202 -3.131 4.633 7.703 717 HG22 ILE 202 HG22 ILE 202 -4.070 3.216 8.170 718 HG23 ILE 202 HG23 ILE 202 -2.939 3.941 9.312 719 HD11 ILE 202 HD11 ILE 202 -3.801 3.336 11.004 720 HD12 ILE 202 HD12 ILE 202 -5.159 3.495 12.117 721 HD13 ILE 202 HD13 ILE 202 -4.135 4.888 11.770 722 H LYS 203 HN LYS 203 -1.755 7.136 9.526 723 HA LYS 203 HA LYS 203 -1.714 7.775 6.651 724 HB2 LYS 203 HB2 LYS 203 0.006 9.165 8.706 725 HB3 LYS 203 HB1 LYS 203 -0.260 9.623 7.030 726 HG2 LYS 203 HG2 LYS 203 -2.732 9.906 7.775 727 HG3 LYS 203 HG1 LYS 203 -2.053 9.965 9.389 728 HD2 LYS 203 HD2 LYS 203 -1.326 11.784 7.097 729 HD3 LYS 203 HD1 LYS 203 -2.356 12.206 8.461 730 HE2 LYS 203 HE2 LYS 203 -0.306 13.125 9.042 731 HE3 LYS 203 HE1 LYS 203 -0.311 11.590 9.909 732 HZ1 LYS 203 HZ1 LYS 203 1.136 10.640 8.328 733 HZ2 LYS 203 HZ2 LYS 203 1.790 12.154 8.694 734 HZ3 LYS 203 HZ3 LYS 203 0.943 11.925 7.243 735 H LEU 204 HN LEU 204 0.490 7.550 5.700 736 HA LEU 204 HA LEU 204 2.137 5.578 7.104 737 HB2 LEU 204 HB2 LEU 204 0.655 4.167 5.917 738 HB3 LEU 204 HB1 LEU 204 0.730 5.182 4.492 739 HG LEU 204 HG LEU 204 2.981 4.389 3.983 740 HD11 LEU 204 HD11 LEU 204 4.125 2.805 5.209 741 HD12 LEU 204 HD12 LEU 204 2.790 2.564 6.342 742 HD13 LEU 204 HD13 LEU 204 3.692 4.085 6.343 743 HD21 LEU 204 HD21 LEU 204 2.471 2.049 3.520 744 HD22 LEU 204 HD22 LEU 204 1.097 3.082 3.146 745 HD23 LEU 204 HD23 LEU 204 1.098 2.124 4.624 746 H LYS 205 HN LYS 205 4.138 6.234 7.017 747 HA LYS 205 HA LYS 205 5.093 7.745 4.689 748 HB2 LYS 205 HB2 LYS 205 6.130 7.408 7.492 749 HB3 LYS 205 HB1 LYS 205 7.164 8.003 6.204 750 HG2 LYS 205 HG2 LYS 205 4.596 9.278 7.107 751 HG3 LYS 205 HG1 LYS 205 6.223 9.796 7.558 752 HD2 LYS 205 HD2 LYS 205 6.653 10.034 5.049 753 HD3 LYS 205 HD1 LYS 205 4.906 9.883 4.855 754 HE2 LYS 205 HE2 LYS 205 6.415 11.990 6.380 755 HE3 LYS 205 HE1 LYS 205 5.430 12.206 4.934 756 HZ1 LYS 205 HZ1 LYS 205 3.505 11.399 6.293 757 HZ2 LYS 205 HZ2 LYS 205 4.131 12.905 6.761 758 HZ3 LYS 205 HZ3 LYS 205 4.497 11.524 7.664 759 H ILE 206 HN ILE 206 5.171 5.762 3.356 760 HA ILE 206 HA ILE 206 7.111 3.790 4.138 761 HB ILE 206 HB ILE 206 6.469 4.072 1.238 762 HG12 ILE 206 HG12 ILE 206 4.569 2.691 3.119 763 HG13 ILE 206 HG11 ILE 206 4.260 4.321 2.515 764 HG21 ILE 206 HG21 ILE 206 6.155 1.473 2.366 765 HG22 ILE 206 HG22 ILE 206 7.618 2.213 3.037 766 HG23 ILE 206 HG23 ILE 206 7.424 2.072 1.294 767 HD11 ILE 206 HD11 ILE 206 4.859 2.683 0.290 768 HD12 ILE 206 HD12 ILE 206 3.308 3.402 0.731 769 HD13 ILE 206 HD13 ILE 206 3.728 1.795 1.311 770 H THR 207 HN THR 207 9.067 4.637 4.474 771 HA THR 207 HA THR 207 10.129 6.553 2.546 772 HB THR 207 HB THR 207 11.419 5.687 5.135 773 HG1 THR 207 HG1 THR 207 9.500 6.530 5.803 774 HG21 THR 207 HG21 THR 207 12.194 8.163 4.889 775 HG22 THR 207 HG22 THR 207 11.790 7.931 3.188 776 HG23 THR 207 HG23 THR 207 13.002 6.905 3.957 777 H LYS 208 HN LYS 208 11.246 5.796 0.915 778 HA LYS 208 HA LYS 208 13.253 3.836 1.061 779 HB2 LYS 208 HB2 LYS 208 12.267 1.925 0.079 780 HB3 LYS 208 HB1 LYS 208 11.143 2.414 1.333 781 HG2 LYS 208 HG2 LYS 208 10.763 3.260 -1.517 782 HG3 LYS 208 HG1 LYS 208 10.201 1.697 -0.936 783 HD2 LYS 208 HD2 LYS 208 8.388 2.640 -0.099 784 HD3 LYS 208 HD1 LYS 208 9.360 3.751 0.866 785 HE2 LYS 208 HE2 LYS 208 8.708 4.176 -2.040 786 HE3 LYS 208 HE1 LYS 208 7.746 4.832 -0.718 787 HZ1 LYS 208 HZ1 LYS 208 10.620 5.392 -1.199 788 HZ2 LYS 208 HZ2 LYS 208 9.665 6.059 0.035 789 HZ3 LYS 208 HZ3 LYS 208 9.340 6.426 -1.586 790 H THR 209 HN THR 209 13.019 2.827 -1.589 791 HA THR 209 HA THR 209 13.638 3.359 -3.698 792 HB THR 209 HB THR 209 12.192 4.974 -4.918 793 HG1 THR 209 HG1 THR 209 11.476 6.502 -3.610 794 HG21 THR 209 HG21 THR 209 10.308 3.380 -3.279 795 HG22 THR 209 HG22 THR 209 11.558 2.514 -4.173 796 HG23 THR 209 HG23 THR 209 10.414 3.549 -5.031 797 H ILE 210 HN ILE 210 15.535 4.323 -2.179 798 HA ILE 210 HA ILE 210 15.968 7.093 -2.203 799 HB ILE 210 HB ILE 210 17.298 5.766 -0.740 800 HG12 ILE 210 HG12 ILE 210 19.618 6.443 -1.356 801 HG13 ILE 210 HG11 ILE 210 19.023 6.898 -2.950 802 HG21 ILE 210 HG21 ILE 210 17.312 3.672 -1.934 803 HG22 ILE 210 HG22 ILE 210 18.962 4.135 -1.520 804 HG23 ILE 210 HG23 ILE 210 18.374 4.350 -3.169 805 HD11 ILE 210 HD11 ILE 210 17.568 8.568 -1.926 806 HD12 ILE 210 HD12 ILE 210 19.262 8.835 -1.515 807 HD13 ILE 210 HD13 ILE 210 18.170 8.113 -0.332 808 H GLN 211 HN GLN 211 15.663 8.141 -4.060 809 HA GLN 211 HA GLN 211 16.612 7.046 -6.557 810 HB2 GLN 211 HB2 GLN 211 14.426 8.217 -6.360 811 HB3 GLN 211 HB1 GLN 211 15.291 9.711 -6.031 812 HG2 GLN 211 HG2 GLN 211 14.546 9.563 -8.352 813 HG3 GLN 211 HG1 GLN 211 16.302 9.647 -8.225 814 HE21 GLN 211 HE21 GLN 211 13.575 7.613 -8.964 815 HE22 GLN 211 HE22 GLN 211 14.471 6.371 -9.774 816 H ASN 212 HN ASN 212 18.837 7.034 -6.170 817 HA ASN 212 HA ASN 212 20.086 9.688 -6.339 818 HB2 ASN 212 HB2 ASN 212 20.803 8.340 -4.391 819 HB3 ASN 212 HB1 ASN 212 21.346 7.072 -5.485 820 HD21 ASN 212 HD21 ASN 212 23.258 7.313 -6.574 821 HD22 ASN 212 HD22 ASN 212 24.363 8.608 -6.275 Start of MODEL 11 1 H1 SER 1 HT1 SER 1 -16.157 -7.186 -15.643 2 H2 SER 1 HT2 SER 1 -16.881 -5.704 -15.289 3 H3 SER 1 HT3 SER 1 -16.589 -6.816 -14.054 4 HA SER 1 HA SER 1 -14.215 -6.608 -14.389 5 HB2 SER 1 HB2 SER 1 -14.937 -4.366 -16.285 6 HB3 SER 1 HB1 SER 1 -13.327 -5.000 -15.936 7 HG SER 1 HG SER 1 -13.831 -6.883 -17.003 8 H GLU 2 HN GLU 2 -16.935 -4.827 -13.559 9 HA GLU 2 HA GLU 2 -15.497 -2.489 -12.598 10 HB2 GLU 2 HB2 GLU 2 -17.667 -1.541 -12.174 11 HB3 GLU 2 HB1 GLU 2 -17.672 -2.269 -13.771 12 HG2 GLU 2 HG2 GLU 2 -18.811 -4.236 -12.861 13 HG3 GLU 2 HG1 GLU 2 -18.838 -3.475 -11.273 14 H GLU 3 HN GLU 3 -16.376 -5.501 -11.373 15 HA GLU 3 HA GLU 3 -17.367 -4.865 -8.822 16 HB2 GLU 3 HB2 GLU 3 -15.862 -7.326 -9.713 17 HB3 GLU 3 HB1 GLU 3 -16.807 -7.186 -8.236 18 HG2 GLU 3 HG2 GLU 3 -18.833 -6.920 -9.485 19 HG3 GLU 3 HG1 GLU 3 -17.938 -6.860 -11.003 20 H GLU 4 HN GLU 4 -14.132 -4.871 -10.047 21 HA GLU 4 HA GLU 4 -12.930 -5.066 -7.421 22 HB2 GLU 4 HB2 GLU 4 -10.784 -4.706 -8.598 23 HB3 GLU 4 HB1 GLU 4 -11.718 -6.028 -9.289 24 HG2 GLU 4 HG2 GLU 4 -12.523 -4.437 -11.039 25 HG3 GLU 4 HG1 GLU 4 -11.374 -3.258 -10.404 26 H ASP 5 HN ASP 5 -13.779 -2.518 -9.686 27 HA ASP 5 HA ASP 5 -12.468 -0.508 -8.052 28 HB2 ASP 5 HB2 ASP 5 -14.088 -0.320 -10.602 29 HB3 ASP 5 HB1 ASP 5 -13.567 1.112 -9.708 30 H LYS 6 HN LYS 6 -15.440 -2.125 -8.144 31 HA LYS 6 HA LYS 6 -16.761 -0.005 -6.596 32 HB2 LYS 6 HB2 LYS 6 -17.881 -1.074 -8.627 33 HB3 LYS 6 HB1 LYS 6 -18.036 -2.531 -7.655 34 HG2 LYS 6 HG2 LYS 6 -20.103 -1.332 -7.560 35 HG3 LYS 6 HG1 LYS 6 -19.322 -1.188 -5.982 36 HD2 LYS 6 HD2 LYS 6 -18.512 1.033 -6.569 37 HD3 LYS 6 HD1 LYS 6 -19.237 0.890 -8.171 38 HE2 LYS 6 HE2 LYS 6 -21.452 0.715 -7.146 39 HE3 LYS 6 HE1 LYS 6 -20.723 0.860 -5.548 40 HZ1 LYS 6 HZ1 LYS 6 -21.622 2.965 -6.312 41 HZ2 LYS 6 HZ2 LYS 6 -20.629 2.925 -7.677 42 HZ3 LYS 6 HZ3 LYS 6 -19.943 3.065 -6.140 43 H CYS 7 HN CYS 7 -14.614 -1.654 -5.646 44 HA CYS 7 HA CYS 7 -15.568 -3.803 -4.050 45 HB2 CYS 7 HB2 CYS 7 -13.185 -3.423 -4.901 46 HB3 CYS 7 HB1 CYS 7 -13.019 -2.254 -3.594 47 HG CYS 7 HG CYS 7 -14.093 -5.307 -2.667 48 H LYS 8 HN LYS 8 -15.811 -3.896 -1.801 49 HA LYS 8 HA LYS 8 -16.842 -1.487 -0.618 50 HB2 LYS 8 HB2 LYS 8 -16.664 -4.355 0.224 51 HB3 LYS 8 HB1 LYS 8 -17.030 -3.121 1.416 52 HG2 LYS 8 HG2 LYS 8 -19.054 -4.161 0.562 53 HG3 LYS 8 HG1 LYS 8 -18.989 -2.446 0.155 54 HD2 LYS 8 HD2 LYS 8 -18.286 -2.985 -2.106 55 HD3 LYS 8 HD1 LYS 8 -18.242 -4.702 -1.705 56 HE2 LYS 8 HE2 LYS 8 -20.713 -2.978 -1.598 57 HE3 LYS 8 HE1 LYS 8 -20.277 -4.021 -2.950 58 HZ1 LYS 8 HZ1 LYS 8 -21.838 -5.139 -1.538 59 HZ2 LYS 8 HZ2 LYS 8 -20.870 -4.891 -0.175 60 HZ3 LYS 8 HZ3 LYS 8 -20.341 -5.918 -1.408 61 HA PRO 9 HA PRO 9 -13.105 -0.208 1.395 62 HB2 PRO 9 HB2 PRO 9 -14.674 0.935 3.559 63 HB3 PRO 9 HB1 PRO 9 -13.713 1.749 2.323 64 HG2 PRO 9 HG2 PRO 9 -16.442 1.808 2.412 65 HG3 PRO 9 HG1 PRO 9 -15.493 2.013 0.930 66 HD2 PRO 9 HD2 PRO 9 -17.020 -0.355 1.899 67 HD3 PRO 9 HD1 PRO 9 -16.720 0.204 0.245 68 H MET 10 HN MET 10 -11.766 -1.022 2.910 69 HA MET 10 HA MET 10 -12.831 -2.988 4.756 70 HB2 MET 10 HB2 MET 10 -10.482 -3.554 5.200 71 HB3 MET 10 HB1 MET 10 -10.849 -3.600 3.489 72 HG2 MET 10 HG2 MET 10 -9.804 -1.419 3.197 73 HG3 MET 10 HG1 MET 10 -9.421 -1.391 4.917 74 HE1 MET 10 HE1 MET 10 -8.923 -3.385 1.566 75 HE2 MET 10 HE2 MET 10 -9.294 -4.674 2.712 76 HE3 MET 10 HE3 MET 10 -7.676 -4.544 2.026 77 H SER 11 HN SER 11 -12.294 -2.949 7.016 78 HA SER 11 HA SER 11 -12.968 -0.364 8.046 79 HB2 SER 11 HB2 SER 11 -13.121 -1.578 10.225 80 HB3 SER 11 HB1 SER 11 -14.083 -2.305 8.938 81 HG SER 11 HG SER 11 -12.311 -3.789 8.620 82 H TYR 12 HN TYR 12 -11.941 0.081 10.365 83 HA TYR 12 HA TYR 12 -9.440 1.241 9.880 84 HB2 TYR 12 HB2 TYR 12 -11.128 1.903 11.624 85 HB3 TYR 12 HB1 TYR 12 -10.610 0.519 12.583 86 HD1 TYR 12 HD1 TYR 12 -8.075 0.456 13.199 87 HD2 TYR 12 HD2 TYR 12 -10.121 3.958 11.935 88 HE1 TYR 12 HE1 TYR 12 -6.362 1.841 14.290 89 HE2 TYR 12 HE2 TYR 12 -8.410 5.356 13.012 90 HH TYR 12 HH TYR 12 -6.762 5.143 14.862 91 H GLU 13 HN GLU 13 -10.268 -1.796 11.498 92 HA GLU 13 HA GLU 13 -7.710 -2.465 12.447 93 HB2 GLU 13 HB2 GLU 13 -9.980 -3.499 13.019 94 HB3 GLU 13 HB1 GLU 13 -9.830 -4.420 11.536 95 HG2 GLU 13 HG2 GLU 13 -7.711 -4.548 13.638 96 HG3 GLU 13 HG1 GLU 13 -9.179 -5.506 13.770 97 H GLU 14 HN GLU 14 -9.275 -2.925 9.354 98 HA GLU 14 HA GLU 14 -7.213 -4.673 8.333 99 HB2 GLU 14 HB2 GLU 14 -9.579 -3.352 6.992 100 HB3 GLU 14 HB1 GLU 14 -8.518 -4.522 6.217 101 HG2 GLU 14 HG2 GLU 14 -9.257 -6.274 7.589 102 HG3 GLU 14 HG1 GLU 14 -9.995 -5.166 8.748 103 H LYS 15 HN LYS 15 -8.275 -1.324 7.776 104 HA LYS 15 HA LYS 15 -6.374 -0.587 5.886 105 HB2 LYS 15 HB2 LYS 15 -7.793 0.980 8.030 106 HB3 LYS 15 HB1 LYS 15 -6.686 1.737 6.899 107 HG2 LYS 15 HG2 LYS 15 -8.058 1.250 5.050 108 HG3 LYS 15 HG1 LYS 15 -9.035 0.119 5.997 109 HD2 LYS 15 HD2 LYS 15 -10.304 1.753 6.885 110 HD3 LYS 15 HD1 LYS 15 -8.946 2.865 7.061 111 HE2 LYS 15 HE2 LYS 15 -9.049 3.371 4.677 112 HE3 LYS 15 HE1 LYS 15 -10.380 2.231 4.477 113 HZ1 LYS 15 HZ1 LYS 15 -11.768 3.603 5.832 114 HZ2 LYS 15 HZ2 LYS 15 -11.066 4.600 4.659 115 HZ3 LYS 15 HZ3 LYS 15 -10.479 4.618 6.252 116 H ARG 16 HN ARG 16 -6.182 -0.519 9.432 117 HA ARG 16 HA ARG 16 -3.590 0.561 9.625 118 HB2 ARG 16 HB2 ARG 16 -5.102 0.366 11.556 119 HB3 ARG 16 HB1 ARG 16 -4.962 -1.391 11.493 120 HG2 ARG 16 HG2 ARG 16 -2.343 -0.625 11.642 121 HG3 ARG 16 HG1 ARG 16 -3.144 0.608 12.619 122 HD2 ARG 16 HD2 ARG 16 -2.481 -1.263 14.011 123 HD3 ARG 16 HD1 ARG 16 -4.238 -1.162 13.924 124 HE ARG 16 HE ARG 16 -2.606 -3.103 12.410 125 HH11 ARG 16 HH11 ARG 16 -5.511 -2.242 14.146 126 HH12 ARG 16 HH12 ARG 16 -6.282 -3.767 13.872 127 HH21 ARG 16 HH21 ARG 16 -3.611 -5.130 12.049 128 HH22 ARG 16 HH22 ARG 16 -5.232 -5.395 12.634 129 H GLN 17 HN GLN 17 -4.708 -2.796 9.412 130 HA GLN 17 HA GLN 17 -2.186 -3.996 9.696 131 HB2 GLN 17 HB2 GLN 17 -4.433 -5.107 9.958 132 HB3 GLN 17 HB1 GLN 17 -4.544 -5.130 8.203 133 HG2 GLN 17 HG2 GLN 17 -3.787 -7.268 9.056 134 HG3 GLN 17 HG1 GLN 17 -2.536 -6.495 8.086 135 HE21 GLN 17 HE21 GLN 17 -0.921 -7.722 9.079 136 HE22 GLN 17 HE22 GLN 17 -0.396 -7.403 10.695 137 H LEU 18 HN LEU 18 -3.798 -2.556 7.027 138 HA LEU 18 HA LEU 18 -2.210 -3.715 4.953 139 HB2 LEU 18 HB2 LEU 18 -4.532 -2.270 5.067 140 HB3 LEU 18 HB1 LEU 18 -3.402 -1.060 4.498 141 HG LEU 18 HG LEU 18 -3.814 -3.721 3.139 142 HD11 LEU 18 HD11 LEU 18 -5.024 -1.043 2.498 143 HD12 LEU 18 HD12 LEU 18 -5.887 -2.454 3.102 144 HD13 LEU 18 HD13 LEU 18 -5.147 -2.488 1.501 145 HD21 LEU 18 HD21 LEU 18 -1.713 -2.805 2.533 146 HD22 LEU 18 HD22 LEU 18 -2.392 -1.193 2.356 147 HD23 LEU 18 HD23 LEU 18 -2.819 -2.461 1.210 148 H SER 19 HN SER 19 -2.110 -0.688 6.790 149 HA SER 19 HA SER 19 0.186 0.380 5.577 150 HB2 SER 19 HB2 SER 19 -1.121 1.749 7.088 151 HB3 SER 19 HB1 SER 19 -0.851 0.622 8.416 152 HG SER 19 HG SER 19 1.520 1.364 7.478 153 H LEU 20 HN LEU 20 -0.287 -2.116 7.915 154 HA LEU 20 HA LEU 20 2.463 -2.307 8.695 155 HB2 LEU 20 HB2 LEU 20 0.042 -3.998 9.201 156 HB3 LEU 20 HB1 LEU 20 1.622 -4.387 9.844 157 HG LEU 20 HG LEU 20 0.015 -1.910 10.440 158 HD11 LEU 20 HD11 LEU 20 -0.671 -4.098 11.436 159 HD12 LEU 20 HD12 LEU 20 -0.292 -2.821 12.590 160 HD13 LEU 20 HD13 LEU 20 0.872 -4.115 12.287 161 HD21 LEU 20 HD21 LEU 20 2.826 -2.694 11.105 162 HD22 LEU 20 HD22 LEU 20 1.898 -1.654 12.186 163 HD23 LEU 20 HD23 LEU 20 2.207 -1.149 10.525 164 H ASP 21 HN ASP 21 0.354 -3.894 6.373 165 HA ASP 21 HA ASP 21 2.176 -6.064 5.937 166 HB2 ASP 21 HB2 ASP 21 0.637 -6.791 4.178 167 HB3 ASP 21 HB1 ASP 21 -0.193 -6.469 5.688 168 H ILE 22 HN ILE 22 1.522 -2.996 4.345 169 HA ILE 22 HA ILE 22 3.294 -3.480 2.168 170 HB ILE 22 HB ILE 22 2.332 -0.880 3.355 171 HG12 ILE 22 HG12 ILE 22 1.509 -2.142 0.746 172 HG13 ILE 22 HG11 ILE 22 0.707 -2.571 2.260 173 HG21 ILE 22 HG21 ILE 22 4.338 -0.360 2.208 174 HG22 ILE 22 HG22 ILE 22 3.007 0.070 1.131 175 HG23 ILE 22 HG23 ILE 22 3.915 -1.416 0.859 176 HD11 ILE 22 HD11 ILE 22 0.059 -0.304 2.578 177 HD12 ILE 22 HD12 ILE 22 -0.485 -0.849 1.001 178 HD13 ILE 22 HD13 ILE 22 0.922 0.208 1.139 179 H ASN 23 HN ASN 23 3.647 -2.168 5.385 180 HA ASN 23 HA ASN 23 6.280 -1.215 5.175 181 HB2 ASN 23 HB2 ASN 23 4.406 -1.140 7.126 182 HB3 ASN 23 HB1 ASN 23 5.418 -2.440 7.743 183 HD21 ASN 23 HD21 ASN 23 6.086 -1.203 9.501 184 HD22 ASN 23 HD22 ASN 23 7.217 0.092 9.332 185 H LYS 24 HN LYS 24 5.005 -4.399 5.242 186 HA LYS 24 HA LYS 24 7.367 -5.715 6.254 187 HB2 LYS 24 HB2 LYS 24 4.832 -6.716 4.962 188 HB3 LYS 24 HB1 LYS 24 6.134 -7.791 5.461 189 HG2 LYS 24 HG2 LYS 24 5.837 -7.090 7.770 190 HG3 LYS 24 HG1 LYS 24 4.592 -5.940 7.279 191 HD2 LYS 24 HD2 LYS 24 3.266 -7.859 6.392 192 HD3 LYS 24 HD1 LYS 24 4.477 -8.948 7.070 193 HE2 LYS 24 HE2 LYS 24 2.842 -6.964 8.648 194 HE3 LYS 24 HE1 LYS 24 2.495 -8.686 8.517 195 HZ1 LYS 24 HZ1 LYS 24 3.665 -8.176 10.555 196 HZ2 LYS 24 HZ2 LYS 24 4.950 -7.502 9.692 197 HZ3 LYS 24 HZ3 LYS 24 4.621 -9.154 9.562 198 H LEU 25 HN LEU 25 6.107 -4.754 3.169 199 HA LEU 25 HA LEU 25 7.399 -6.625 1.511 200 HB2 LEU 25 HB2 LEU 25 6.568 -3.802 0.952 201 HB3 LEU 25 HB1 LEU 25 7.034 -4.944 -0.277 202 HG LEU 25 HG LEU 25 4.592 -4.965 1.452 203 HD11 LEU 25 HD11 LEU 25 5.113 -4.937 -1.497 204 HD12 LEU 25 HD12 LEU 25 4.411 -3.652 -0.527 205 HD13 LEU 25 HD13 LEU 25 3.521 -5.151 -0.785 206 HD21 LEU 25 HD21 LEU 25 5.788 -7.179 -0.140 207 HD22 LEU 25 HD22 LEU 25 4.077 -7.128 0.264 208 HD23 LEU 25 HD23 LEU 25 5.288 -7.209 1.546 209 HA PRO 26 HA PRO 26 11.683 -5.172 1.507 210 HB2 PRO 26 HB2 PRO 26 11.667 -6.673 -1.063 211 HB3 PRO 26 HB1 PRO 26 12.773 -6.811 0.313 212 HG2 PRO 26 HG2 PRO 26 10.947 -8.689 -0.147 213 HG3 PRO 26 HG1 PRO 26 11.311 -8.170 1.509 214 HD2 PRO 26 HD2 PRO 26 8.985 -7.450 -0.237 215 HD3 PRO 26 HD1 PRO 26 9.017 -7.830 1.500 216 H GLY 27 HN GLY 27 12.854 -3.659 0.246 217 HA2 GLY 27 HA2 GLY 27 11.475 -1.520 -0.675 218 HA3 GLY 27 HA1 GLY 27 13.119 -1.862 -1.162 219 H GLU 28 HN GLU 28 12.759 -4.068 -2.821 220 HA GLU 28 HA GLU 28 12.039 -2.925 -5.251 221 HB2 GLU 28 HB2 GLU 28 13.433 -4.936 -5.120 222 HB3 GLU 28 HB1 GLU 28 12.083 -5.853 -4.483 223 HG2 GLU 28 HG2 GLU 28 10.995 -4.996 -6.775 224 HG3 GLU 28 HG1 GLU 28 12.693 -5.065 -7.232 225 H LYS 29 HN LYS 29 10.197 -5.272 -3.343 226 HA LYS 29 HA LYS 29 7.858 -5.218 -4.916 227 HB2 LYS 29 HB2 LYS 29 8.450 -6.048 -2.079 228 HB3 LYS 29 HB1 LYS 29 6.849 -6.219 -2.789 229 HG2 LYS 29 HG2 LYS 29 9.347 -7.489 -3.891 230 HG3 LYS 29 HG1 LYS 29 8.184 -8.299 -2.839 231 HD2 LYS 29 HD2 LYS 29 6.427 -7.693 -4.566 232 HD3 LYS 29 HD1 LYS 29 7.761 -7.269 -5.634 233 HE2 LYS 29 HE2 LYS 29 7.094 -9.495 -6.155 234 HE3 LYS 29 HE1 LYS 29 8.645 -9.583 -5.329 235 HZ1 LYS 29 HZ1 LYS 29 7.004 -11.247 -4.580 236 HZ2 LYS 29 HZ2 LYS 29 6.029 -9.996 -4.002 237 HZ3 LYS 29 HZ3 LYS 29 7.559 -10.254 -3.328 238 H LEU 30 HN LEU 30 8.951 -3.416 -2.162 239 HA LEU 30 HA LEU 30 6.556 -2.150 -1.396 240 HB2 LEU 30 HB2 LEU 30 8.570 -2.251 -0.019 241 HB3 LEU 30 HB1 LEU 30 9.439 -1.268 -1.177 242 HG LEU 30 HG LEU 30 8.340 0.679 -0.537 243 HD11 LEU 30 HD11 LEU 30 6.343 -0.672 1.203 244 HD12 LEU 30 HD12 LEU 30 6.052 -0.611 -0.529 245 HD13 LEU 30 HD13 LEU 30 6.255 0.880 0.381 246 HD21 LEU 30 HD21 LEU 30 8.514 0.688 1.934 247 HD22 LEU 30 HD22 LEU 30 9.900 -0.054 1.137 248 HD23 LEU 30 HD23 LEU 30 8.670 -1.066 1.894 249 H GLY 31 HN GLY 31 9.035 -1.197 -3.758 250 HA2 GLY 31 HA2 GLY 31 8.186 1.412 -4.234 251 HA3 GLY 31 HA1 GLY 31 9.010 0.408 -5.408 252 H ARG 32 HN ARG 32 6.664 -1.548 -5.205 253 HA ARG 32 HA ARG 32 5.135 -0.465 -7.352 254 HB2 ARG 32 HB2 ARG 32 5.489 -2.896 -7.047 255 HB3 ARG 32 HB1 ARG 32 4.517 -2.828 -5.586 256 HG2 ARG 32 HG2 ARG 32 3.183 -3.687 -7.409 257 HG3 ARG 32 HG1 ARG 32 2.586 -2.105 -6.929 258 HD2 ARG 32 HD2 ARG 32 2.710 -2.380 -9.403 259 HD3 ARG 32 HD1 ARG 32 3.672 -1.040 -8.790 260 HE ARG 32 HE ARG 32 5.633 -2.546 -8.997 261 HH11 ARG 32 HH11 ARG 32 2.763 -3.230 -10.891 262 HH12 ARG 32 HH12 ARG 32 3.642 -4.004 -12.169 263 HH21 ARG 32 HH21 ARG 32 6.783 -3.570 -10.673 264 HH22 ARG 32 HH22 ARG 32 5.928 -4.196 -12.047 265 H VAL 33 HN VAL 33 4.482 -0.984 -3.905 266 HA VAL 33 HA VAL 33 1.744 -0.213 -4.064 267 HB VAL 33 HB VAL 33 3.008 0.211 -1.452 268 HG11 VAL 33 HG11 VAL 33 0.787 -1.572 -2.449 269 HG12 VAL 33 HG12 VAL 33 0.609 0.074 -1.839 270 HG13 VAL 33 HG13 VAL 33 1.150 -1.204 -0.762 271 HG21 VAL 33 HG21 VAL 33 4.520 -1.512 -2.076 272 HG22 VAL 33 HG22 VAL 33 3.241 -2.446 -2.853 273 HG23 VAL 33 HG23 VAL 33 3.264 -2.274 -1.100 274 H VAL 34 HN VAL 34 4.645 1.518 -2.942 275 HA VAL 34 HA VAL 34 3.499 3.978 -2.378 276 HB VAL 34 HB VAL 34 5.667 4.400 -1.978 277 HG11 VAL 34 HG11 VAL 34 6.115 2.046 -2.201 278 HG12 VAL 34 HG12 VAL 34 7.479 3.011 -2.763 279 HG13 VAL 34 HG13 VAL 34 6.395 2.250 -3.928 280 HG21 VAL 34 HG21 VAL 34 5.502 5.852 -3.936 281 HG22 VAL 34 HG22 VAL 34 6.024 4.528 -4.970 282 HG23 VAL 34 HG23 VAL 34 7.126 5.196 -3.767 283 H HIS 35 HN HIS 35 4.391 2.575 -5.451 284 HA HIS 35 HA HIS 35 3.702 4.809 -7.066 285 HB2 HIS 35 HB2 HIS 35 5.228 2.881 -7.679 286 HB3 HIS 35 HB1 HIS 35 3.774 1.927 -7.938 287 HD1 HIS 35 HD1 HIS 35 5.889 4.568 -9.462 288 HD2 HIS 35 HD2 HIS 35 2.261 2.689 -10.238 289 HE1 HIS 35 HE1 HIS 35 5.310 5.164 -11.834 290 HE2 HIS 35 HE2 HIS 35 3.095 4.051 -12.272 291 H ILE 36 HN ILE 36 1.936 1.881 -6.090 292 HA ILE 36 HA ILE 36 -0.320 2.216 -7.714 293 HB ILE 36 HB ILE 36 -0.292 0.961 -4.955 294 HG12 ILE 36 HG12 ILE 36 0.188 -0.202 -7.700 295 HG13 ILE 36 HG11 ILE 36 1.304 -0.178 -6.347 296 HG21 ILE 36 HG21 ILE 36 -2.489 0.610 -5.228 297 HG22 ILE 36 HG22 ILE 36 -2.182 -0.188 -6.771 298 HG23 ILE 36 HG23 ILE 36 -2.427 1.556 -6.717 299 HD11 ILE 36 HD11 ILE 36 -0.238 -1.686 -5.121 300 HD12 ILE 36 HD12 ILE 36 0.427 -2.383 -6.597 301 HD13 ILE 36 HD13 ILE 36 -1.227 -1.778 -6.576 302 H ILE 37 HN ILE 37 0.169 3.246 -4.329 303 HA ILE 37 HA ILE 37 -2.354 4.454 -4.064 304 HB ILE 37 HB ILE 37 0.182 5.195 -2.591 305 HG12 ILE 37 HG12 ILE 37 -1.699 3.751 -0.999 306 HG13 ILE 37 HG11 ILE 37 -1.446 2.845 -2.488 307 HG21 ILE 37 HG21 ILE 37 -1.998 6.689 -2.696 308 HG22 ILE 37 HG22 ILE 37 -1.070 6.502 -1.205 309 HG23 ILE 37 HG23 ILE 37 -2.537 5.554 -1.457 310 HD11 ILE 37 HD11 ILE 37 0.912 2.743 -2.081 311 HD12 ILE 37 HD12 ILE 37 0.045 2.176 -0.651 312 HD13 ILE 37 HD13 ILE 37 0.747 3.792 -0.675 313 H GLN 38 HN GLN 38 0.791 5.885 -4.844 314 HA GLN 38 HA GLN 38 -0.016 8.517 -5.199 315 HB2 GLN 38 HB2 GLN 38 2.202 6.909 -6.426 316 HB3 GLN 38 HB1 GLN 38 1.969 8.594 -6.864 317 HG2 GLN 38 HG2 GLN 38 1.935 8.660 -4.103 318 HG3 GLN 38 HG1 GLN 38 3.126 7.412 -4.464 319 HE21 GLN 38 HE21 GLN 38 4.792 8.720 -3.683 320 HE22 GLN 38 HE22 GLN 38 5.396 10.066 -4.581 321 H SER 39 HN SER 39 -0.229 5.812 -7.436 322 HA SER 39 HA SER 39 -0.952 7.435 -9.677 323 HB2 SER 39 HB2 SER 39 0.117 5.283 -10.038 324 HB3 SER 39 HB1 SER 39 -1.210 4.454 -9.224 325 HG SER 39 HG SER 39 -1.489 6.019 -11.581 326 H ARG 40 HN ARG 40 -2.748 5.506 -7.305 327 HA ARG 40 HA ARG 40 -5.242 5.952 -8.684 328 HB2 ARG 40 HB2 ARG 40 -4.781 4.780 -5.951 329 HB3 ARG 40 HB1 ARG 40 -6.267 4.692 -6.881 330 HG2 ARG 40 HG2 ARG 40 -4.535 3.583 -8.631 331 HG3 ARG 40 HG1 ARG 40 -3.806 3.103 -7.097 332 HD2 ARG 40 HD2 ARG 40 -5.382 1.427 -7.886 333 HD3 ARG 40 HD1 ARG 40 -5.895 2.161 -6.370 334 HE ARG 40 HE ARG 40 -7.172 3.642 -8.254 335 HH11 ARG 40 HH11 ARG 40 -7.006 0.205 -7.606 336 HH12 ARG 40 HH12 ARG 40 -8.599 -0.115 -8.210 337 HH21 ARG 40 HH21 ARG 40 -9.268 3.221 -9.065 338 HH22 ARG 40 HH22 ARG 40 -9.880 1.594 -9.079 339 H GLU 41 HN GLU 41 -3.601 7.278 -5.869 340 HA GLU 41 HA GLU 41 -5.898 9.058 -5.418 341 HB2 GLU 41 HB2 GLU 41 -3.579 8.535 -3.582 342 HB3 GLU 41 HB1 GLU 41 -5.027 9.447 -3.198 343 HG2 GLU 41 HG2 GLU 41 -4.731 6.495 -3.610 344 HG3 GLU 41 HG1 GLU 41 -5.262 7.354 -2.170 345 HA PRO 42 HA PRO 42 -2.979 11.932 -7.749 346 HB2 PRO 42 HB2 PRO 42 -5.482 13.481 -7.464 347 HB3 PRO 42 HB1 PRO 42 -4.453 13.242 -8.877 348 HG2 PRO 42 HG2 PRO 42 -6.856 11.917 -8.369 349 HG3 PRO 42 HG1 PRO 42 -5.633 11.464 -9.547 350 HD2 PRO 42 HD2 PRO 42 -6.399 10.022 -7.234 351 HD3 PRO 42 HD1 PRO 42 -5.106 9.638 -8.366 352 H SER 43 HN SER 43 -5.022 12.412 -4.902 353 HA SER 43 HA SER 43 -4.283 15.009 -4.249 354 HB2 SER 43 HB2 SER 43 -5.044 12.835 -2.295 355 HB3 SER 43 HB1 SER 43 -5.295 14.573 -2.125 356 HG SER 43 HG SER 43 -6.836 14.514 -3.702 357 H LEU 44 HN LEU 44 -2.491 12.075 -3.885 358 HA LEU 44 HA LEU 44 -0.550 13.519 -2.209 359 HB2 LEU 44 HB2 LEU 44 0.070 11.347 -1.204 360 HB3 LEU 44 HB1 LEU 44 -1.567 11.844 -0.843 361 HG LEU 44 HG LEU 44 -2.084 10.285 -2.948 362 HD11 LEU 44 HD11 LEU 44 0.322 9.771 -3.261 363 HD12 LEU 44 HD12 LEU 44 -0.679 8.345 -2.993 364 HD13 LEU 44 HD13 LEU 44 0.318 8.981 -1.685 365 HD21 LEU 44 HD21 LEU 44 -3.093 10.085 -0.752 366 HD22 LEU 44 HD22 LEU 44 -1.623 9.343 -0.124 367 HD23 LEU 44 HD23 LEU 44 -2.584 8.502 -1.338 368 H LYS 45 HN LYS 45 -0.899 12.923 -5.211 369 HA LYS 45 HA LYS 45 1.370 11.276 -5.832 370 HB2 LYS 45 HB2 LYS 45 0.897 11.670 -8.107 371 HB3 LYS 45 HB1 LYS 45 -0.670 11.610 -7.321 372 HG2 LYS 45 HG2 LYS 45 -0.664 14.094 -7.284 373 HG3 LYS 45 HG1 LYS 45 0.825 14.047 -8.234 374 HD2 LYS 45 HD2 LYS 45 -0.532 12.522 -9.817 375 HD3 LYS 45 HD1 LYS 45 -1.938 13.220 -9.011 376 HE2 LYS 45 HE2 LYS 45 0.257 14.760 -10.368 377 HE3 LYS 45 HE1 LYS 45 -1.338 14.445 -11.050 378 HZ1 LYS 45 HZ1 LYS 45 -1.282 16.634 -10.108 379 HZ2 LYS 45 HZ2 LYS 45 -0.731 16.047 -8.624 380 HZ3 LYS 45 HZ3 LYS 45 -2.292 15.671 -9.155 381 H ASN 46 HN ASN 46 1.094 14.332 -4.669 382 HA ASN 46 HA ASN 46 3.475 15.351 -6.015 383 HB2 ASN 46 HB2 ASN 46 2.946 17.431 -4.633 384 HB3 ASN 46 HB1 ASN 46 1.786 17.002 -5.886 385 HD21 ASN 46 HD21 ASN 46 2.376 17.210 -2.478 386 HD22 ASN 46 HD22 ASN 46 0.743 16.948 -1.979 387 H SER 47 HN SER 47 2.963 13.280 -3.631 388 HA SER 47 HA SER 47 4.811 14.277 -1.665 389 HB2 SER 47 HB2 SER 47 3.811 11.437 -2.091 390 HB3 SER 47 HB1 SER 47 4.607 12.069 -0.650 391 HG SER 47 HG SER 47 2.558 13.652 -1.151 392 H ASN 48 HN ASN 48 6.981 13.790 -1.488 393 HA ASN 48 HA ASN 48 8.422 13.093 -3.816 394 HB2 ASN 48 HB2 ASN 48 9.370 12.968 -0.935 395 HB3 ASN 48 HB1 ASN 48 10.397 13.006 -2.364 396 HD21 ASN 48 HD21 ASN 48 10.205 14.802 -0.046 397 HD22 ASN 48 HD22 ASN 48 9.953 16.378 -0.724 398 HA PRO 49 HA PRO 49 7.706 8.743 -3.819 399 HB2 PRO 49 HB2 PRO 49 9.874 7.956 -5.295 400 HB3 PRO 49 HB1 PRO 49 8.406 8.652 -5.984 401 HG2 PRO 49 HG2 PRO 49 11.010 9.983 -5.329 402 HG3 PRO 49 HG1 PRO 49 9.996 10.165 -6.776 403 HD2 PRO 49 HD2 PRO 49 9.963 11.991 -4.825 404 HD3 PRO 49 HD1 PRO 49 8.476 11.552 -5.687 405 H ASP 50 HN ASP 50 10.578 10.153 -2.546 406 HA ASP 50 HA ASP 50 11.597 7.704 -1.413 407 HB2 ASP 50 HB2 ASP 50 12.403 10.486 -0.580 408 HB3 ASP 50 HB1 ASP 50 13.352 9.009 -0.519 409 H GLU 51 HN GLU 51 9.474 10.267 -0.528 410 HA GLU 51 HA GLU 51 9.277 9.363 2.268 411 HB2 GLU 51 HB2 GLU 51 10.251 11.929 1.238 412 HB3 GLU 51 HB1 GLU 51 8.863 12.135 2.295 413 HG2 GLU 51 HG2 GLU 51 11.164 10.462 3.163 414 HG3 GLU 51 HG1 GLU 51 11.254 12.214 3.266 415 H ILE 52 HN ILE 52 7.387 8.378 0.867 416 HA ILE 52 HA ILE 52 5.563 10.296 -0.227 417 HB ILE 52 HB ILE 52 4.450 8.569 -1.265 418 HG12 ILE 52 HG12 ILE 52 5.540 6.452 0.520 419 HG13 ILE 52 HG11 ILE 52 4.117 7.372 1.013 420 HG21 ILE 52 HG21 ILE 52 7.091 7.221 -0.802 421 HG22 ILE 52 HG22 ILE 52 6.925 8.670 -1.801 422 HG23 ILE 52 HG23 ILE 52 6.082 7.187 -2.253 423 HD11 ILE 52 HD11 ILE 52 2.982 6.705 -1.031 424 HD12 ILE 52 HD12 ILE 52 3.497 5.300 -0.094 425 HD13 ILE 52 HD13 ILE 52 4.403 5.785 -1.523 426 H GLU 53 HN GLU 53 3.424 10.636 0.336 427 HA GLU 53 HA GLU 53 2.925 10.244 3.208 428 HB2 GLU 53 HB2 GLU 53 3.250 12.569 1.905 429 HB3 GLU 53 HB1 GLU 53 1.533 12.347 1.624 430 HG2 GLU 53 HG2 GLU 53 2.962 12.634 4.244 431 HG3 GLU 53 HG1 GLU 53 1.771 13.714 3.531 432 H ILE 54 HN ILE 54 1.398 8.716 3.537 433 HA ILE 54 HA ILE 54 -0.763 8.441 1.541 434 HB ILE 54 HB ILE 54 0.294 6.367 3.464 435 HG12 ILE 54 HG12 ILE 54 0.436 6.457 0.449 436 HG13 ILE 54 HG11 ILE 54 1.769 6.900 1.513 437 HG21 ILE 54 HG21 ILE 54 -1.185 4.839 2.152 438 HG22 ILE 54 HG22 ILE 54 -1.908 6.264 1.415 439 HG23 ILE 54 HG23 ILE 54 -2.044 6.006 3.154 440 HD11 ILE 54 HD11 ILE 54 1.880 4.604 0.564 441 HD12 ILE 54 HD12 ILE 54 0.456 4.198 1.521 442 HD13 ILE 54 HD13 ILE 54 1.954 4.676 2.318 443 H ASP 55 HN ASP 55 -2.862 8.582 2.166 444 HA ASP 55 HA ASP 55 -3.375 8.898 5.060 445 HB2 ASP 55 HB2 ASP 55 -3.668 11.020 3.739 446 HB3 ASP 55 HB1 ASP 55 -4.924 10.208 2.811 447 H PHE 56 HN PHE 56 -4.000 6.833 5.490 448 HA PHE 56 HA PHE 56 -5.276 5.180 3.626 449 HB2 PHE 56 HB2 PHE 56 -4.324 4.959 6.350 450 HB3 PHE 56 HB1 PHE 56 -5.780 4.003 6.069 451 HD1 PHE 56 HD1 PHE 56 -2.273 4.503 5.097 452 HD2 PHE 56 HD2 PHE 56 -5.772 2.162 4.575 453 HE1 PHE 56 HE1 PHE 56 -0.959 2.797 3.909 454 HE2 PHE 56 HE2 PHE 56 -4.484 0.462 3.399 455 HZ PHE 56 HZ PHE 56 -2.072 0.756 3.064 456 H GLU 57 HN GLU 57 -6.629 7.569 5.648 457 HA GLU 57 HA GLU 57 -9.249 6.322 5.674 458 HB2 GLU 57 HB2 GLU 57 -8.140 8.864 6.817 459 HB3 GLU 57 HB1 GLU 57 -9.868 8.530 6.805 460 HG2 GLU 57 HG2 GLU 57 -7.827 6.689 8.015 461 HG3 GLU 57 HG1 GLU 57 -8.679 7.940 8.918 462 H THR 58 HN THR 58 -7.554 7.895 3.368 463 HA THR 58 HA THR 58 -10.017 9.057 2.252 464 HB THR 58 HB THR 58 -8.631 10.734 1.068 465 HG1 THR 58 HG1 THR 58 -6.587 9.406 2.497 466 HG21 THR 58 HG21 THR 58 -8.437 10.668 4.073 467 HG22 THR 58 HG22 THR 58 -9.719 11.396 3.103 468 HG23 THR 58 HG23 THR 58 -8.099 12.094 3.091 469 H LEU 59 HN LEU 59 -7.526 6.802 1.817 470 HA LEU 59 HA LEU 59 -7.285 6.796 -1.008 471 HB2 LEU 59 HB2 LEU 59 -7.148 4.242 0.555 472 HB3 LEU 59 HB1 LEU 59 -6.214 4.741 -0.832 473 HG LEU 59 HG LEU 59 -5.869 5.708 1.998 474 HD11 LEU 59 HD11 LEU 59 -4.296 3.882 0.209 475 HD12 LEU 59 HD12 LEU 59 -4.927 3.577 1.826 476 HD13 LEU 59 HD13 LEU 59 -3.577 4.686 1.603 477 HD21 LEU 59 HD21 LEU 59 -4.610 6.635 -0.561 478 HD22 LEU 59 HD22 LEU 59 -3.821 6.837 0.993 479 HD23 LEU 59 HD23 LEU 59 -5.383 7.592 0.692 480 H LYS 60 HN LYS 60 -8.483 5.801 -2.570 481 HA LYS 60 HA LYS 60 -11.208 5.244 -2.125 482 HB2 LYS 60 HB2 LYS 60 -9.440 4.398 -4.435 483 HB3 LYS 60 HB1 LYS 60 -11.196 4.510 -4.464 484 HG2 LYS 60 HG2 LYS 60 -11.067 6.914 -4.160 485 HG3 LYS 60 HG1 LYS 60 -9.307 6.825 -4.054 486 HD2 LYS 60 HD2 LYS 60 -9.267 5.896 -6.351 487 HD3 LYS 60 HD1 LYS 60 -11.012 6.158 -6.448 488 HE2 LYS 60 HE2 LYS 60 -9.766 7.996 -7.487 489 HE3 LYS 60 HE1 LYS 60 -10.695 8.543 -6.093 490 HZ1 LYS 60 HZ1 LYS 60 -7.772 8.031 -6.208 491 HZ2 LYS 60 HZ2 LYS 60 -8.609 8.336 -4.770 492 HZ3 LYS 60 HZ3 LYS 60 -8.544 9.523 -5.979 493 HA PRO 61 HA PRO 61 -11.345 1.097 -0.648 494 HB2 PRO 61 HB2 PRO 61 -13.477 0.531 -2.612 495 HB3 PRO 61 HB1 PRO 61 -13.524 0.451 -0.851 496 HG2 PRO 61 HG2 PRO 61 -14.751 2.403 -2.263 497 HG3 PRO 61 HG1 PRO 61 -14.105 2.661 -0.634 498 HD2 PRO 61 HD2 PRO 61 -13.040 3.552 -3.264 499 HD3 PRO 61 HD1 PRO 61 -12.884 4.304 -1.664 500 H SER 62 HN SER 62 -11.304 1.627 -4.119 501 HA SER 62 HA SER 62 -10.442 -1.100 -4.660 502 HB2 SER 62 HB2 SER 62 -11.667 0.395 -6.430 503 HB3 SER 62 HB1 SER 62 -10.052 1.044 -6.749 504 HG SER 62 HG SER 62 -10.956 -1.621 -7.009 505 H THR 63 HN THR 63 -8.922 1.914 -3.951 506 HA THR 63 HA THR 63 -6.307 1.150 -4.731 507 HB THR 63 HB THR 63 -6.867 3.047 -2.444 508 HG1 THR 63 HG1 THR 63 -7.057 4.640 -4.262 509 HG21 THR 63 HG21 THR 63 -4.530 2.507 -3.059 510 HG22 THR 63 HG22 THR 63 -4.925 4.202 -3.329 511 HG23 THR 63 HG23 THR 63 -4.842 3.086 -4.692 512 H LEU 64 HN LEU 64 -7.967 1.149 -1.578 513 HA LEU 64 HA LEU 64 -5.980 -0.077 -0.065 514 HB2 LEU 64 HB2 LEU 64 -8.982 -0.273 0.179 515 HB3 LEU 64 HB1 LEU 64 -7.866 -0.874 1.391 516 HG LEU 64 HG LEU 64 -8.026 2.010 0.536 517 HD11 LEU 64 HD11 LEU 64 -10.102 1.285 1.645 518 HD12 LEU 64 HD12 LEU 64 -9.176 2.408 2.634 519 HD13 LEU 64 HD13 LEU 64 -9.148 0.684 2.998 520 HD21 LEU 64 HD21 LEU 64 -5.869 1.454 1.407 521 HD22 LEU 64 HD22 LEU 64 -6.593 0.604 2.767 522 HD23 LEU 64 HD23 LEU 64 -6.760 2.355 2.631 523 H ARG 65 HN ARG 65 -8.595 -1.584 -1.933 524 HA ARG 65 HA ARG 65 -7.998 -4.221 -1.132 525 HB2 ARG 65 HB2 ARG 65 -10.170 -3.500 -2.084 526 HB3 ARG 65 HB1 ARG 65 -9.381 -3.229 -3.621 527 HG2 ARG 65 HG2 ARG 65 -10.725 -5.381 -3.335 528 HG3 ARG 65 HG1 ARG 65 -9.143 -5.472 -4.091 529 HD2 ARG 65 HD2 ARG 65 -8.176 -6.391 -2.076 530 HD3 ARG 65 HD1 ARG 65 -9.677 -6.157 -1.173 531 HE ARG 65 HE ARG 65 -10.303 -7.703 -3.379 532 HH11 ARG 65 HH11 ARG 65 -8.247 -8.010 -0.540 533 HH12 ARG 65 HH12 ARG 65 -8.388 -9.740 -0.499 534 HH21 ARG 65 HH21 ARG 65 -10.480 -9.958 -3.302 535 HH22 ARG 65 HH22 ARG 65 -9.657 -10.846 -2.063 536 H GLU 66 HN GLU 66 -6.727 -2.143 -3.632 537 HA GLU 66 HA GLU 66 -5.405 -4.228 -5.100 538 HB2 GLU 66 HB2 GLU 66 -6.057 -2.221 -6.253 539 HB3 GLU 66 HB1 GLU 66 -5.146 -1.221 -5.129 540 HG2 GLU 66 HG2 GLU 66 -3.961 -1.381 -7.199 541 HG3 GLU 66 HG1 GLU 66 -3.064 -2.255 -5.957 542 H LEU 67 HN LEU 67 -4.573 -1.917 -2.609 543 HA LEU 67 HA LEU 67 -1.788 -2.346 -2.602 544 HB2 LEU 67 HB2 LEU 67 -3.611 -1.512 -0.331 545 HB3 LEU 67 HB1 LEU 67 -1.886 -1.229 -0.410 546 HG LEU 67 HG LEU 67 -3.978 0.016 -2.198 547 HD11 LEU 67 HD11 LEU 67 -2.212 1.241 -0.092 548 HD12 LEU 67 HD12 LEU 67 -3.922 0.867 0.114 549 HD13 LEU 67 HD13 LEU 67 -3.419 2.074 -1.070 550 HD21 LEU 67 HD21 LEU 67 -1.747 -0.471 -3.265 551 HD22 LEU 67 HD22 LEU 67 -1.059 0.676 -2.116 552 HD23 LEU 67 HD23 LEU 67 -2.273 1.210 -3.271 553 H GLU 68 HN GLU 68 -4.462 -3.603 -0.670 554 HA GLU 68 HA GLU 68 -2.944 -5.315 0.986 555 HB2 GLU 68 HB2 GLU 68 -5.163 -4.562 1.612 556 HB3 GLU 68 HB1 GLU 68 -5.869 -5.376 0.226 557 HG2 GLU 68 HG2 GLU 68 -4.341 -7.162 1.931 558 HG3 GLU 68 HG1 GLU 68 -5.669 -6.373 2.766 559 H ARG 69 HN ARG 69 -4.960 -6.028 -1.864 560 HA ARG 69 HA ARG 69 -4.545 -8.789 -1.951 561 HB2 ARG 69 HB2 ARG 69 -6.238 -7.567 -3.292 562 HB3 ARG 69 HB1 ARG 69 -4.945 -6.965 -4.324 563 HG2 ARG 69 HG2 ARG 69 -4.375 -9.466 -4.639 564 HG3 ARG 69 HG1 ARG 69 -6.022 -9.733 -4.065 565 HD2 ARG 69 HD2 ARG 69 -5.893 -9.616 -6.525 566 HD3 ARG 69 HD1 ARG 69 -6.921 -8.363 -5.833 567 HE ARG 69 HE ARG 69 -4.669 -7.013 -6.053 568 HH11 ARG 69 HH11 ARG 69 -6.113 -9.232 -8.349 569 HH12 ARG 69 HH12 ARG 69 -5.452 -8.417 -9.730 570 HH21 ARG 69 HH21 ARG 69 -3.822 -5.928 -7.864 571 HH22 ARG 69 HH22 ARG 69 -4.149 -6.547 -9.459 572 H TYR 70 HN TYR 70 -2.568 -6.166 -3.057 573 HA TYR 70 HA TYR 70 -0.868 -7.836 -4.674 574 HB2 TYR 70 HB2 TYR 70 -1.014 -5.599 -5.429 575 HB3 TYR 70 HB1 TYR 70 -0.719 -4.948 -3.818 576 HD1 TYR 70 HD2 TYR 70 0.885 -6.694 -6.670 577 HD2 TYR 70 HD1 TYR 70 1.453 -4.548 -3.042 578 HE1 TYR 70 HE2 TYR 70 3.292 -6.569 -7.136 579 HE2 TYR 70 HE1 TYR 70 3.867 -4.409 -3.500 580 HH TYR 70 HH TYR 70 5.211 -4.989 -6.463 581 H VAL 71 HN VAL 71 -0.531 -6.173 -1.534 582 HA VAL 71 HA VAL 71 2.118 -7.050 -1.096 583 HB VAL 71 HB VAL 71 1.796 -6.420 1.235 584 HG11 VAL 71 HG11 VAL 71 0.516 -4.103 0.370 585 HG12 VAL 71 HG12 VAL 71 1.357 -4.729 -1.041 586 HG13 VAL 71 HG13 VAL 71 2.247 -4.396 0.446 587 HG21 VAL 71 HG21 VAL 71 -0.293 -7.045 1.912 588 HG22 VAL 71 HG22 VAL 71 -1.070 -6.427 0.453 589 HG23 VAL 71 HG23 VAL 71 -0.515 -5.308 1.698 590 H THR 72 HN THR 72 -1.005 -8.382 -0.106 591 HA THR 72 HA THR 72 -0.027 -10.428 1.531 592 HB THR 72 HB THR 72 -2.435 -9.646 1.300 593 HG1 THR 72 HG1 THR 72 -2.836 -11.391 2.408 594 HG21 THR 72 HG21 THR 72 -2.534 -9.898 -1.152 595 HG22 THR 72 HG22 THR 72 -3.843 -10.730 -0.316 596 HG23 THR 72 HG23 THR 72 -2.477 -11.648 -0.952 597 H SER 73 HN SER 73 -0.262 -10.179 -1.946 598 HA SER 73 HA SER 73 0.251 -12.894 -2.541 599 HB2 SER 73 HB2 SER 73 0.423 -12.238 -4.758 600 HB3 SER 73 HB1 SER 73 -0.501 -10.893 -4.086 601 HG SER 73 HG SER 73 1.287 -9.630 -4.097 602 H CYS 74 HN CYS 74 2.250 -10.261 -1.538 603 HA CYS 74 HA CYS 74 4.728 -11.610 -2.249 604 HB2 CYS 74 HB2 CYS 74 4.597 -9.204 -2.607 605 HB3 CYS 74 HB1 CYS 74 4.225 -8.952 -0.905 606 HG CYS 74 HG CYS 74 7.021 -10.654 -1.123 607 H LEU 75 HN LEU 75 3.158 -10.391 0.718 608 HA LEU 75 HA LEU 75 4.930 -11.341 2.605 609 HB2 LEU 75 HB2 LEU 75 1.981 -11.587 3.065 610 HB3 LEU 75 HB1 LEU 75 3.233 -11.094 4.180 611 HG LEU 75 HG LEU 75 2.350 -9.417 1.853 612 HD11 LEU 75 HD11 LEU 75 1.624 -8.925 4.704 613 HD12 LEU 75 HD12 LEU 75 0.619 -9.951 3.684 614 HD13 LEU 75 HD13 LEU 75 0.900 -8.272 3.236 615 HD21 LEU 75 HD21 LEU 75 4.623 -9.068 2.760 616 HD22 LEU 75 HD22 LEU 75 3.906 -8.724 4.333 617 HD23 LEU 75 HD23 LEU 75 3.562 -7.673 2.958 618 H ARG 76 HN ARG 76 2.545 -13.075 0.741 619 HA ARG 76 HA ARG 76 3.081 -15.515 2.255 620 HB2 ARG 76 HB2 ARG 76 0.856 -14.795 0.358 621 HB3 ARG 76 HB1 ARG 76 1.043 -16.379 1.105 622 HG2 ARG 76 HG2 ARG 76 0.488 -15.608 3.198 623 HG3 ARG 76 HG1 ARG 76 0.976 -13.950 2.829 624 HD2 ARG 76 HD2 ARG 76 -1.438 -14.154 3.027 625 HD3 ARG 76 HD1 ARG 76 -0.955 -13.670 1.406 626 HE ARG 76 HE ARG 76 -1.314 -16.499 1.646 627 HH11 ARG 76 HH11 ARG 76 -2.962 -13.447 1.185 628 HH12 ARG 76 HH12 ARG 76 -4.326 -14.155 0.375 629 HH21 ARG 76 HH21 ARG 76 -3.116 -17.441 0.566 630 HH22 ARG 76 HH22 ARG 76 -4.419 -16.428 0.034 631 H LYS 77 HN LYS 77 4.287 -14.037 -0.367 632 HA LYS 77 HA LYS 77 5.506 -16.422 -1.385 633 HB2 LYS 77 HB2 LYS 77 3.300 -15.146 -2.918 634 HB3 LYS 77 HB1 LYS 77 4.709 -15.690 -3.817 635 HG2 LYS 77 HG2 LYS 77 4.410 -17.935 -3.042 636 HG3 LYS 77 HG1 LYS 77 3.108 -17.430 -1.966 637 HD2 LYS 77 HD2 LYS 77 1.797 -16.727 -3.941 638 HD3 LYS 77 HD1 LYS 77 3.092 -17.323 -4.982 639 HE2 LYS 77 HE2 LYS 77 1.284 -18.951 -4.800 640 HE3 LYS 77 HE1 LYS 77 2.776 -19.574 -4.098 641 HZ1 LYS 77 HZ1 LYS 77 0.816 -20.027 -2.721 642 HZ2 LYS 77 HZ2 LYS 77 0.550 -18.368 -2.548 643 HZ3 LYS 77 HZ3 LYS 77 1.951 -19.071 -1.911 644 H LYS 78 HN LYS 78 7.525 -15.895 -1.937 645 HA LYS 78 HA LYS 78 9.342 -14.788 -2.727 646 HB2 LYS 78 HB2 LYS 78 7.281 -14.247 -4.470 647 HB3 LYS 78 HB1 LYS 78 7.912 -12.650 -4.106 648 HG2 LYS 78 HG2 LYS 78 9.428 -14.982 -5.245 649 HG3 LYS 78 HG1 LYS 78 8.965 -13.502 -6.081 650 HD2 LYS 78 HD2 LYS 78 10.367 -12.266 -4.371 651 HD3 LYS 78 HD1 LYS 78 10.991 -13.844 -3.885 652 HE2 LYS 78 HE2 LYS 78 11.224 -12.507 -6.568 653 HE3 LYS 78 HE1 LYS 78 12.523 -12.933 -5.459 654 HZ1 LYS 78 HZ1 LYS 78 12.367 -14.482 -7.310 655 HZ2 LYS 78 HZ2 LYS 78 10.778 -14.869 -6.888 656 HZ3 LYS 78 HZ3 LYS 78 12.051 -15.264 -5.846 657 H ARG 79 HN ARG 79 9.945 -14.033 -0.634 658 HA ARG 79 HA ARG 79 9.434 -11.150 -0.266 659 HB2 ARG 79 HB2 ARG 79 10.223 -12.948 2.025 660 HB3 ARG 79 HB1 ARG 79 9.563 -11.326 2.091 661 HG2 ARG 79 HG2 ARG 79 7.794 -12.628 2.777 662 HG3 ARG 79 HG1 ARG 79 7.444 -12.385 1.065 663 HD2 ARG 79 HD2 ARG 79 8.183 -14.554 0.507 664 HD3 ARG 79 HD1 ARG 79 8.948 -14.782 2.078 665 HE ARG 79 HE ARG 79 6.285 -14.410 2.627 666 HH11 ARG 79 HH11 ARG 79 8.121 -16.623 0.634 667 HH12 ARG 79 HH12 ARG 79 7.031 -17.952 0.880 668 HH21 ARG 79 HH21 ARG 79 4.877 -16.173 2.998 669 HH22 ARG 79 HH22 ARG 79 5.193 -17.698 2.229 670 H LYS 80 HN LYS 80 11.482 -12.317 -1.859 671 HA LYS 80 HA LYS 80 13.784 -11.116 -0.586 672 HB2 LYS 80 HB2 LYS 80 15.245 -13.083 -1.040 673 HB3 LYS 80 HB1 LYS 80 14.069 -13.321 0.239 674 HG2 LYS 80 HG2 LYS 80 12.659 -14.603 -1.299 675 HG3 LYS 80 HG1 LYS 80 13.850 -14.364 -2.581 676 HD2 LYS 80 HD2 LYS 80 15.531 -15.528 -1.222 677 HD3 LYS 80 HD1 LYS 80 14.329 -15.777 0.043 678 HE2 LYS 80 HE2 LYS 80 14.525 -17.794 -1.234 679 HE3 LYS 80 HE1 LYS 80 12.962 -17.060 -1.577 680 HZ1 LYS 80 HZ1 LYS 80 14.109 -17.896 -3.569 681 HZ2 LYS 80 HZ2 LYS 80 15.358 -16.785 -3.308 682 HZ3 LYS 80 HZ3 LYS 80 13.796 -16.236 -3.651 683 HA PRO 81 HA PRO 81 13.932 -10.221 -5.099 684 HB2 PRO 81 HB2 PRO 81 14.840 -7.687 -4.820 685 HB3 PRO 81 HB1 PRO 81 13.121 -8.091 -4.752 686 HG2 PRO 81 HG2 PRO 81 15.041 -7.610 -2.507 687 HG3 PRO 81 HG1 PRO 81 13.378 -7.027 -2.698 688 HD2 PRO 81 HD2 PRO 81 14.008 -9.142 -1.141 689 HD3 PRO 81 HD1 PRO 81 12.463 -9.022 -2.011 690 H GLN 82 HN GLN 82 15.642 -11.776 -5.094 691 HA GLN 82 HA GLN 82 18.317 -10.590 -4.783 692 HB2 GLN 82 HB2 GLN 82 17.465 -13.348 -3.882 693 HB3 GLN 82 HB1 GLN 82 19.125 -12.778 -3.916 694 HG2 GLN 82 HG2 GLN 82 18.604 -11.085 -2.270 695 HG3 GLN 82 HG1 GLN 82 16.912 -11.577 -2.270 696 HE21 GLN 82 HE21 GLN 82 17.583 -14.422 -2.466 697 HE22 GLN 82 HE22 GLN 82 18.147 -14.879 -0.898 698 H ALA 83 HN ALA 83 17.493 -13.898 -5.601 699 HA ALA 83 HA ALA 83 18.141 -13.470 -8.406 700 HB1 ALA 83 HB1 ALA 83 19.848 -15.227 -8.397 701 HB2 ALA 83 HB2 ALA 83 19.693 -15.370 -6.646 702 HB3 ALA 83 HB3 ALA 83 20.310 -13.879 -7.359 703 H1 GLU 201 HT1 GLU 201 -5.933 11.141 10.786 704 H2 GLU 201 HT2 GLU 201 -5.292 10.159 9.570 705 H3 GLU 201 HT3 GLU 201 -4.295 10.725 10.812 706 HA GLU 201 HA GLU 201 -5.527 9.458 12.433 707 HB2 GLU 201 HB2 GLU 201 -7.671 9.497 11.162 708 HB3 GLU 201 HB1 GLU 201 -6.987 8.338 10.033 709 HG2 GLU 201 HG2 GLU 201 -8.422 7.233 11.635 710 HG3 GLU 201 HG1 GLU 201 -6.749 6.716 11.838 711 H ILE 202 HN ILE 202 -5.442 7.570 9.424 712 HA ILE 202 HA ILE 202 -3.093 6.152 10.485 713 HB ILE 202 HB ILE 202 -5.058 5.273 8.358 714 HG12 ILE 202 HG12 ILE 202 -5.978 5.210 10.644 715 HG13 ILE 202 HG11 ILE 202 -5.769 3.594 9.982 716 HG21 ILE 202 HG21 ILE 202 -2.813 4.433 7.904 717 HG22 ILE 202 HG22 ILE 202 -3.880 3.125 8.414 718 HG23 ILE 202 HG23 ILE 202 -2.707 3.799 9.545 719 HD11 ILE 202 HD11 ILE 202 -3.697 3.353 11.269 720 HD12 ILE 202 HD12 ILE 202 -5.096 3.655 12.298 721 HD13 ILE 202 HD13 ILE 202 -3.955 4.955 11.959 722 H LYS 203 HN LYS 203 -1.285 7.005 9.735 723 HA LYS 203 HA LYS 203 -1.185 7.851 6.913 724 HB2 LYS 203 HB2 LYS 203 0.538 8.840 9.194 725 HB3 LYS 203 HB1 LYS 203 0.540 9.443 7.543 726 HG2 LYS 203 HG2 LYS 203 -1.815 10.178 7.874 727 HG3 LYS 203 HG1 LYS 203 -1.678 9.697 9.564 728 HD2 LYS 203 HD2 LYS 203 0.133 11.700 8.223 729 HD3 LYS 203 HD1 LYS 203 -1.301 12.130 9.156 730 HE2 LYS 203 HE2 LYS 203 -0.360 11.147 11.142 731 HE3 LYS 203 HE1 LYS 203 1.018 10.537 10.235 732 HZ1 LYS 203 HZ1 LYS 203 1.565 12.545 11.462 733 HZ2 LYS 203 HZ2 LYS 203 0.361 13.403 10.640 734 HZ3 LYS 203 HZ3 LYS 203 1.697 12.804 9.798 735 H LEU 204 HN LEU 204 0.485 7.104 5.649 736 HA LEU 204 HA LEU 204 2.418 5.306 6.953 737 HB2 LEU 204 HB2 LEU 204 0.444 4.417 5.303 738 HB3 LEU 204 HB1 LEU 204 1.726 4.719 4.148 739 HG LEU 204 HG LEU 204 1.703 2.764 6.433 740 HD11 LEU 204 HD11 LEU 204 2.184 2.485 3.475 741 HD12 LEU 204 HD12 LEU 204 0.745 1.986 4.364 742 HD13 LEU 204 HD13 LEU 204 2.283 1.177 4.654 743 HD21 LEU 204 HD21 LEU 204 4.127 3.408 4.767 744 HD22 LEU 204 HD22 LEU 204 4.011 2.289 6.122 745 HD23 LEU 204 HD23 LEU 204 3.872 4.024 6.397 746 H LYS 205 HN LYS 205 4.145 6.658 6.934 747 HA LYS 205 HA LYS 205 4.973 7.943 4.463 748 HB2 LYS 205 HB2 LYS 205 6.155 7.817 7.239 749 HB3 LYS 205 HB1 LYS 205 7.006 8.548 5.889 750 HG2 LYS 205 HG2 LYS 205 4.295 9.428 6.846 751 HG3 LYS 205 HG1 LYS 205 5.820 10.159 7.353 752 HD2 LYS 205 HD2 LYS 205 6.281 10.523 4.877 753 HD3 LYS 205 HD1 LYS 205 4.585 10.112 4.613 754 HE2 LYS 205 HE2 LYS 205 5.663 12.368 6.288 755 HE3 LYS 205 HE1 LYS 205 4.833 12.507 4.743 756 HZ1 LYS 205 HZ1 LYS 205 2.845 11.542 5.805 757 HZ2 LYS 205 HZ2 LYS 205 3.319 13.000 6.528 758 HZ3 LYS 205 HZ3 LYS 205 3.660 11.531 7.289 759 H ILE 206 HN ILE 206 5.145 5.845 3.269 760 HA ILE 206 HA ILE 206 7.052 3.924 4.158 761 HB ILE 206 HB ILE 206 6.575 4.128 1.222 762 HG12 ILE 206 HG12 ILE 206 4.524 2.858 3.019 763 HG13 ILE 206 HG11 ILE 206 4.284 4.459 2.314 764 HG21 ILE 206 HG21 ILE 206 6.130 1.568 2.363 765 HG22 ILE 206 HG22 ILE 206 7.552 2.286 3.140 766 HG23 ILE 206 HG23 ILE 206 7.493 2.130 1.386 767 HD11 ILE 206 HD11 ILE 206 4.941 2.930 0.135 768 HD12 ILE 206 HD12 ILE 206 3.299 3.304 0.659 769 HD13 ILE 206 HD13 ILE 206 4.051 1.790 1.145 770 H THR 207 HN THR 207 9.123 4.479 4.416 771 HA THR 207 HA THR 207 10.395 6.256 2.494 772 HB THR 207 HB THR 207 12.410 5.738 4.122 773 HG1 THR 207 HG1 THR 207 10.727 5.601 6.216 774 HG21 THR 207 HG21 THR 207 11.619 7.587 5.580 775 HG22 THR 207 HG22 THR 207 10.030 7.457 4.826 776 HG23 THR 207 HG23 THR 207 11.429 7.928 3.862 777 H LYS 208 HN LYS 208 11.507 5.532 0.814 778 HA LYS 208 HA LYS 208 13.106 3.286 0.650 779 HB2 LYS 208 HB2 LYS 208 11.840 1.568 -0.300 780 HB3 LYS 208 HB1 LYS 208 10.817 2.153 0.999 781 HG2 LYS 208 HG2 LYS 208 10.487 3.221 -1.760 782 HG3 LYS 208 HG1 LYS 208 9.808 1.656 -1.343 783 HD2 LYS 208 HD2 LYS 208 8.044 2.674 -0.455 784 HD3 LYS 208 HD1 LYS 208 9.091 3.493 0.698 785 HE2 LYS 208 HE2 LYS 208 8.714 4.515 -2.093 786 HE3 LYS 208 HE1 LYS 208 7.599 4.932 -0.794 787 HZ1 LYS 208 HZ1 LYS 208 9.370 5.935 0.426 788 HZ2 LYS 208 HZ2 LYS 208 9.388 6.570 -1.148 789 HZ3 LYS 208 HZ3 LYS 208 10.526 5.404 -0.699 790 H THR 209 HN THR 209 13.241 2.507 -1.784 791 HA THR 209 HA THR 209 14.136 3.163 -3.760 792 HB THR 209 HB THR 209 11.911 2.612 -4.471 793 HG1 THR 209 HG1 THR 209 12.917 4.981 -5.690 794 HG21 THR 209 HG21 THR 209 10.275 3.804 -3.416 795 HG22 THR 209 HG22 THR 209 10.374 4.748 -4.901 796 HG23 THR 209 HG23 THR 209 11.199 5.305 -3.446 797 H ILE 210 HN ILE 210 15.528 4.641 -2.481 798 HA ILE 210 HA ILE 210 15.153 7.411 -2.389 799 HB ILE 210 HB ILE 210 17.756 5.886 -2.610 800 HG12 ILE 210 HG12 ILE 210 16.256 6.849 -0.163 801 HG13 ILE 210 HG11 ILE 210 16.321 5.178 -0.713 802 HG21 ILE 210 HG21 ILE 210 18.051 8.247 -3.107 803 HG22 ILE 210 HG22 ILE 210 18.758 7.855 -1.540 804 HG23 ILE 210 HG23 ILE 210 17.204 8.682 -1.623 805 HD11 ILE 210 HD11 ILE 210 18.746 5.175 -0.359 806 HD12 ILE 210 HD12 ILE 210 17.853 5.538 1.119 807 HD13 ILE 210 HD13 ILE 210 18.650 6.836 0.228 808 H GLN 211 HN GLN 211 15.145 8.904 -3.903 809 HA GLN 211 HA GLN 211 16.519 8.367 -6.457 810 HB2 GLN 211 HB2 GLN 211 14.063 8.114 -6.707 811 HB3 GLN 211 HB1 GLN 211 13.852 9.757 -6.121 812 HG2 GLN 211 HG2 GLN 211 15.054 10.627 -8.032 813 HG3 GLN 211 HG1 GLN 211 15.365 8.991 -8.604 814 HE21 GLN 211 HE21 GLN 211 12.339 9.982 -7.180 815 HE22 GLN 211 HE22 GLN 211 11.400 9.874 -8.629 816 H ASN 212 HN ASN 212 14.994 10.917 -4.496 817 HA ASN 212 HA ASN 212 17.323 12.620 -5.032 818 HB2 ASN 212 HB2 ASN 212 15.495 13.298 -6.574 819 HB3 ASN 212 HB1 ASN 212 14.450 13.568 -5.186 820 HD21 ASN 212 HD21 ASN 212 14.796 15.358 -3.875 821 HD22 ASN 212 HD22 ASN 212 15.801 16.678 -4.366 Start of MODEL 12 1 H1 SER 1 HT1 SER 1 -17.492 -7.310 -13.041 2 H2 SER 1 HT2 SER 1 -16.066 -7.894 -12.351 3 H3 SER 1 HT3 SER 1 -16.606 -8.514 -13.828 4 HA SER 1 HA SER 1 -14.763 -7.003 -14.128 5 HB2 SER 1 HB2 SER 1 -17.368 -5.874 -15.172 6 HB3 SER 1 HB1 SER 1 -15.771 -5.672 -15.888 7 HG SER 1 HG SER 1 -15.725 -7.908 -16.293 8 H GLU 2 HN GLU 2 -17.490 -5.623 -12.361 9 HA GLU 2 HA GLU 2 -16.025 -3.098 -12.062 10 HB2 GLU 2 HB2 GLU 2 -18.851 -3.785 -11.226 11 HB3 GLU 2 HB1 GLU 2 -18.104 -2.199 -11.130 12 HG2 GLU 2 HG2 GLU 2 -17.905 -2.130 -13.555 13 HG3 GLU 2 HG1 GLU 2 -18.637 -3.730 -13.663 14 H GLU 3 HN GLU 3 -16.755 -5.970 -10.367 15 HA GLU 3 HA GLU 3 -17.130 -5.100 -7.759 16 HB2 GLU 3 HB2 GLU 3 -15.720 -7.650 -8.538 17 HB3 GLU 3 HB1 GLU 3 -16.580 -7.333 -7.041 18 HG2 GLU 3 HG2 GLU 3 -18.103 -8.596 -8.190 19 HG3 GLU 3 HG1 GLU 3 -18.622 -6.964 -8.606 20 H GLU 4 HN GLU 4 -14.154 -5.299 -9.552 21 HA GLU 4 HA GLU 4 -12.496 -5.379 -7.208 22 HB2 GLU 4 HB2 GLU 4 -10.596 -4.993 -8.765 23 HB3 GLU 4 HB1 GLU 4 -11.612 -6.350 -9.232 24 HG2 GLU 4 HG2 GLU 4 -12.700 -4.973 -10.922 25 HG3 GLU 4 HG1 GLU 4 -11.700 -3.599 -10.448 26 H ASP 5 HN ASP 5 -13.658 -2.799 -9.355 27 HA ASP 5 HA ASP 5 -12.212 -0.853 -7.745 28 HB2 ASP 5 HB2 ASP 5 -12.325 -0.499 -10.194 29 HB3 ASP 5 HB1 ASP 5 -14.073 -0.331 -10.082 30 H LYS 6 HN LYS 6 -15.241 -2.372 -7.856 31 HA LYS 6 HA LYS 6 -16.542 -0.211 -6.353 32 HB2 LYS 6 HB2 LYS 6 -17.548 -1.137 -8.499 33 HB3 LYS 6 HB1 LYS 6 -17.877 -2.613 -7.602 34 HG2 LYS 6 HG2 LYS 6 -19.845 -1.190 -7.711 35 HG3 LYS 6 HG1 LYS 6 -19.287 -1.336 -6.043 36 HD2 LYS 6 HD2 LYS 6 -18.396 0.833 -6.036 37 HD3 LYS 6 HD1 LYS 6 -18.454 0.959 -7.794 38 HE2 LYS 6 HE2 LYS 6 -20.860 0.784 -5.986 39 HE3 LYS 6 HE1 LYS 6 -20.215 2.274 -6.667 40 HZ1 LYS 6 HZ1 LYS 6 -21.317 -0.020 -8.199 41 HZ2 LYS 6 HZ2 LYS 6 -20.629 1.360 -8.890 42 HZ3 LYS 6 HZ3 LYS 6 -22.053 1.487 -7.985 43 H CYS 7 HN CYS 7 -14.606 -1.922 -5.211 44 HA CYS 7 HA CYS 7 -15.923 -3.967 -3.674 45 HB2 CYS 7 HB2 CYS 7 -13.472 -3.950 -4.463 46 HB3 CYS 7 HB1 CYS 7 -13.190 -2.827 -3.134 47 HG CYS 7 HG CYS 7 -14.531 -5.929 -2.642 48 H LYS 8 HN LYS 8 -16.073 -3.970 -1.366 49 HA LYS 8 HA LYS 8 -16.938 -1.465 -0.288 50 HB2 LYS 8 HB2 LYS 8 -16.792 -4.273 0.735 51 HB3 LYS 8 HB1 LYS 8 -17.036 -2.955 1.867 52 HG2 LYS 8 HG2 LYS 8 -19.157 -3.877 1.287 53 HG3 LYS 8 HG1 LYS 8 -19.022 -2.265 0.588 54 HD2 LYS 8 HD2 LYS 8 -18.427 -3.285 -1.578 55 HD3 LYS 8 HD1 LYS 8 -18.641 -4.883 -0.860 56 HE2 LYS 8 HE2 LYS 8 -20.624 -4.239 -2.104 57 HE3 LYS 8 HE1 LYS 8 -20.983 -4.349 -0.381 58 HZ1 LYS 8 HZ1 LYS 8 -20.436 -1.832 -1.857 59 HZ2 LYS 8 HZ2 LYS 8 -20.836 -1.954 -0.220 60 HZ3 LYS 8 HZ3 LYS 8 -21.968 -2.382 -1.401 61 HA PRO 9 HA PRO 9 -13.090 -0.194 1.523 62 HB2 PRO 9 HB2 PRO 9 -14.521 1.150 3.656 63 HB3 PRO 9 HB1 PRO 9 -13.605 1.845 2.317 64 HG2 PRO 9 HG2 PRO 9 -16.331 1.987 2.550 65 HG3 PRO 9 HG1 PRO 9 -15.456 2.091 1.015 66 HD2 PRO 9 HD2 PRO 9 -16.986 -0.180 2.180 67 HD3 PRO 9 HD1 PRO 9 -16.748 0.277 0.483 68 H MET 10 HN MET 10 -11.765 -1.179 2.899 69 HA MET 10 HA MET 10 -12.778 -2.915 4.954 70 HB2 MET 10 HB2 MET 10 -10.423 -3.427 5.386 71 HB3 MET 10 HB1 MET 10 -10.780 -3.531 3.672 72 HG2 MET 10 HG2 MET 10 -9.807 -1.316 3.341 73 HG3 MET 10 HG1 MET 10 -9.407 -1.255 5.054 74 HE1 MET 10 HE1 MET 10 -8.899 -3.177 1.712 75 HE2 MET 10 HE2 MET 10 -9.180 -4.526 2.810 76 HE3 MET 10 HE3 MET 10 -7.585 -4.289 2.097 77 H SER 11 HN SER 11 -12.162 -2.716 7.205 78 HA SER 11 HA SER 11 -12.833 -0.053 8.055 79 HB2 SER 11 HB2 SER 11 -13.023 -1.139 10.308 80 HB3 SER 11 HB1 SER 11 -14.026 -1.869 9.057 81 HG SER 11 HG SER 11 -12.358 -3.473 8.810 82 H TYR 12 HN TYR 12 -11.824 0.572 10.326 83 HA TYR 12 HA TYR 12 -9.281 1.615 9.872 84 HB2 TYR 12 HB2 TYR 12 -10.904 2.426 11.562 85 HB3 TYR 12 HB1 TYR 12 -10.578 1.004 12.546 86 HD1 TYR 12 HD1 TYR 12 -8.080 0.705 13.283 87 HD2 TYR 12 HD2 TYR 12 -9.745 4.382 11.968 88 HE1 TYR 12 HE1 TYR 12 -6.319 1.923 14.491 89 HE2 TYR 12 HE2 TYR 12 -7.985 5.613 13.161 90 HH TYR 12 HH TYR 12 -5.219 4.066 14.463 91 H GLU 13 HN GLU 13 -10.185 -1.353 11.572 92 HA GLU 13 HA GLU 13 -7.652 -2.054 12.551 93 HB2 GLU 13 HB2 GLU 13 -9.823 -3.111 13.213 94 HB3 GLU 13 HB1 GLU 13 -9.851 -3.941 11.659 95 HG2 GLU 13 HG2 GLU 13 -7.676 -4.993 12.277 96 HG3 GLU 13 HG1 GLU 13 -7.869 -4.299 13.887 97 H GLU 14 HN GLU 14 -9.149 -2.496 9.434 98 HA GLU 14 HA GLU 14 -7.138 -4.402 8.558 99 HB2 GLU 14 HB2 GLU 14 -9.498 -3.185 7.115 100 HB3 GLU 14 HB1 GLU 14 -8.473 -4.465 6.478 101 HG2 GLU 14 HG2 GLU 14 -9.223 -6.010 8.109 102 HG3 GLU 14 HG1 GLU 14 -10.004 -4.737 9.049 103 H LYS 15 HN LYS 15 -8.169 -1.090 7.848 104 HA LYS 15 HA LYS 15 -6.285 -0.467 5.888 105 HB2 LYS 15 HB2 LYS 15 -7.628 1.218 7.995 106 HB3 LYS 15 HB1 LYS 15 -6.559 1.897 6.779 107 HG2 LYS 15 HG2 LYS 15 -8.017 1.396 5.033 108 HG3 LYS 15 HG1 LYS 15 -8.917 0.237 6.016 109 HD2 LYS 15 HD2 LYS 15 -10.136 1.838 7.056 110 HD3 LYS 15 HD1 LYS 15 -8.843 3.034 6.985 111 HE2 LYS 15 HE2 LYS 15 -9.271 3.407 4.642 112 HE3 LYS 15 HE1 LYS 15 -10.489 2.130 4.621 113 HZ1 LYS 15 HZ1 LYS 15 -10.656 4.566 6.319 114 HZ2 LYS 15 HZ2 LYS 15 -11.871 3.415 6.060 115 HZ3 LYS 15 HZ3 LYS 15 -11.389 4.430 4.798 116 H ARG 16 HN ARG 16 -6.094 -0.241 9.419 117 HA ARG 16 HA ARG 16 -3.476 0.757 9.598 118 HB2 ARG 16 HB2 ARG 16 -5.074 0.635 11.493 119 HB3 ARG 16 HB1 ARG 16 -4.883 -1.116 11.515 120 HG2 ARG 16 HG2 ARG 16 -2.313 -0.404 11.729 121 HG3 ARG 16 HG1 ARG 16 -3.068 1.007 12.469 122 HD2 ARG 16 HD2 ARG 16 -2.578 -0.624 14.174 123 HD3 ARG 16 HD1 ARG 16 -4.324 -0.487 13.971 124 HE ARG 16 HE ARG 16 -2.766 -2.669 12.735 125 HH11 ARG 16 HH11 ARG 16 -5.483 -1.539 14.622 126 HH12 ARG 16 HH12 ARG 16 -6.204 -3.106 14.761 127 HH21 ARG 16 HH21 ARG 16 -3.722 -4.749 12.896 128 HH22 ARG 16 HH22 ARG 16 -5.202 -4.932 13.788 129 H GLN 17 HN GLN 17 -4.709 -2.553 9.411 130 HA GLN 17 HA GLN 17 -2.208 -3.803 9.773 131 HB2 GLN 17 HB2 GLN 17 -4.568 -4.780 10.091 132 HB3 GLN 17 HB1 GLN 17 -4.549 -5.040 8.352 133 HG2 GLN 17 HG2 GLN 17 -3.909 -7.057 9.500 134 HG3 GLN 17 HG1 GLN 17 -2.541 -6.416 8.591 135 HE21 GLN 17 HE21 GLN 17 -1.043 -7.495 9.875 136 HE22 GLN 17 HE22 GLN 17 -0.694 -7.000 11.496 137 H LEU 18 HN LEU 18 -3.856 -2.501 7.051 138 HA LEU 18 HA LEU 18 -2.272 -3.720 5.012 139 HB2 LEU 18 HB2 LEU 18 -4.589 -2.307 5.044 140 HB3 LEU 18 HB1 LEU 18 -3.472 -1.058 4.542 141 HG LEU 18 HG LEU 18 -3.762 -3.693 3.105 142 HD11 LEU 18 HD11 LEU 18 -5.047 -1.046 2.496 143 HD12 LEU 18 HD12 LEU 18 -5.873 -2.508 3.026 144 HD13 LEU 18 HD13 LEU 18 -5.077 -2.461 1.453 145 HD21 LEU 18 HD21 LEU 18 -1.709 -2.780 2.501 146 HD22 LEU 18 HD22 LEU 18 -2.324 -1.134 2.519 147 HD23 LEU 18 HD23 LEU 18 -2.801 -2.241 1.234 148 H SER 19 HN SER 19 -2.164 -0.670 6.783 149 HA SER 19 HA SER 19 0.160 0.377 5.629 150 HB2 SER 19 HB2 SER 19 -1.287 1.630 7.203 151 HB3 SER 19 HB1 SER 19 -0.772 0.573 8.513 152 HG SER 19 HG SER 19 1.454 1.382 7.739 153 H LEU 20 HN LEU 20 -0.352 -2.147 7.951 154 HA LEU 20 HA LEU 20 2.411 -2.390 8.681 155 HB2 LEU 20 HB2 LEU 20 -0.030 -4.031 9.285 156 HB3 LEU 20 HB1 LEU 20 1.561 -4.447 9.876 157 HG LEU 20 HG LEU 20 0.181 -1.839 10.483 158 HD11 LEU 20 HD11 LEU 20 -0.839 -4.024 11.356 159 HD12 LEU 20 HD12 LEU 20 -0.529 -2.725 12.504 160 HD13 LEU 20 HD13 LEU 20 0.573 -4.099 12.400 161 HD21 LEU 20 HD21 LEU 20 2.699 -1.939 10.553 162 HD22 LEU 20 HD22 LEU 20 2.539 -3.125 11.845 163 HD23 LEU 20 HD23 LEU 20 1.914 -1.491 12.063 164 H ASP 21 HN ASP 21 0.262 -3.886 6.336 165 HA ASP 21 HA ASP 21 2.041 -6.090 5.899 166 HB2 ASP 21 HB2 ASP 21 0.525 -6.761 4.093 167 HB3 ASP 21 HB1 ASP 21 -0.311 -6.481 5.607 168 H ILE 22 HN ILE 22 1.480 -2.987 4.344 169 HA ILE 22 HA ILE 22 3.273 -3.478 2.178 170 HB ILE 22 HB ILE 22 2.319 -0.889 3.408 171 HG12 ILE 22 HG12 ILE 22 1.615 -2.067 0.719 172 HG13 ILE 22 HG11 ILE 22 0.707 -2.481 2.179 173 HG21 ILE 22 HG21 ILE 22 4.337 -0.278 2.413 174 HG22 ILE 22 HG22 ILE 22 3.102 0.102 1.211 175 HG23 ILE 22 HG23 ILE 22 4.082 -1.352 1.040 176 HD11 ILE 22 HD11 ILE 22 0.206 -0.133 2.480 177 HD12 ILE 22 HD12 ILE 22 -0.397 -0.736 0.947 178 HD13 ILE 22 HD13 ILE 22 1.060 0.260 0.997 179 H ASN 23 HN ASN 23 3.632 -2.251 5.440 180 HA ASN 23 HA ASN 23 6.278 -1.354 5.294 181 HB2 ASN 23 HB2 ASN 23 4.952 -0.777 7.185 182 HB3 ASN 23 HB1 ASN 23 4.632 -2.463 7.561 183 HD21 ASN 23 HD21 ASN 23 6.991 0.101 7.642 184 HD22 ASN 23 HD22 ASN 23 8.056 -0.639 8.782 185 H LYS 24 HN LYS 24 4.969 -4.546 5.291 186 HA LYS 24 HA LYS 24 7.356 -5.888 6.172 187 HB2 LYS 24 HB2 LYS 24 4.782 -6.817 4.937 188 HB3 LYS 24 HB1 LYS 24 6.160 -7.900 5.130 189 HG2 LYS 24 HG2 LYS 24 5.948 -7.999 7.374 190 HG3 LYS 24 HG1 LYS 24 5.317 -6.350 7.510 191 HD2 LYS 24 HD2 LYS 24 3.145 -7.011 6.849 192 HD3 LYS 24 HD1 LYS 24 3.675 -8.575 6.278 193 HE2 LYS 24 HE2 LYS 24 3.994 -9.387 8.500 194 HE3 LYS 24 HE1 LYS 24 3.781 -7.775 9.207 195 HZ1 LYS 24 HZ1 LYS 24 1.820 -9.173 9.441 196 HZ2 LYS 24 HZ2 LYS 24 1.691 -9.319 7.762 197 HZ3 LYS 24 HZ3 LYS 24 1.490 -7.811 8.498 198 H LEU 25 HN LEU 25 5.997 -4.925 3.088 199 HA LEU 25 HA LEU 25 7.451 -6.630 1.403 200 HB2 LEU 25 HB2 LEU 25 6.510 -3.841 0.829 201 HB3 LEU 25 HB1 LEU 25 6.978 -5.012 -0.368 202 HG LEU 25 HG LEU 25 4.541 -5.008 1.372 203 HD11 LEU 25 HD11 LEU 25 5.042 -5.071 -1.584 204 HD12 LEU 25 HD12 LEU 25 4.372 -3.735 -0.651 205 HD13 LEU 25 HD13 LEU 25 3.454 -5.229 -0.842 206 HD21 LEU 25 HD21 LEU 25 5.716 -7.243 -0.216 207 HD22 LEU 25 HD22 LEU 25 4.028 -7.198 0.279 208 HD23 LEU 25 HD23 LEU 25 5.310 -7.246 1.494 209 HA PRO 26 HA PRO 26 11.640 -4.968 1.688 210 HB2 PRO 26 HB2 PRO 26 11.827 -6.468 -0.877 211 HB3 PRO 26 HB1 PRO 26 12.868 -6.543 0.553 212 HG2 PRO 26 HG2 PRO 26 11.152 -8.507 0.014 213 HG3 PRO 26 HG1 PRO 26 11.434 -7.973 1.681 214 HD2 PRO 26 HD2 PRO 26 9.125 -7.401 -0.128 215 HD3 PRO 26 HD1 PRO 26 9.142 -7.723 1.617 216 H GLY 27 HN GLY 27 12.836 -3.424 0.496 217 HA2 GLY 27 HA2 GLY 27 11.481 -1.313 -0.491 218 HA3 GLY 27 HA1 GLY 27 13.145 -1.639 -0.921 219 H GLU 28 HN GLU 28 12.803 -3.885 -2.566 220 HA GLU 28 HA GLU 28 12.189 -2.699 -5.027 221 HB2 GLU 28 HB2 GLU 28 13.664 -4.669 -4.736 222 HB3 GLU 28 HB1 GLU 28 12.256 -5.643 -4.345 223 HG2 GLU 28 HG2 GLU 28 12.915 -6.032 -6.622 224 HG3 GLU 28 HG1 GLU 28 11.354 -5.211 -6.584 225 H LYS 29 HN LYS 29 10.373 -5.181 -3.244 226 HA LYS 29 HA LYS 29 8.088 -5.173 -4.893 227 HB2 LYS 29 HB2 LYS 29 8.507 -5.963 -2.007 228 HB3 LYS 29 HB1 LYS 29 7.014 -6.266 -2.891 229 HG2 LYS 29 HG2 LYS 29 9.703 -7.308 -3.735 230 HG3 LYS 29 HG1 LYS 29 8.574 -8.206 -2.723 231 HD2 LYS 29 HD2 LYS 29 6.881 -7.993 -4.537 232 HD3 LYS 29 HD1 LYS 29 8.125 -7.281 -5.560 233 HE2 LYS 29 HE2 LYS 29 7.873 -9.652 -6.036 234 HE3 LYS 29 HE1 LYS 29 9.464 -9.323 -5.357 235 HZ1 LYS 29 HZ1 LYS 29 8.570 -10.043 -3.181 236 HZ2 LYS 29 HZ2 LYS 29 8.576 -11.272 -4.338 237 HZ3 LYS 29 HZ3 LYS 29 7.130 -10.490 -3.945 238 H LEU 30 HN LEU 30 9.020 -3.400 -2.059 239 HA LEU 30 HA LEU 30 6.586 -2.194 -1.361 240 HB2 LEU 30 HB2 LEU 30 8.565 -2.283 0.074 241 HB3 LEU 30 HB1 LEU 30 9.438 -1.243 -1.032 242 HG LEU 30 HG LEU 30 8.187 0.645 -0.417 243 HD11 LEU 30 HD11 LEU 30 6.343 -0.781 1.389 244 HD12 LEU 30 HD12 LEU 30 6.020 -0.884 -0.330 245 HD13 LEU 30 HD13 LEU 30 6.100 0.683 0.455 246 HD21 LEU 30 HD21 LEU 30 8.422 0.689 2.035 247 HD22 LEU 30 HD22 LEU 30 9.831 -0.004 1.233 248 HD23 LEU 30 HD23 LEU 30 8.659 -1.058 2.023 249 H GLY 31 HN GLY 31 9.064 -1.217 -3.704 250 HA2 GLY 31 HA2 GLY 31 8.166 1.392 -4.186 251 HA3 GLY 31 HA1 GLY 31 9.028 0.404 -5.344 252 H ARG 32 HN ARG 32 6.716 -1.609 -5.100 253 HA ARG 32 HA ARG 32 5.199 -0.590 -7.303 254 HB2 ARG 32 HB2 ARG 32 5.482 -2.967 -7.200 255 HB3 ARG 32 HB1 ARG 32 4.862 -3.023 -5.559 256 HG2 ARG 32 HG2 ARG 32 3.149 -3.898 -6.965 257 HG3 ARG 32 HG1 ARG 32 2.646 -2.294 -6.470 258 HD2 ARG 32 HD2 ARG 32 3.526 -1.417 -8.646 259 HD3 ARG 32 HD1 ARG 32 3.749 -3.093 -9.151 260 HE ARG 32 HE ARG 32 1.220 -3.207 -8.504 261 HH11 ARG 32 HH11 ARG 32 2.885 -0.639 -10.210 262 HH12 ARG 32 HH12 ARG 32 1.463 -0.118 -11.060 263 HH21 ARG 32 HH21 ARG 32 -0.640 -2.518 -9.617 264 HH22 ARG 32 HH22 ARG 32 -0.537 -1.178 -10.716 265 H VAL 33 HN VAL 33 4.414 -1.159 -3.872 266 HA VAL 33 HA VAL 33 1.709 -0.326 -4.081 267 HB VAL 33 HB VAL 33 2.469 0.235 -1.445 268 HG11 VAL 33 HG11 VAL 33 1.113 -2.027 -2.874 269 HG12 VAL 33 HG12 VAL 33 0.430 -0.804 -1.804 270 HG13 VAL 33 HG13 VAL 33 1.395 -2.115 -1.139 271 HG21 VAL 33 HG21 VAL 33 3.873 -2.243 -2.451 272 HG22 VAL 33 HG22 VAL 33 3.667 -1.790 -0.764 273 HG23 VAL 33 HG23 VAL 33 4.642 -0.785 -1.834 274 H VAL 34 HN VAL 34 4.598 1.442 -2.955 275 HA VAL 34 HA VAL 34 3.398 3.892 -2.415 276 HB VAL 34 HB VAL 34 5.557 4.341 -1.968 277 HG11 VAL 34 HG11 VAL 34 6.049 1.995 -2.231 278 HG12 VAL 34 HG12 VAL 34 7.404 2.999 -2.752 279 HG13 VAL 34 HG13 VAL 34 6.352 2.243 -3.949 280 HG21 VAL 34 HG21 VAL 34 5.375 5.797 -3.951 281 HG22 VAL 34 HG22 VAL 34 5.999 4.494 -4.951 282 HG23 VAL 34 HG23 VAL 34 7.016 5.215 -3.705 283 H HIS 35 HN HIS 35 4.408 2.521 -5.486 284 HA HIS 35 HA HIS 35 3.749 4.761 -7.098 285 HB2 HIS 35 HB2 HIS 35 5.313 2.976 -7.792 286 HB3 HIS 35 HB1 HIS 35 3.960 1.857 -7.885 287 HD1 HIS 35 HD1 HIS 35 5.400 4.884 -9.611 288 HD2 HIS 35 HD2 HIS 35 2.484 1.987 -10.230 289 HE1 HIS 35 HE1 HIS 35 4.648 5.178 -11.990 290 HE2 HIS 35 HE2 HIS 35 2.795 3.500 -12.302 291 H ILE 36 HN ILE 36 1.997 1.822 -6.190 292 HA ILE 36 HA ILE 36 -0.243 2.102 -7.807 293 HB ILE 36 HB ILE 36 -0.195 0.995 -4.993 294 HG12 ILE 36 HG12 ILE 36 0.211 -0.300 -7.693 295 HG13 ILE 36 HG11 ILE 36 1.368 -0.205 -6.377 296 HG21 ILE 36 HG21 ILE 36 -2.404 0.783 -5.207 297 HG22 ILE 36 HG22 ILE 36 -2.130 -0.282 -6.586 298 HG23 ILE 36 HG23 ILE 36 -2.343 1.448 -6.840 299 HD11 ILE 36 HD11 ILE 36 -0.166 -1.629 -5.031 300 HD12 ILE 36 HD12 ILE 36 0.514 -2.415 -6.452 301 HD13 ILE 36 HD13 ILE 36 -1.148 -1.834 -6.478 302 H ILE 37 HN ILE 37 0.204 3.317 -4.475 303 HA ILE 37 HA ILE 37 -2.344 4.487 -4.297 304 HB ILE 37 HB ILE 37 0.120 5.419 -2.823 305 HG12 ILE 37 HG12 ILE 37 -1.567 3.884 -1.159 306 HG13 ILE 37 HG11 ILE 37 -1.368 2.957 -2.639 307 HG21 ILE 37 HG21 ILE 37 -2.106 6.767 -2.967 308 HG22 ILE 37 HG22 ILE 37 -1.293 6.569 -1.411 309 HG23 ILE 37 HG23 ILE 37 -2.687 5.563 -1.815 310 HD11 ILE 37 HD11 ILE 37 0.972 2.878 -2.387 311 HD12 ILE 37 HD12 ILE 37 0.272 2.473 -0.817 312 HD13 ILE 37 HD13 ILE 37 0.938 4.082 -1.101 313 H GLN 38 HN GLN 38 0.788 6.026 -4.968 314 HA GLN 38 HA GLN 38 -0.100 8.609 -5.454 315 HB2 GLN 38 HB2 GLN 38 2.211 7.069 -6.628 316 HB3 GLN 38 HB1 GLN 38 1.957 8.774 -6.973 317 HG2 GLN 38 HG2 GLN 38 1.854 8.700 -4.220 318 HG3 GLN 38 HG1 GLN 38 3.053 7.467 -4.602 319 HE21 GLN 38 HE21 GLN 38 4.689 8.761 -3.692 320 HE22 GLN 38 HE22 GLN 38 5.322 10.141 -4.519 321 H SER 39 HN SER 39 -0.226 5.812 -7.529 322 HA SER 39 HA SER 39 -0.848 7.286 -9.904 323 HB2 SER 39 HB2 SER 39 0.286 5.157 -10.091 324 HB3 SER 39 HB1 SER 39 -1.032 4.338 -9.255 325 HG SER 39 HG SER 39 -1.809 4.045 -11.170 326 H ARG 40 HN ARG 40 -2.734 5.772 -7.324 327 HA ARG 40 HA ARG 40 -5.159 5.959 -8.939 328 HB2 ARG 40 HB2 ARG 40 -4.848 4.986 -6.101 329 HB3 ARG 40 HB1 ARG 40 -6.276 4.817 -7.109 330 HG2 ARG 40 HG2 ARG 40 -4.545 3.549 -8.683 331 HG3 ARG 40 HG1 ARG 40 -3.741 3.281 -7.131 332 HD2 ARG 40 HD2 ARG 40 -5.228 1.448 -7.615 333 HD3 ARG 40 HD1 ARG 40 -5.789 2.366 -6.223 334 HE ARG 40 HE ARG 40 -7.235 3.497 -8.123 335 HH11 ARG 40 HH11 ARG 40 -6.563 0.102 -7.592 336 HH12 ARG 40 HH12 ARG 40 -8.042 -0.433 -8.321 337 HH21 ARG 40 HH21 ARG 40 -9.185 2.791 -9.067 338 HH22 ARG 40 HH22 ARG 40 -9.541 1.097 -9.149 339 H GLU 41 HN GLU 41 -3.575 7.413 -6.210 340 HA GLU 41 HA GLU 41 -5.828 9.248 -5.817 341 HB2 GLU 41 HB2 GLU 41 -3.614 8.658 -3.907 342 HB3 GLU 41 HB1 GLU 41 -5.218 9.294 -3.574 343 HG2 GLU 41 HG2 GLU 41 -5.062 6.752 -4.929 344 HG3 GLU 41 HG1 GLU 41 -4.584 6.752 -3.272 345 HA PRO 42 HA PRO 42 -2.681 12.059 -7.691 346 HB2 PRO 42 HB2 PRO 42 -5.107 13.720 -7.992 347 HB3 PRO 42 HB1 PRO 42 -3.894 13.276 -9.194 348 HG2 PRO 42 HG2 PRO 42 -6.329 12.187 -9.234 349 HG3 PRO 42 HG1 PRO 42 -4.890 11.229 -9.632 350 HD2 PRO 42 HD2 PRO 42 -6.479 11.296 -7.094 351 HD3 PRO 42 HD1 PRO 42 -5.781 9.904 -7.951 352 H SER 43 HN SER 43 -4.799 12.293 -5.040 353 HA SER 43 HA SER 43 -4.332 14.992 -4.269 354 HB2 SER 43 HB2 SER 43 -6.236 14.136 -3.232 355 HB3 SER 43 HB1 SER 43 -5.470 12.581 -2.895 356 HG SER 43 HG SER 43 -4.807 15.037 -1.627 357 H LEU 44 HN LEU 44 -2.442 12.143 -4.016 358 HA LEU 44 HA LEU 44 -0.646 13.490 -2.120 359 HB2 LEU 44 HB2 LEU 44 -0.068 11.245 -1.230 360 HB3 LEU 44 HB1 LEU 44 -1.709 11.749 -0.906 361 HG LEU 44 HG LEU 44 -2.163 10.302 -3.126 362 HD11 LEU 44 HD11 LEU 44 0.206 9.748 -3.415 363 HD12 LEU 44 HD12 LEU 44 -0.784 8.318 -3.135 364 HD13 LEU 44 HD13 LEU 44 0.209 8.970 -1.833 365 HD21 LEU 44 HD21 LEU 44 -3.290 10.019 -1.014 366 HD22 LEU 44 HD22 LEU 44 -1.857 9.257 -0.316 367 HD23 LEU 44 HD23 LEU 44 -2.743 8.452 -1.612 368 H LYS 45 HN LYS 45 -0.836 12.993 -5.166 369 HA LYS 45 HA LYS 45 1.511 11.478 -5.785 370 HB2 LYS 45 HB2 LYS 45 1.175 12.115 -8.047 371 HB3 LYS 45 HB1 LYS 45 -0.425 11.874 -7.365 372 HG2 LYS 45 HG2 LYS 45 -0.544 14.352 -7.034 373 HG3 LYS 45 HG1 LYS 45 0.961 14.470 -7.954 374 HD2 LYS 45 HD2 LYS 45 -0.301 13.058 -9.709 375 HD3 LYS 45 HD1 LYS 45 -1.749 13.610 -8.867 376 HE2 LYS 45 HE2 LYS 45 -1.055 15.928 -9.186 377 HE3 LYS 45 HE1 LYS 45 0.399 15.375 -10.014 378 HZ1 LYS 45 HZ1 LYS 45 -0.986 14.405 -11.732 379 HZ2 LYS 45 HZ2 LYS 45 -1.322 16.053 -11.573 380 HZ3 LYS 45 HZ3 LYS 45 -2.387 14.910 -10.933 381 H ASN 46 HN ASN 46 1.033 14.558 -4.545 382 HA ASN 46 HA ASN 46 3.451 15.717 -5.666 383 HB2 ASN 46 HB2 ASN 46 2.830 17.644 -4.141 384 HB3 ASN 46 HB1 ASN 46 1.656 17.260 -5.394 385 HD21 ASN 46 HD21 ASN 46 2.346 17.173 -1.990 386 HD22 ASN 46 HD22 ASN 46 0.737 16.815 -1.477 387 H SER 47 HN SER 47 3.400 13.319 -3.880 388 HA SER 47 HA SER 47 5.052 14.314 -1.670 389 HB2 SER 47 HB2 SER 47 3.934 11.527 -2.067 390 HB3 SER 47 HB1 SER 47 4.640 12.192 -0.594 391 HG SER 47 HG SER 47 2.123 12.585 -1.722 392 H ASN 48 HN ASN 48 7.230 13.916 -1.686 393 HA ASN 48 HA ASN 48 8.571 13.011 -3.971 394 HB2 ASN 48 HB2 ASN 48 9.567 12.972 -1.105 395 HB3 ASN 48 HB1 ASN 48 10.578 12.849 -2.537 396 HD21 ASN 48 HD21 ASN 48 10.717 14.776 -0.433 397 HD22 ASN 48 HD22 ASN 48 10.478 16.329 -1.159 398 HA PRO 49 HA PRO 49 7.636 8.738 -3.897 399 HB2 PRO 49 HB2 PRO 49 9.822 7.815 -5.309 400 HB3 PRO 49 HB1 PRO 49 8.355 8.480 -6.029 401 HG2 PRO 49 HG2 PRO 49 10.992 9.790 -5.526 402 HG3 PRO 49 HG1 PRO 49 9.893 9.973 -6.908 403 HD2 PRO 49 HD2 PRO 49 10.062 11.829 -4.968 404 HD3 PRO 49 HD1 PRO 49 8.528 11.469 -5.785 405 H ASP 50 HN ASP 50 10.739 9.884 -2.773 406 HA ASP 50 HA ASP 50 11.542 7.380 -1.641 407 HB2 ASP 50 HB2 ASP 50 12.573 10.103 -0.861 408 HB3 ASP 50 HB1 ASP 50 13.402 8.564 -0.721 409 H GLU 51 HN GLU 51 9.623 10.074 -0.646 410 HA GLU 51 HA GLU 51 9.228 8.892 2.021 411 HB2 GLU 51 HB2 GLU 51 10.078 11.682 1.325 412 HB3 GLU 51 HB1 GLU 51 9.007 11.465 2.700 413 HG2 GLU 51 HG2 GLU 51 10.660 9.969 3.721 414 HG3 GLU 51 HG1 GLU 51 11.724 10.227 2.340 415 H ILE 52 HN ILE 52 7.283 8.171 0.609 416 HA ILE 52 HA ILE 52 5.510 10.267 -0.255 417 HB ILE 52 HB ILE 52 4.228 8.654 -1.323 418 HG12 ILE 52 HG12 ILE 52 5.379 6.361 0.169 419 HG13 ILE 52 HG11 ILE 52 4.082 7.304 0.905 420 HG21 ILE 52 HG21 ILE 52 6.863 7.236 -1.183 421 HG22 ILE 52 HG22 ILE 52 6.623 8.737 -2.086 422 HG23 ILE 52 HG23 ILE 52 5.722 7.287 -2.531 423 HD11 ILE 52 HD11 ILE 52 2.822 6.916 -1.279 424 HD12 ILE 52 HD12 ILE 52 2.990 5.559 -0.178 425 HD13 ILE 52 HD13 ILE 52 4.024 5.668 -1.601 426 H GLU 53 HN GLU 53 3.352 10.560 0.450 427 HA GLU 53 HA GLU 53 2.897 9.709 3.228 428 HB2 GLU 53 HB2 GLU 53 3.080 12.202 2.715 429 HB3 GLU 53 HB1 GLU 53 1.581 12.033 1.820 430 HG2 GLU 53 HG2 GLU 53 0.984 12.828 3.955 431 HG3 GLU 53 HG1 GLU 53 0.553 11.120 3.915 432 H ILE 54 HN ILE 54 1.241 8.372 3.586 433 HA ILE 54 HA ILE 54 -0.856 8.156 1.510 434 HB ILE 54 HB ILE 54 0.033 6.019 3.457 435 HG12 ILE 54 HG12 ILE 54 0.381 6.150 0.458 436 HG13 ILE 54 HG11 ILE 54 1.666 6.440 1.631 437 HG21 ILE 54 HG21 ILE 54 -1.430 4.579 2.012 438 HG22 ILE 54 HG22 ILE 54 -2.061 6.060 1.301 439 HG23 ILE 54 HG23 ILE 54 -2.280 5.743 3.024 440 HD11 ILE 54 HD11 ILE 54 1.704 4.178 0.650 441 HD12 ILE 54 HD12 ILE 54 0.125 3.870 1.374 442 HD13 ILE 54 HD13 ILE 54 1.523 4.170 2.403 443 H ASP 55 HN ASP 55 -2.978 8.356 2.163 444 HA ASP 55 HA ASP 55 -3.406 8.668 5.065 445 HB2 ASP 55 HB2 ASP 55 -3.639 10.817 3.745 446 HB3 ASP 55 HB1 ASP 55 -5.006 10.071 2.918 447 H PHE 56 HN PHE 56 -4.074 6.638 5.492 448 HA PHE 56 HA PHE 56 -5.424 5.026 3.645 449 HB2 PHE 56 HB2 PHE 56 -4.491 4.780 6.401 450 HB3 PHE 56 HB1 PHE 56 -5.898 3.784 6.025 451 HD1 PHE 56 HD1 PHE 56 -2.365 4.414 5.239 452 HD2 PHE 56 HD2 PHE 56 -5.780 2.029 4.439 453 HE1 PHE 56 HE1 PHE 56 -0.959 2.792 4.032 454 HE2 PHE 56 HE2 PHE 56 -4.399 0.420 3.246 455 HZ PHE 56 HZ PHE 56 -1.982 0.775 3.040 456 H GLU 57 HN GLU 57 -6.702 7.430 5.675 457 HA GLU 57 HA GLU 57 -9.315 6.175 5.814 458 HB2 GLU 57 HB2 GLU 57 -8.183 8.724 6.918 459 HB3 GLU 57 HB1 GLU 57 -9.895 8.332 7.029 460 HG2 GLU 57 HG2 GLU 57 -7.727 6.529 8.066 461 HG3 GLU 57 HG1 GLU 57 -8.495 7.778 9.044 462 H THR 58 HN THR 58 -7.662 7.936 3.551 463 HA THR 58 HA THR 58 -10.183 9.005 2.473 464 HB THR 58 HB THR 58 -8.877 10.785 1.353 465 HG1 THR 58 HG1 THR 58 -6.756 9.849 3.029 466 HG21 THR 58 HG21 THR 58 -8.629 10.610 4.347 467 HG22 THR 58 HG22 THR 58 -9.999 11.264 3.444 468 HG23 THR 58 HG23 THR 58 -8.443 12.097 3.413 469 H LEU 59 HN LEU 59 -7.776 6.754 1.981 470 HA LEU 59 HA LEU 59 -7.505 6.886 -0.855 471 HB2 LEU 59 HB2 LEU 59 -7.364 4.269 0.622 472 HB3 LEU 59 HB1 LEU 59 -6.484 4.788 -0.789 473 HG LEU 59 HG LEU 59 -5.999 5.694 2.040 474 HD11 LEU 59 HD11 LEU 59 -4.490 3.887 0.160 475 HD12 LEU 59 HD12 LEU 59 -5.147 3.514 1.754 476 HD13 LEU 59 HD13 LEU 59 -3.775 4.609 1.601 477 HD21 LEU 59 HD21 LEU 59 -4.864 6.638 -0.566 478 HD22 LEU 59 HD22 LEU 59 -3.954 6.765 0.931 479 HD23 LEU 59 HD23 LEU 59 -5.505 7.585 0.768 480 H LYS 60 HN LYS 60 -8.558 5.705 -2.437 481 HA LYS 60 HA LYS 60 -11.332 5.206 -2.087 482 HB2 LYS 60 HB2 LYS 60 -9.488 4.261 -4.293 483 HB3 LYS 60 HB1 LYS 60 -11.243 4.352 -4.382 484 HG2 LYS 60 HG2 LYS 60 -11.098 6.799 -4.141 485 HG3 LYS 60 HG1 LYS 60 -9.336 6.673 -4.127 486 HD2 LYS 60 HD2 LYS 60 -9.416 5.647 -6.361 487 HD3 LYS 60 HD1 LYS 60 -11.169 5.850 -6.376 488 HE2 LYS 60 HE2 LYS 60 -10.184 7.649 -7.613 489 HE3 LYS 60 HE1 LYS 60 -10.831 8.295 -6.106 490 HZ1 LYS 60 HZ1 LYS 60 -7.987 7.748 -6.756 491 HZ2 LYS 60 HZ2 LYS 60 -8.526 8.126 -5.196 492 HZ3 LYS 60 HZ3 LYS 60 -8.706 9.249 -6.448 493 HA PRO 61 HA PRO 61 -11.463 1.083 -0.470 494 HB2 PRO 61 HB2 PRO 61 -13.542 0.499 -2.499 495 HB3 PRO 61 HB1 PRO 61 -13.637 0.399 -0.741 496 HG2 PRO 61 HG2 PRO 61 -14.849 2.354 -2.149 497 HG3 PRO 61 HG1 PRO 61 -14.216 2.619 -0.517 498 HD2 PRO 61 HD2 PRO 61 -13.128 3.502 -3.141 499 HD3 PRO 61 HD1 PRO 61 -13.000 4.268 -1.545 500 H SER 62 HN SER 62 -11.373 1.588 -3.945 501 HA SER 62 HA SER 62 -10.569 -1.097 -4.534 502 HB2 SER 62 HB2 SER 62 -10.117 -0.077 -6.828 503 HB3 SER 62 HB1 SER 62 -11.774 0.006 -6.236 504 HG SER 62 HG SER 62 -11.084 1.994 -7.109 505 H THR 63 HN THR 63 -8.961 1.987 -4.020 506 HA THR 63 HA THR 63 -6.358 1.237 -4.730 507 HB THR 63 HB THR 63 -6.859 3.044 -2.358 508 HG1 THR 63 HG1 THR 63 -7.328 4.722 -3.843 509 HG21 THR 63 HG21 THR 63 -4.550 2.538 -3.167 510 HG22 THR 63 HG22 THR 63 -4.967 4.244 -3.212 511 HG23 THR 63 HG23 THR 63 -4.965 3.298 -4.697 512 H LEU 64 HN LEU 64 -8.075 1.060 -1.632 513 HA LEU 64 HA LEU 64 -6.045 -0.126 -0.118 514 HB2 LEU 64 HB2 LEU 64 -9.048 -0.306 0.120 515 HB3 LEU 64 HB1 LEU 64 -7.951 -0.977 1.312 516 HG LEU 64 HG LEU 64 -8.087 1.944 0.568 517 HD11 LEU 64 HD11 LEU 64 -10.126 1.222 1.732 518 HD12 LEU 64 HD12 LEU 64 -9.133 2.262 2.745 519 HD13 LEU 64 HD13 LEU 64 -9.135 0.521 3.008 520 HD21 LEU 64 HD21 LEU 64 -5.907 1.378 1.340 521 HD22 LEU 64 HD22 LEU 64 -6.570 0.445 2.676 522 HD23 LEU 64 HD23 LEU 64 -6.757 2.197 2.644 523 H ARG 65 HN ARG 65 -8.502 -1.618 -2.179 524 HA ARG 65 HA ARG 65 -7.794 -4.268 -1.331 525 HB2 ARG 65 HB2 ARG 65 -9.769 -3.079 -3.134 526 HB3 ARG 65 HB1 ARG 65 -9.165 -4.622 -3.678 527 HG2 ARG 65 HG2 ARG 65 -10.486 -4.038 -1.044 528 HG3 ARG 65 HG1 ARG 65 -11.184 -4.955 -2.386 529 HD2 ARG 65 HD2 ARG 65 -9.225 -6.566 -2.061 530 HD3 ARG 65 HD1 ARG 65 -8.948 -5.737 -0.528 531 HE ARG 65 HE ARG 65 -11.625 -6.374 -0.562 532 HH11 ARG 65 HH11 ARG 65 -8.573 -8.093 -0.515 533 HH12 ARG 65 HH12 ARG 65 -9.275 -9.567 0.073 534 HH21 ARG 65 HH21 ARG 65 -12.536 -8.315 0.234 535 HH22 ARG 65 HH22 ARG 65 -11.517 -9.691 0.509 536 H GLU 66 HN GLU 66 -6.560 -2.037 -3.621 537 HA GLU 66 HA GLU 66 -5.284 -4.074 -5.218 538 HB2 GLU 66 HB2 GLU 66 -5.971 -2.030 -6.303 539 HB3 GLU 66 HB1 GLU 66 -5.046 -1.062 -5.164 540 HG2 GLU 66 HG2 GLU 66 -3.906 -1.173 -7.274 541 HG3 GLU 66 HG1 GLU 66 -2.976 -2.038 -6.050 542 H LEU 67 HN LEU 67 -4.481 -1.792 -2.675 543 HA LEU 67 HA LEU 67 -1.701 -2.268 -2.593 544 HB2 LEU 67 HB2 LEU 67 -3.571 -1.416 -0.365 545 HB3 LEU 67 HB1 LEU 67 -1.831 -1.175 -0.388 546 HG LEU 67 HG LEU 67 -3.840 0.128 -2.232 547 HD11 LEU 67 HD11 LEU 67 -2.129 1.362 -0.080 548 HD12 LEU 67 HD12 LEU 67 -3.836 0.964 0.099 549 HD13 LEU 67 HD13 LEU 67 -3.332 2.169 -1.084 550 HD21 LEU 67 HD21 LEU 67 -1.637 -0.383 -3.271 551 HD22 LEU 67 HD22 LEU 67 -0.885 0.647 -2.050 552 HD23 LEU 67 HD23 LEU 67 -2.039 1.327 -3.196 553 H GLU 68 HN GLU 68 -4.455 -3.494 -0.747 554 HA GLU 68 HA GLU 68 -3.006 -5.266 0.916 555 HB2 GLU 68 HB2 GLU 68 -5.219 -4.467 1.516 556 HB3 GLU 68 HB1 GLU 68 -5.920 -5.271 0.119 557 HG2 GLU 68 HG2 GLU 68 -4.570 -7.280 1.451 558 HG3 GLU 68 HG1 GLU 68 -5.290 -6.313 2.732 559 H ARG 69 HN ARG 69 -5.091 -5.969 -1.925 560 HA ARG 69 HA ARG 69 -4.694 -8.704 -2.060 561 HB2 ARG 69 HB2 ARG 69 -6.293 -7.493 -3.482 562 HB3 ARG 69 HB1 ARG 69 -4.957 -6.835 -4.417 563 HG2 ARG 69 HG2 ARG 69 -4.353 -9.367 -4.713 564 HG3 ARG 69 HG1 ARG 69 -6.071 -9.581 -4.373 565 HD2 ARG 69 HD2 ARG 69 -5.584 -9.377 -6.793 566 HD3 ARG 69 HD1 ARG 69 -6.673 -8.128 -6.195 567 HE ARG 69 HE ARG 69 -4.857 -6.560 -6.308 568 HH11 ARG 69 HH11 ARG 69 -4.214 -9.650 -7.821 569 HH12 ARG 69 HH12 ARG 69 -2.955 -9.032 -8.841 570 HH21 ARG 69 HH21 ARG 69 -3.202 -5.732 -7.657 571 HH22 ARG 69 HH22 ARG 69 -2.382 -6.816 -8.749 572 H TYR 70 HN TYR 70 -2.572 -6.163 -3.185 573 HA TYR 70 HA TYR 70 -0.891 -7.977 -4.639 574 HB2 TYR 70 HB2 TYR 70 -0.889 -5.813 -5.532 575 HB3 TYR 70 HB1 TYR 70 -0.724 -5.061 -3.947 576 HD1 TYR 70 HD2 TYR 70 1.108 -6.946 -6.567 577 HD2 TYR 70 HD1 TYR 70 1.357 -4.665 -2.997 578 HE1 TYR 70 HE2 TYR 70 3.553 -6.822 -6.830 579 HE2 TYR 70 HE1 TYR 70 3.802 -4.521 -3.246 580 HH TYR 70 HH TYR 70 5.417 -5.458 -6.109 581 H VAL 71 HN VAL 71 -0.614 -6.237 -1.537 582 HA VAL 71 HA VAL 71 2.002 -7.154 -0.998 583 HB VAL 71 HB VAL 71 1.610 -6.498 1.324 584 HG11 VAL 71 HG11 VAL 71 0.463 -4.147 0.413 585 HG12 VAL 71 HG12 VAL 71 1.295 -4.813 -0.986 586 HG13 VAL 71 HG13 VAL 71 2.179 -4.514 0.512 587 HG21 VAL 71 HG21 VAL 71 -0.537 -7.068 1.882 588 HG22 VAL 71 HG22 VAL 71 -1.221 -6.369 0.413 589 HG23 VAL 71 HG23 VAL 71 -0.657 -5.316 1.711 590 H THR 72 HN THR 72 -1.168 -8.381 0.011 591 HA THR 72 HA THR 72 -0.278 -10.424 1.674 592 HB THR 72 HB THR 72 -2.667 -9.615 1.399 593 HG1 THR 72 HG1 THR 72 -2.532 -11.367 2.681 594 HG21 THR 72 HG21 THR 72 -2.727 -9.880 -1.071 595 HG22 THR 72 HG22 THR 72 -4.072 -10.660 -0.242 596 HG23 THR 72 HG23 THR 72 -2.728 -11.629 -0.848 597 H SER 73 HN SER 73 -0.496 -10.265 -1.808 598 HA SER 73 HA SER 73 -0.054 -13.010 -2.319 599 HB2 SER 73 HB2 SER 73 0.054 -12.427 -4.559 600 HB3 SER 73 HB1 SER 73 -0.809 -11.037 -3.903 601 HG SER 73 HG SER 73 1.104 -9.868 -3.911 602 H CYS 74 HN CYS 74 2.021 -10.380 -1.473 603 HA CYS 74 HA CYS 74 4.454 -11.785 -2.225 604 HB2 CYS 74 HB2 CYS 74 4.263 -9.363 -2.640 605 HB3 CYS 74 HB1 CYS 74 4.064 -9.083 -0.912 606 HG CYS 74 HG CYS 74 6.673 -10.141 -0.342 607 H LEU 75 HN LEU 75 2.942 -10.521 0.754 608 HA LEU 75 HA LEU 75 4.812 -11.401 2.612 609 HB2 LEU 75 HB2 LEU 75 1.900 -11.630 3.235 610 HB3 LEU 75 HB1 LEU 75 3.207 -11.063 4.247 611 HG LEU 75 HG LEU 75 2.145 -9.521 1.901 612 HD11 LEU 75 HD11 LEU 75 1.597 -8.931 4.779 613 HD12 LEU 75 HD12 LEU 75 0.543 -9.984 3.843 614 HD13 LEU 75 HD13 LEU 75 0.786 -8.318 3.339 615 HD21 LEU 75 HD21 LEU 75 4.466 -9.096 2.632 616 HD22 LEU 75 HD22 LEU 75 3.850 -8.676 4.230 617 HD23 LEU 75 HD23 LEU 75 3.399 -7.707 2.826 618 H ARG 76 HN ARG 76 2.312 -13.160 0.945 619 HA ARG 76 HA ARG 76 2.703 -15.524 2.602 620 HB2 ARG 76 HB2 ARG 76 0.692 -14.814 0.470 621 HB3 ARG 76 HB1 ARG 76 0.781 -16.411 1.210 622 HG2 ARG 76 HG2 ARG 76 0.048 -15.650 3.255 623 HG3 ARG 76 HG1 ARG 76 0.596 -14.000 2.951 624 HD2 ARG 76 HD2 ARG 76 -1.834 -14.165 2.934 625 HD3 ARG 76 HD1 ARG 76 -1.200 -13.662 1.373 626 HE ARG 76 HE ARG 76 -1.600 -16.474 1.468 627 HH11 ARG 76 HH11 ARG 76 -3.259 -13.415 1.156 628 HH12 ARG 76 HH12 ARG 76 -4.579 -14.075 0.242 629 HH21 ARG 76 HH21 ARG 76 -3.326 -17.352 0.246 630 HH22 ARG 76 HH22 ARG 76 -4.624 -16.323 -0.269 631 H LYS 77 HN LYS 77 4.605 -14.376 0.533 632 HA LYS 77 HA LYS 77 5.418 -16.996 -0.466 633 HB2 LYS 77 HB2 LYS 77 4.041 -16.158 -2.346 634 HB3 LYS 77 HB1 LYS 77 5.056 -14.710 -2.409 635 HG2 LYS 77 HG2 LYS 77 6.994 -16.336 -2.715 636 HG3 LYS 77 HG1 LYS 77 5.759 -17.540 -3.063 637 HD2 LYS 77 HD2 LYS 77 4.870 -16.120 -4.852 638 HD3 LYS 77 HD1 LYS 77 6.131 -14.930 -4.529 639 HE2 LYS 77 HE2 LYS 77 7.841 -16.524 -5.146 640 HE3 LYS 77 HE1 LYS 77 6.628 -17.786 -5.359 641 HZ1 LYS 77 HZ1 LYS 77 7.283 -16.838 -7.473 642 HZ2 LYS 77 HZ2 LYS 77 6.830 -15.295 -6.957 643 HZ3 LYS 77 HZ3 LYS 77 5.661 -16.496 -7.156 644 H LYS 78 HN LYS 78 7.418 -17.134 0.346 645 HA LYS 78 HA LYS 78 8.821 -14.691 0.981 646 HB2 LYS 78 HB2 LYS 78 9.141 -17.558 1.719 647 HB3 LYS 78 HB1 LYS 78 10.545 -16.503 1.832 648 HG2 LYS 78 HG2 LYS 78 9.420 -16.636 3.970 649 HG3 LYS 78 HG1 LYS 78 9.286 -15.004 3.317 650 HD2 LYS 78 HD2 LYS 78 7.154 -15.527 4.183 651 HD3 LYS 78 HD1 LYS 78 7.012 -15.695 2.433 652 HE2 LYS 78 HE2 LYS 78 5.898 -17.552 3.445 653 HE3 LYS 78 HE1 LYS 78 7.387 -18.145 2.711 654 HZ1 LYS 78 HZ1 LYS 78 8.432 -18.109 4.887 655 HZ2 LYS 78 HZ2 LYS 78 7.052 -19.084 4.904 656 HZ3 LYS 78 HZ3 LYS 78 7.004 -17.540 5.592 657 H ARG 79 HN ARG 79 11.437 -15.452 0.868 658 HA ARG 79 HA ARG 79 13.240 -15.272 -0.464 659 HB2 ARG 79 HB2 ARG 79 11.476 -16.846 -2.311 660 HB3 ARG 79 HB1 ARG 79 13.025 -16.228 -2.859 661 HG2 ARG 79 HG2 ARG 79 13.359 -18.470 -2.172 662 HG3 ARG 79 HG1 ARG 79 14.093 -17.431 -0.952 663 HD2 ARG 79 HD2 ARG 79 11.991 -17.679 0.389 664 HD3 ARG 79 HD1 ARG 79 11.461 -18.884 -0.783 665 HE ARG 79 HE ARG 79 14.053 -19.364 0.419 666 HH11 ARG 79 HH11 ARG 79 10.619 -20.013 0.501 667 HH12 ARG 79 HH12 ARG 79 10.778 -21.427 1.492 668 HH21 ARG 79 HH21 ARG 79 14.270 -21.230 1.723 669 HH22 ARG 79 HH22 ARG 79 12.856 -22.130 2.174 670 H LYS 80 HN LYS 80 13.761 -13.281 -0.927 671 HA LYS 80 HA LYS 80 12.108 -11.809 -2.876 672 HB2 LYS 80 HB2 LYS 80 12.917 -9.745 -1.741 673 HB3 LYS 80 HB1 LYS 80 11.939 -10.779 -0.709 674 HG2 LYS 80 HG2 LYS 80 13.871 -11.558 0.458 675 HG3 LYS 80 HG1 LYS 80 14.948 -10.763 -0.690 676 HD2 LYS 80 HD2 LYS 80 14.005 -8.582 0.019 677 HD3 LYS 80 HD1 LYS 80 13.066 -9.430 1.249 678 HE2 LYS 80 HE2 LYS 80 15.106 -10.225 2.294 679 HE3 LYS 80 HE1 LYS 80 16.071 -9.469 1.027 680 HZ1 LYS 80 HZ1 LYS 80 14.356 -8.054 2.991 681 HZ2 LYS 80 HZ2 LYS 80 15.228 -7.311 1.747 682 HZ3 LYS 80 HZ3 LYS 80 16.046 -8.105 2.993 683 HA PRO 81 HA PRO 81 16.441 -12.477 -4.739 684 HB2 PRO 81 HB2 PRO 81 14.682 -12.688 -7.123 685 HB3 PRO 81 HB1 PRO 81 16.084 -13.664 -6.667 686 HG2 PRO 81 HG2 PRO 81 13.576 -14.600 -6.454 687 HG3 PRO 81 HG1 PRO 81 14.843 -15.040 -5.297 688 HD2 PRO 81 HD2 PRO 81 12.536 -13.179 -4.972 689 HD3 PRO 81 HD1 PRO 81 13.357 -14.208 -3.770 690 H GLN 82 HN GLN 82 16.920 -10.332 -4.383 691 HA GLN 82 HA GLN 82 15.752 -8.366 -6.238 692 HB2 GLN 82 HB2 GLN 82 15.346 -7.963 -3.818 693 HB3 GLN 82 HB1 GLN 82 17.082 -7.900 -3.559 694 HG2 GLN 82 HG2 GLN 82 17.195 -5.960 -5.090 695 HG3 GLN 82 HG1 GLN 82 15.436 -5.994 -5.202 696 HE21 GLN 82 HE21 GLN 82 18.165 -5.304 -3.184 697 HE22 GLN 82 HE22 GLN 82 17.299 -4.463 -1.946 698 H ALA 83 HN ALA 83 18.741 -9.408 -4.646 699 HA ALA 83 HA ALA 83 20.257 -8.507 -6.967 700 HB1 ALA 83 HB1 ALA 83 20.931 -7.658 -4.151 701 HB2 ALA 83 HB2 ALA 83 20.351 -6.610 -5.445 702 HB3 ALA 83 HB3 ALA 83 21.932 -7.379 -5.575 703 H1 GLU 201 HT1 GLU 201 -6.810 9.930 12.954 704 H2 GLU 201 HT2 GLU 201 -5.550 8.963 13.533 705 H3 GLU 201 HT3 GLU 201 -6.784 8.278 12.605 706 HA GLU 201 HA GLU 201 -6.114 9.500 10.680 707 HB2 GLU 201 HB2 GLU 201 -3.938 10.577 12.488 708 HB3 GLU 201 HB1 GLU 201 -4.036 10.842 10.754 709 HG2 GLU 201 HG2 GLU 201 -5.978 11.811 12.835 710 HG3 GLU 201 HG1 GLU 201 -4.830 12.785 11.920 711 H ILE 202 HN ILE 202 -5.054 8.202 9.289 712 HA ILE 202 HA ILE 202 -2.943 6.452 10.370 713 HB ILE 202 HB ILE 202 -5.056 5.645 8.357 714 HG12 ILE 202 HG12 ILE 202 -5.831 5.768 10.743 715 HG13 ILE 202 HG11 ILE 202 -5.922 4.157 10.040 716 HG21 ILE 202 HG21 ILE 202 -2.885 4.630 7.886 717 HG22 ILE 202 HG22 ILE 202 -4.036 3.424 8.460 718 HG23 ILE 202 HG23 ILE 202 -2.792 4.042 9.546 719 HD11 ILE 202 HD11 ILE 202 -3.880 3.522 11.201 720 HD12 ILE 202 HD12 ILE 202 -5.101 4.109 12.334 721 HD13 ILE 202 HD13 ILE 202 -3.752 5.148 11.876 722 H LYS 203 HN LYS 203 -1.200 7.464 9.534 723 HA LYS 203 HA LYS 203 -1.144 7.908 6.623 724 HB2 LYS 203 HB2 LYS 203 0.510 9.192 8.807 725 HB3 LYS 203 HB1 LYS 203 0.750 9.458 7.087 726 HG2 LYS 203 HG2 LYS 203 -1.409 10.493 6.898 727 HG3 LYS 203 HG1 LYS 203 -1.784 10.109 8.577 728 HD2 LYS 203 HD2 LYS 203 0.078 11.539 9.297 729 HD3 LYS 203 HD1 LYS 203 0.420 11.930 7.612 730 HE2 LYS 203 HE2 LYS 203 -0.882 13.690 8.728 731 HE3 LYS 203 HE1 LYS 203 -1.757 12.966 7.379 732 HZ1 LYS 203 HZ1 LYS 203 -3.029 11.653 8.928 733 HZ2 LYS 203 HZ2 LYS 203 -3.152 13.286 9.345 734 HZ3 LYS 203 HZ3 LYS 203 -2.147 12.262 10.238 735 H LEU 204 HN LEU 204 0.663 7.183 5.451 736 HA LEU 204 HA LEU 204 2.539 5.464 6.925 737 HB2 LEU 204 HB2 LEU 204 0.624 4.420 5.299 738 HB3 LEU 204 HB1 LEU 204 1.933 4.655 4.158 739 HG LEU 204 HG LEU 204 1.960 2.936 6.637 740 HD11 LEU 204 HD11 LEU 204 2.444 2.185 3.766 741 HD12 LEU 204 HD12 LEU 204 0.877 2.065 4.562 742 HD13 LEU 204 HD13 LEU 204 2.238 1.108 5.147 743 HD21 LEU 204 HD21 LEU 204 4.273 3.308 4.749 744 HD22 LEU 204 HD22 LEU 204 4.241 2.433 6.279 745 HD23 LEU 204 HD23 LEU 204 4.122 4.192 6.266 746 H LYS 205 HN LYS 205 4.243 6.821 6.862 747 HA LYS 205 HA LYS 205 5.134 8.039 4.407 748 HB2 LYS 205 HB2 LYS 205 6.151 7.902 7.214 749 HB3 LYS 205 HB1 LYS 205 7.268 8.329 5.931 750 HG2 LYS 205 HG2 LYS 205 4.685 9.770 6.417 751 HG3 LYS 205 HG1 LYS 205 6.228 10.253 7.125 752 HD2 LYS 205 HD2 LYS 205 7.139 10.333 4.773 753 HD3 LYS 205 HD1 LYS 205 5.476 10.150 4.211 754 HE2 LYS 205 HE2 LYS 205 4.884 12.168 5.552 755 HE3 LYS 205 HE1 LYS 205 6.603 12.371 5.907 756 HZ1 LYS 205 HZ1 LYS 205 5.942 13.763 4.075 757 HZ2 LYS 205 HZ2 LYS 205 5.355 12.435 3.213 758 HZ3 LYS 205 HZ3 LYS 205 7.009 12.576 3.526 759 H ILE 206 HN ILE 206 5.121 5.889 3.245 760 HA ILE 206 HA ILE 206 7.034 3.917 3.944 761 HB ILE 206 HB ILE 206 6.423 4.319 1.045 762 HG12 ILE 206 HG12 ILE 206 4.465 2.899 2.843 763 HG13 ILE 206 HG11 ILE 206 4.209 4.573 2.332 764 HG21 ILE 206 HG21 ILE 206 6.057 1.706 2.256 765 HG22 ILE 206 HG22 ILE 206 7.640 2.418 2.628 766 HG23 ILE 206 HG23 ILE 206 7.142 2.219 0.948 767 HD11 ILE 206 HD11 ILE 206 4.847 2.815 0.110 768 HD12 ILE 206 HD12 ILE 206 3.493 3.913 0.330 769 HD13 ILE 206 HD13 ILE 206 3.418 2.288 1.001 770 H THR 207 HN THR 207 9.193 4.045 3.848 771 HA THR 207 HA THR 207 10.377 6.143 2.160 772 HB THR 207 HB THR 207 12.413 5.723 3.697 773 HG1 THR 207 HG1 THR 207 11.686 3.856 4.739 774 HG21 THR 207 HG21 THR 207 9.896 6.969 4.811 775 HG22 THR 207 HG22 THR 207 11.068 7.764 3.761 776 HG23 THR 207 HG23 THR 207 11.534 7.271 5.388 777 H LYS 208 HN LYS 208 11.098 5.354 0.279 778 HA LYS 208 HA LYS 208 13.051 3.368 0.112 779 HB2 LYS 208 HB2 LYS 208 11.968 1.482 -0.802 780 HB3 LYS 208 HB1 LYS 208 11.035 1.923 0.613 781 HG2 LYS 208 HG2 LYS 208 10.290 2.563 -2.234 782 HG3 LYS 208 HG1 LYS 208 9.642 1.236 -1.284 783 HD2 LYS 208 HD2 LYS 208 7.994 2.737 -0.876 784 HD3 LYS 208 HD1 LYS 208 9.116 3.297 0.367 785 HE2 LYS 208 HE2 LYS 208 10.038 4.912 -1.259 786 HE3 LYS 208 HE1 LYS 208 8.819 4.397 -2.418 787 HZ1 LYS 208 HZ1 LYS 208 8.211 6.416 -1.265 788 HZ2 LYS 208 HZ2 LYS 208 8.248 5.606 0.226 789 HZ3 LYS 208 HZ3 LYS 208 7.108 5.171 -0.950 790 H THR 209 HN THR 209 12.408 2.375 -2.492 791 HA THR 209 HA THR 209 12.717 2.801 -4.661 792 HB THR 209 HB THR 209 11.733 4.769 -5.756 793 HG1 THR 209 HG1 THR 209 11.894 5.869 -3.340 794 HG21 THR 209 HG21 THR 209 9.844 3.582 -3.743 795 HG22 THR 209 HG22 THR 209 10.381 2.759 -5.205 796 HG23 THR 209 HG23 THR 209 9.436 4.245 -5.323 797 H ILE 210 HN ILE 210 13.890 4.083 -6.250 798 HA ILE 210 HA ILE 210 15.864 4.967 -6.927 799 HB ILE 210 HB ILE 210 15.517 6.922 -4.647 800 HG12 ILE 210 HG12 ILE 210 13.441 6.796 -5.959 801 HG13 ILE 210 HG11 ILE 210 14.261 8.329 -6.226 802 HG21 ILE 210 HG21 ILE 210 17.687 7.018 -5.750 803 HG22 ILE 210 HG22 ILE 210 16.736 8.458 -6.115 804 HG23 ILE 210 HG23 ILE 210 16.895 7.178 -7.318 805 HD11 ILE 210 HD11 ILE 210 13.367 7.452 -8.296 806 HD12 ILE 210 HD12 ILE 210 14.283 5.960 -8.081 807 HD13 ILE 210 HD13 ILE 210 15.130 7.483 -8.352 808 H GLN 211 HN GLN 211 16.634 2.845 -5.973 809 HA GLN 211 HA GLN 211 18.166 3.053 -3.526 810 HB2 GLN 211 HB2 GLN 211 17.785 0.798 -5.497 811 HB3 GLN 211 HB1 GLN 211 18.855 0.685 -4.110 812 HG2 GLN 211 HG2 GLN 211 16.888 -0.342 -3.418 813 HG3 GLN 211 HG1 GLN 211 16.827 1.260 -2.693 814 HE21 GLN 211 HE21 GLN 211 16.166 0.587 -6.071 815 HE22 GLN 211 HE22 GLN 211 14.478 0.956 -6.003 816 H ASN 212 HN ASN 212 19.298 4.909 -4.704 817 HA ASN 212 HA ASN 212 21.347 4.102 -6.578 818 HB2 ASN 212 HB2 ASN 212 20.161 6.323 -6.695 819 HB3 ASN 212 HB1 ASN 212 21.014 6.785 -5.224 820 HD21 ASN 212 HD21 ASN 212 21.272 6.162 -8.611 821 HD22 ASN 212 HD22 ASN 212 22.872 6.786 -8.818 Start of MODEL 13 1 H1 SER 1 HT1 SER 1 -11.308 -4.516 -14.864 2 H2 SER 1 HT2 SER 1 -11.471 -4.303 -13.198 3 H3 SER 1 HT3 SER 1 -11.762 -3.009 -14.249 4 HA SER 1 HA SER 1 -13.587 -4.254 -15.249 5 HB2 SER 1 HB2 SER 1 -12.854 -6.127 -12.973 6 HB3 SER 1 HB1 SER 1 -14.457 -6.186 -13.706 7 HG SER 1 HG SER 1 -11.932 -6.790 -14.837 8 H GLU 2 HN GLU 2 -15.781 -4.690 -13.527 9 HA GLU 2 HA GLU 2 -16.025 -1.979 -12.557 10 HB2 GLU 2 HB2 GLU 2 -18.064 -4.214 -12.609 11 HB3 GLU 2 HB1 GLU 2 -18.391 -2.566 -12.105 12 HG2 GLU 2 HG2 GLU 2 -17.544 -3.444 -14.853 13 HG3 GLU 2 HG1 GLU 2 -19.151 -2.928 -14.362 14 H GLU 3 HN GLU 3 -16.621 -5.171 -11.055 15 HA GLU 3 HA GLU 3 -17.323 -4.113 -8.558 16 HB2 GLU 3 HB2 GLU 3 -16.363 -6.856 -9.341 17 HB3 GLU 3 HB1 GLU 3 -16.899 -6.457 -7.718 18 HG2 GLU 3 HG2 GLU 3 -19.102 -5.836 -8.625 19 HG3 GLU 3 HG1 GLU 3 -18.548 -6.312 -10.231 20 H GLU 4 HN GLU 4 -14.175 -4.755 -9.875 21 HA GLU 4 HA GLU 4 -12.849 -4.905 -7.341 22 HB2 GLU 4 HB2 GLU 4 -10.746 -4.615 -8.596 23 HB3 GLU 4 HB1 GLU 4 -11.761 -5.865 -9.306 24 HG2 GLU 4 HG2 GLU 4 -12.471 -4.346 -11.047 25 HG3 GLU 4 HG1 GLU 4 -11.559 -3.032 -10.306 26 H ASP 5 HN ASP 5 -13.647 -2.281 -9.558 27 HA ASP 5 HA ASP 5 -12.242 -0.374 -7.876 28 HB2 ASP 5 HB2 ASP 5 -13.871 0.048 -10.394 29 HB3 ASP 5 HB1 ASP 5 -13.090 1.346 -9.494 30 H LYS 6 HN LYS 6 -15.268 -1.838 -8.066 31 HA LYS 6 HA LYS 6 -16.566 0.342 -6.581 32 HB2 LYS 6 HB2 LYS 6 -17.626 -0.558 -8.705 33 HB3 LYS 6 HB1 LYS 6 -17.908 -2.061 -7.839 34 HG2 LYS 6 HG2 LYS 6 -19.916 -0.738 -7.825 35 HG3 LYS 6 HG1 LYS 6 -19.263 -0.794 -6.185 36 HD2 LYS 6 HD2 LYS 6 -18.298 1.416 -6.473 37 HD3 LYS 6 HD1 LYS 6 -18.873 1.470 -8.141 38 HE2 LYS 6 HE2 LYS 6 -21.178 1.373 -7.365 39 HE3 LYS 6 HE1 LYS 6 -20.626 1.258 -5.696 40 HZ1 LYS 6 HZ1 LYS 6 -21.301 3.510 -6.299 41 HZ2 LYS 6 HZ2 LYS 6 -20.114 3.555 -7.499 42 HZ3 LYS 6 HZ3 LYS 6 -19.666 3.444 -5.872 43 H CYS 7 HN CYS 7 -14.604 -1.454 -5.519 44 HA CYS 7 HA CYS 7 -15.900 -3.465 -3.953 45 HB2 CYS 7 HB2 CYS 7 -13.487 -3.566 -4.668 46 HB3 CYS 7 HB1 CYS 7 -13.144 -2.290 -3.503 47 HG CYS 7 HG CYS 7 -14.090 -3.876 -1.315 48 H LYS 8 HN LYS 8 -16.158 -3.493 -1.709 49 HA LYS 8 HA LYS 8 -17.007 -0.970 -0.615 50 HB2 LYS 8 HB2 LYS 8 -17.140 -3.835 0.280 51 HB3 LYS 8 HB1 LYS 8 -17.516 -2.537 1.399 52 HG2 LYS 8 HG2 LYS 8 -19.526 -3.463 0.382 53 HG3 LYS 8 HG1 LYS 8 -19.303 -1.768 -0.044 54 HD2 LYS 8 HD2 LYS 8 -18.369 -2.461 -2.214 55 HD3 LYS 8 HD1 LYS 8 -18.645 -4.147 -1.779 56 HE2 LYS 8 HE2 LYS 8 -21.019 -3.794 -1.703 57 HE3 LYS 8 HE1 LYS 8 -20.812 -2.061 -1.945 58 HZ1 LYS 8 HZ1 LYS 8 -21.458 -3.193 -3.985 59 HZ2 LYS 8 HZ2 LYS 8 -20.078 -4.166 -3.910 60 HZ3 LYS 8 HZ3 LYS 8 -19.926 -2.496 -4.138 61 HA PRO 9 HA PRO 9 -13.368 0.123 1.615 62 HB2 PRO 9 HB2 PRO 9 -15.019 0.820 3.926 63 HB3 PRO 9 HB1 PRO 9 -13.985 1.849 2.927 64 HG2 PRO 9 HG2 PRO 9 -16.692 1.967 2.831 65 HG3 PRO 9 HG1 PRO 9 -15.658 2.330 1.439 66 HD2 PRO 9 HD2 PRO 9 -17.300 -0.084 2.002 67 HD3 PRO 9 HD1 PRO 9 -16.878 0.665 0.450 68 H MET 10 HN MET 10 -12.000 -1.126 2.683 69 HA MET 10 HA MET 10 -12.907 -3.279 4.315 70 HB2 MET 10 HB2 MET 10 -10.545 -3.759 4.687 71 HB3 MET 10 HB1 MET 10 -10.861 -3.481 2.983 72 HG2 MET 10 HG2 MET 10 -9.984 -1.221 3.181 73 HG3 MET 10 HG1 MET 10 -9.677 -1.501 4.891 74 HE1 MET 10 HE1 MET 10 -8.887 -2.769 1.269 75 HE2 MET 10 HE2 MET 10 -9.164 -4.279 2.138 76 HE3 MET 10 HE3 MET 10 -7.548 -3.878 1.561 77 H SER 11 HN SER 11 -12.093 -3.566 6.526 78 HA SER 11 HA SER 11 -13.182 -1.510 8.127 79 HB2 SER 11 HB2 SER 11 -12.555 -3.002 10.020 80 HB3 SER 11 HB1 SER 11 -13.438 -3.840 8.743 81 HG SER 11 HG SER 11 -11.775 -5.159 9.020 82 H TYR 12 HN TYR 12 -12.086 -0.694 10.140 83 HA TYR 12 HA TYR 12 -9.746 0.768 9.553 84 HB2 TYR 12 HB2 TYR 12 -11.408 1.412 11.283 85 HB3 TYR 12 HB1 TYR 12 -10.878 0.056 12.277 86 HD1 TYR 12 HD1 TYR 12 -8.374 0.043 12.937 87 HD2 TYR 12 HD2 TYR 12 -10.414 3.501 11.549 88 HE1 TYR 12 HE1 TYR 12 -6.671 1.462 13.997 89 HE2 TYR 12 HE2 TYR 12 -8.712 4.932 12.596 90 HH TYR 12 HH TYR 12 -5.768 3.665 13.858 91 H GLU 13 HN GLU 13 -10.266 -2.265 11.288 92 HA GLU 13 HA GLU 13 -7.661 -2.734 12.179 93 HB2 GLU 13 HB2 GLU 13 -9.660 -4.058 12.840 94 HB3 GLU 13 HB1 GLU 13 -9.671 -4.798 11.243 95 HG2 GLU 13 HG2 GLU 13 -7.490 -5.777 11.661 96 HG3 GLU 13 HG1 GLU 13 -7.438 -5.010 13.247 97 H GLU 14 HN GLU 14 -9.228 -3.569 9.118 98 HA GLU 14 HA GLU 14 -6.974 -4.961 8.073 99 HB2 GLU 14 HB2 GLU 14 -9.327 -5.451 7.498 100 HB3 GLU 14 HB1 GLU 14 -9.411 -3.910 6.650 101 HG2 GLU 14 HG2 GLU 14 -7.963 -4.614 4.999 102 HG3 GLU 14 HG1 GLU 14 -7.360 -5.966 5.942 103 H LYS 15 HN LYS 15 -8.273 -1.660 7.629 104 HA LYS 15 HA LYS 15 -6.418 -0.780 5.739 105 HB2 LYS 15 HB2 LYS 15 -7.857 0.655 7.957 106 HB3 LYS 15 HB1 LYS 15 -6.764 1.491 6.868 107 HG2 LYS 15 HG2 LYS 15 -8.122 1.016 4.988 108 HG3 LYS 15 HG1 LYS 15 -9.110 -0.111 5.931 109 HD2 LYS 15 HD2 LYS 15 -10.374 1.524 6.787 110 HD3 LYS 15 HD1 LYS 15 -8.987 2.568 7.090 111 HE2 LYS 15 HE2 LYS 15 -8.961 3.203 4.725 112 HE3 LYS 15 HE1 LYS 15 -10.358 2.166 4.430 113 HZ1 LYS 15 HZ1 LYS 15 -11.656 3.537 5.919 114 HZ2 LYS 15 HZ2 LYS 15 -10.968 4.505 4.718 115 HZ3 LYS 15 HZ3 LYS 15 -10.306 4.498 6.280 116 H ARG 16 HN ARG 16 -6.228 -0.756 9.276 117 HA ARG 16 HA ARG 16 -3.705 0.423 9.534 118 HB2 ARG 16 HB2 ARG 16 -5.277 0.063 11.419 119 HB3 ARG 16 HB1 ARG 16 -4.951 -1.667 11.335 120 HG2 ARG 16 HG2 ARG 16 -2.437 -0.705 11.569 121 HG3 ARG 16 HG1 ARG 16 -3.339 0.512 12.475 122 HD2 ARG 16 HD2 ARG 16 -2.639 -1.218 13.985 123 HD3 ARG 16 HD1 ARG 16 -4.387 -1.317 13.783 124 HE ARG 16 HE ARG 16 -2.594 -3.067 12.238 125 HH11 ARG 16 HH11 ARG 16 -5.226 -2.657 14.506 126 HH12 ARG 16 HH12 ARG 16 -5.625 -4.345 14.539 127 HH21 ARG 16 HH21 ARG 16 -3.119 -5.295 12.273 128 HH22 ARG 16 HH22 ARG 16 -4.432 -5.844 13.267 129 H GLN 17 HN GLN 17 -4.631 -3.001 9.298 130 HA GLN 17 HA GLN 17 -2.010 -3.992 9.548 131 HB2 GLN 17 HB2 GLN 17 -4.077 -5.343 9.915 132 HB3 GLN 17 HB1 GLN 17 -4.335 -5.334 8.173 133 HG2 GLN 17 HG2 GLN 17 -3.293 -7.400 8.840 134 HG3 GLN 17 HG1 GLN 17 -2.175 -6.447 7.863 135 HE21 GLN 17 HE21 GLN 17 -0.302 -7.306 8.645 136 HE22 GLN 17 HE22 GLN 17 0.221 -7.103 10.287 137 H LEU 18 HN LEU 18 -3.935 -2.995 6.822 138 HA LEU 18 HA LEU 18 -2.342 -3.905 4.722 139 HB2 LEU 18 HB2 LEU 18 -4.626 -2.497 4.894 140 HB3 LEU 18 HB1 LEU 18 -3.522 -1.194 4.509 141 HG LEU 18 HG LEU 18 -3.866 -3.675 2.834 142 HD11 LEU 18 HD11 LEU 18 -4.957 -0.917 2.342 143 HD12 LEU 18 HD12 LEU 18 -5.904 -2.279 2.926 144 HD13 LEU 18 HD13 LEU 18 -5.168 -2.335 1.326 145 HD21 LEU 18 HD21 LEU 18 -1.717 -2.709 2.468 146 HD22 LEU 18 HD22 LEU 18 -2.404 -1.093 2.363 147 HD23 LEU 18 HD23 LEU 18 -2.747 -2.281 1.110 148 H SER 19 HN SER 19 -2.181 -0.912 6.592 149 HA SER 19 HA SER 19 0.057 0.234 5.359 150 HB2 SER 19 HB2 SER 19 -1.371 1.516 6.852 151 HB3 SER 19 HB1 SER 19 -0.962 0.464 8.205 152 HG SER 19 HG SER 19 0.254 2.374 8.276 153 H LEU 20 HN LEU 20 -0.227 -2.034 8.035 154 HA LEU 20 HA LEU 20 2.538 -2.082 8.687 155 HB2 LEU 20 HB2 LEU 20 0.217 -3.865 9.338 156 HB3 LEU 20 HB1 LEU 20 1.831 -4.212 9.904 157 HG LEU 20 HG LEU 20 0.360 -1.661 10.523 158 HD11 LEU 20 HD11 LEU 20 -0.555 -3.923 11.385 159 HD12 LEU 20 HD12 LEU 20 -0.350 -2.588 12.517 160 HD13 LEU 20 HD13 LEU 20 0.844 -3.886 12.457 161 HD21 LEU 20 HD21 LEU 20 2.885 -1.673 10.576 162 HD22 LEU 20 HD22 LEU 20 2.774 -2.878 11.857 163 HD23 LEU 20 HD23 LEU 20 2.099 -1.267 12.101 164 H ASP 21 HN ASP 21 0.512 -3.891 6.506 165 HA ASP 21 HA ASP 21 2.380 -6.014 6.120 166 HB2 ASP 21 HB2 ASP 21 -0.204 -5.282 4.874 167 HB3 ASP 21 HB1 ASP 21 0.781 -6.553 4.187 168 H ILE 22 HN ILE 22 1.618 -3.030 4.425 169 HA ILE 22 HA ILE 22 3.307 -3.534 2.189 170 HB ILE 22 HB ILE 22 2.393 -0.915 3.383 171 HG12 ILE 22 HG12 ILE 22 1.522 -2.184 0.789 172 HG13 ILE 22 HG11 ILE 22 0.729 -2.581 2.318 173 HG21 ILE 22 HG21 ILE 22 4.375 -0.389 2.206 174 HG22 ILE 22 HG22 ILE 22 3.029 0.022 1.137 175 HG23 ILE 22 HG23 ILE 22 3.942 -1.462 0.872 176 HD11 ILE 22 HD11 ILE 22 0.100 -0.310 2.607 177 HD12 ILE 22 HD12 ILE 22 -0.433 -0.849 1.025 178 HD13 ILE 22 HD13 ILE 22 0.989 0.187 1.177 179 H ASN 23 HN ASN 23 3.772 -2.206 5.361 180 HA ASN 23 HA ASN 23 6.396 -1.274 5.115 181 HB2 ASN 23 HB2 ASN 23 5.198 -0.586 7.016 182 HB3 ASN 23 HB1 ASN 23 4.712 -2.225 7.421 183 HD21 ASN 23 HD21 ASN 23 7.246 0.138 7.566 184 HD22 ASN 23 HD22 ASN 23 8.231 -0.689 8.719 185 H LYS 24 HN LYS 24 5.101 -4.471 5.315 186 HA LYS 24 HA LYS 24 7.484 -5.777 6.248 187 HB2 LYS 24 HB2 LYS 24 4.923 -6.769 5.016 188 HB3 LYS 24 HB1 LYS 24 6.233 -7.854 5.462 189 HG2 LYS 24 HG2 LYS 24 6.022 -7.170 7.784 190 HG3 LYS 24 HG1 LYS 24 4.766 -6.010 7.343 191 HD2 LYS 24 HD2 LYS 24 3.379 -7.884 6.513 192 HD3 LYS 24 HD1 LYS 24 4.621 -9.011 7.063 193 HE2 LYS 24 HE2 LYS 24 3.098 -7.088 8.820 194 HE3 LYS 24 HE1 LYS 24 2.764 -8.812 8.665 195 HZ1 LYS 24 HZ1 LYS 24 4.969 -9.279 9.530 196 HZ2 LYS 24 HZ2 LYS 24 4.090 -8.337 10.625 197 HZ3 LYS 24 HZ3 LYS 24 5.293 -7.626 9.674 198 H LEU 25 HN LEU 25 6.151 -4.918 3.153 199 HA LEU 25 HA LEU 25 7.421 -6.760 1.483 200 HB2 LEU 25 HB2 LEU 25 6.653 -3.907 0.957 201 HB3 LEU 25 HB1 LEU 25 7.074 -5.047 -0.286 202 HG LEU 25 HG LEU 25 4.636 -5.009 1.455 203 HD11 LEU 25 HD11 LEU 25 5.112 -5.034 -1.504 204 HD12 LEU 25 HD12 LEU 25 4.553 -3.671 -0.541 205 HD13 LEU 25 HD13 LEU 25 3.529 -5.093 -0.739 206 HD21 LEU 25 HD21 LEU 25 5.690 -7.245 -0.223 207 HD22 LEU 25 HD22 LEU 25 4.025 -7.144 0.335 208 HD23 LEU 25 HD23 LEU 25 5.343 -7.286 1.501 209 HA PRO 26 HA PRO 26 11.727 -5.384 1.501 210 HB2 PRO 26 HB2 PRO 26 11.703 -6.750 -1.137 211 HB3 PRO 26 HB1 PRO 26 12.794 -6.979 0.237 212 HG2 PRO 26 HG2 PRO 26 10.933 -8.797 -0.343 213 HG3 PRO 26 HG1 PRO 26 11.310 -8.388 1.340 214 HD2 PRO 26 HD2 PRO 26 8.993 -7.535 -0.350 215 HD3 PRO 26 HD1 PRO 26 9.028 -7.998 1.367 216 H GLY 27 HN GLY 27 12.899 -3.798 0.351 217 HA2 GLY 27 HA2 GLY 27 11.494 -1.625 -0.466 218 HA3 GLY 27 HA1 GLY 27 13.153 -1.908 -0.939 219 H GLU 28 HN GLU 28 12.754 -4.099 -2.691 220 HA GLU 28 HA GLU 28 12.126 -2.808 -5.088 221 HB2 GLU 28 HB2 GLU 28 13.512 -4.827 -5.019 222 HB3 GLU 28 HB1 GLU 28 12.151 -5.768 -4.449 223 HG2 GLU 28 HG2 GLU 28 11.109 -4.823 -6.727 224 HG3 GLU 28 HG1 GLU 28 12.818 -4.868 -7.150 225 H LYS 29 HN LYS 29 10.260 -5.309 -3.417 226 HA LYS 29 HA LYS 29 7.943 -5.145 -4.972 227 HB2 LYS 29 HB2 LYS 29 8.503 -6.084 -2.167 228 HB3 LYS 29 HB1 LYS 29 6.898 -6.206 -2.884 229 HG2 LYS 29 HG2 LYS 29 9.379 -7.452 -4.046 230 HG3 LYS 29 HG1 LYS 29 8.227 -8.295 -3.009 231 HD2 LYS 29 HD2 LYS 29 6.447 -7.679 -4.677 232 HD3 LYS 29 HD1 LYS 29 7.734 -7.137 -5.747 233 HE2 LYS 29 HE2 LYS 29 7.106 -9.368 -6.361 234 HE3 LYS 29 HE1 LYS 29 8.718 -9.408 -5.652 235 HZ1 LYS 29 HZ1 LYS 29 7.347 -11.204 -4.824 236 HZ2 LYS 29 HZ2 LYS 29 6.195 -10.106 -4.257 237 HZ3 LYS 29 HZ3 LYS 29 7.739 -10.141 -3.569 238 H LEU 30 HN LEU 30 8.975 -3.453 -2.119 239 HA LEU 30 HA LEU 30 6.588 -2.176 -1.391 240 HB2 LEU 30 HB2 LEU 30 8.584 -2.272 0.013 241 HB3 LEU 30 HB1 LEU 30 9.463 -1.275 -1.126 242 HG LEU 30 HG LEU 30 8.291 0.651 -0.520 243 HD11 LEU 30 HD11 LEU 30 6.366 -0.757 1.257 244 HD12 LEU 30 HD12 LEU 30 6.052 -0.721 -0.470 245 HD13 LEU 30 HD13 LEU 30 6.208 0.782 0.426 246 HD21 LEU 30 HD21 LEU 30 8.505 0.708 1.943 247 HD22 LEU 30 HD22 LEU 30 9.899 -0.021 1.147 248 HD23 LEU 30 HD23 LEU 30 8.699 -1.044 1.937 249 H GLY 31 HN GLY 31 9.069 -1.220 -3.752 250 HA2 GLY 31 HA2 GLY 31 8.210 1.387 -4.254 251 HA3 GLY 31 HA1 GLY 31 9.021 0.366 -5.424 252 H ARG 32 HN ARG 32 6.757 -1.618 -5.231 253 HA ARG 32 HA ARG 32 5.176 -0.658 -7.369 254 HB2 ARG 32 HB2 ARG 32 5.521 -3.067 -6.908 255 HB3 ARG 32 HB1 ARG 32 4.596 -2.892 -5.426 256 HG2 ARG 32 HG2 ARG 32 3.183 -3.881 -7.091 257 HG3 ARG 32 HG1 ARG 32 2.631 -2.234 -6.793 258 HD2 ARG 32 HD2 ARG 32 2.679 -2.786 -9.202 259 HD3 ARG 32 HD1 ARG 32 3.743 -1.443 -8.788 260 HE ARG 32 HE ARG 32 5.257 -3.783 -8.686 261 HH11 ARG 32 HH11 ARG 32 3.526 -1.897 -11.068 262 HH12 ARG 32 HH12 ARG 32 4.598 -2.316 -12.363 263 HH21 ARG 32 HH21 ARG 32 6.685 -4.319 -10.376 264 HH22 ARG 32 HH22 ARG 32 6.394 -3.704 -11.971 265 H VAL 33 HN VAL 33 4.506 -1.046 -3.911 266 HA VAL 33 HA VAL 33 1.779 -0.263 -4.082 267 HB VAL 33 HB VAL 33 3.101 0.201 -1.496 268 HG11 VAL 33 HG11 VAL 33 0.787 -1.520 -2.371 269 HG12 VAL 33 HG12 VAL 33 0.683 0.154 -1.819 270 HG13 VAL 33 HG13 VAL 33 1.212 -1.105 -0.710 271 HG21 VAL 33 HG21 VAL 33 4.526 -1.589 -2.095 272 HG22 VAL 33 HG22 VAL 33 3.206 -2.480 -2.850 273 HG23 VAL 33 HG23 VAL 33 3.253 -2.293 -1.099 274 H VAL 34 HN VAL 34 4.678 1.493 -2.995 275 HA VAL 34 HA VAL 34 3.506 3.952 -2.448 276 HB VAL 34 HB VAL 34 5.666 4.380 -2.006 277 HG11 VAL 34 HG11 VAL 34 6.125 2.025 -2.244 278 HG12 VAL 34 HG12 VAL 34 7.498 3.008 -2.762 279 HG13 VAL 34 HG13 VAL 34 6.447 2.255 -3.962 280 HG21 VAL 34 HG21 VAL 34 5.501 5.826 -3.986 281 HG22 VAL 34 HG22 VAL 34 6.107 4.514 -4.987 282 HG23 VAL 34 HG23 VAL 34 7.136 5.225 -3.744 283 H HIS 35 HN HIS 35 4.470 2.562 -5.519 284 HA HIS 35 HA HIS 35 3.752 4.778 -7.138 285 HB2 HIS 35 HB2 HIS 35 5.265 3.041 -7.946 286 HB3 HIS 35 HB1 HIS 35 3.979 1.845 -7.831 287 HD1 HIS 35 HD1 HIS 35 4.865 4.974 -9.778 288 HD2 HIS 35 HD2 HIS 35 2.460 1.599 -10.098 289 HE1 HIS 35 HE1 HIS 35 3.897 5.050 -12.094 290 HE2 HIS 35 HE2 HIS 35 2.335 3.081 -12.215 291 H ILE 36 HN ILE 36 2.002 1.848 -6.150 292 HA ILE 36 HA ILE 36 -0.267 2.181 -7.736 293 HB ILE 36 HB ILE 36 -0.199 0.974 -4.962 294 HG12 ILE 36 HG12 ILE 36 0.232 -0.248 -7.693 295 HG13 ILE 36 HG11 ILE 36 1.380 -0.182 -6.369 296 HG21 ILE 36 HG21 ILE 36 -2.413 0.816 -5.209 297 HG22 ILE 36 HG22 ILE 36 -2.111 -0.295 -6.545 298 HG23 ILE 36 HG23 ILE 36 -2.325 1.424 -6.864 299 HD11 ILE 36 HD11 ILE 36 -0.153 -1.649 -5.064 300 HD12 ILE 36 HD12 ILE 36 0.530 -2.394 -6.507 301 HD13 ILE 36 HD13 ILE 36 -1.134 -1.814 -6.518 302 H ILE 37 HN ILE 37 0.249 3.293 -4.370 303 HA ILE 37 HA ILE 37 -2.291 4.479 -4.117 304 HB ILE 37 HB ILE 37 0.237 5.259 -2.656 305 HG12 ILE 37 HG12 ILE 37 -1.573 3.869 -0.990 306 HG13 ILE 37 HG11 ILE 37 -1.461 2.937 -2.477 307 HG21 ILE 37 HG21 ILE 37 -1.947 6.748 -2.789 308 HG22 ILE 37 HG22 ILE 37 -1.014 6.593 -1.297 309 HG23 ILE 37 HG23 ILE 37 -2.480 5.636 -1.525 310 HD11 ILE 37 HD11 ILE 37 0.912 2.750 -2.240 311 HD12 ILE 37 HD12 ILE 37 0.132 2.230 -0.746 312 HD13 ILE 37 HD13 ILE 37 0.889 3.818 -0.840 313 H GLN 38 HN GLN 38 0.842 5.940 -4.916 314 HA GLN 38 HA GLN 38 -0.010 8.569 -5.241 315 HB2 GLN 38 HB2 GLN 38 2.245 7.019 -6.486 316 HB3 GLN 38 HB1 GLN 38 1.998 8.721 -6.856 317 HG2 GLN 38 HG2 GLN 38 1.949 8.733 -4.116 318 HG3 GLN 38 HG1 GLN 38 3.084 7.436 -4.454 319 HE21 GLN 38 HE21 GLN 38 4.735 8.721 -3.549 320 HE22 GLN 38 HE22 GLN 38 5.454 10.018 -4.439 321 H SER 39 HN SER 39 -0.229 5.870 -7.445 322 HA SER 39 HA SER 39 -0.940 7.487 -9.702 323 HB2 SER 39 HB2 SER 39 0.192 5.306 -9.947 324 HB3 SER 39 HB1 SER 39 -1.241 4.506 -9.298 325 HG SER 39 HG SER 39 -1.864 4.454 -11.295 326 H ARG 40 HN ARG 40 -2.725 5.472 -7.381 327 HA ARG 40 HA ARG 40 -5.224 5.925 -8.746 328 HB2 ARG 40 HB2 ARG 40 -4.782 4.740 -6.013 329 HB3 ARG 40 HB1 ARG 40 -6.237 4.610 -6.991 330 HG2 ARG 40 HG2 ARG 40 -4.557 3.520 -8.714 331 HG3 ARG 40 HG1 ARG 40 -3.650 3.185 -7.239 332 HD2 ARG 40 HD2 ARG 40 -5.081 1.321 -7.766 333 HD3 ARG 40 HD1 ARG 40 -5.596 2.117 -6.284 334 HE ARG 40 HE ARG 40 -7.212 3.305 -7.983 335 HH11 ARG 40 HH11 ARG 40 -6.298 -0.078 -7.892 336 HH12 ARG 40 HH12 ARG 40 -7.797 -0.635 -8.555 337 HH21 ARG 40 HH21 ARG 40 -9.187 2.581 -8.858 338 HH22 ARG 40 HH22 ARG 40 -9.454 0.878 -9.110 339 H GLU 41 HN GLU 41 -3.574 7.215 -5.944 340 HA GLU 41 HA GLU 41 -5.811 9.074 -5.499 341 HB2 GLU 41 HB2 GLU 41 -3.446 8.525 -3.720 342 HB3 GLU 41 HB1 GLU 41 -4.830 9.526 -3.324 343 HG2 GLU 41 HG2 GLU 41 -4.790 6.546 -3.713 344 HG3 GLU 41 HG1 GLU 41 -5.005 7.424 -2.204 345 HA PRO 42 HA PRO 42 -2.738 11.687 -7.744 346 HB2 PRO 42 HB2 PRO 42 -5.144 13.276 -8.329 347 HB3 PRO 42 HB1 PRO 42 -3.952 12.594 -9.437 348 HG2 PRO 42 HG2 PRO 42 -6.437 11.597 -9.251 349 HG3 PRO 42 HG1 PRO 42 -5.031 10.563 -9.564 350 HD2 PRO 42 HD2 PRO 42 -6.530 11.000 -7.010 351 HD3 PRO 42 HD1 PRO 42 -5.873 9.494 -7.693 352 H SER 43 HN SER 43 -4.789 12.143 -5.107 353 HA SER 43 HA SER 43 -4.341 14.925 -4.665 354 HB2 SER 43 HB2 SER 43 -5.239 12.824 -2.685 355 HB3 SER 43 HB1 SER 43 -5.487 14.567 -2.571 356 HG SER 43 HG SER 43 -6.972 14.483 -4.158 357 H LEU 44 HN LEU 44 -2.473 12.099 -4.113 358 HA LEU 44 HA LEU 44 -0.720 13.638 -2.319 359 HB2 LEU 44 HB2 LEU 44 -0.032 11.494 -1.278 360 HB3 LEU 44 HB1 LEU 44 -1.696 11.938 -0.976 361 HG LEU 44 HG LEU 44 -2.114 10.331 -3.052 362 HD11 LEU 44 HD11 LEU 44 0.307 9.927 -3.369 363 HD12 LEU 44 HD12 LEU 44 -0.619 8.456 -3.070 364 HD13 LEU 44 HD13 LEU 44 0.353 9.165 -1.779 365 HD21 LEU 44 HD21 LEU 44 -3.106 10.105 -0.844 366 HD22 LEU 44 HD22 LEU 44 -1.607 9.412 -0.229 367 HD23 LEU 44 HD23 LEU 44 -2.546 8.543 -1.440 368 H LYS 45 HN LYS 45 -0.828 12.956 -5.339 369 HA LYS 45 HA LYS 45 1.565 11.442 -5.765 370 HB2 LYS 45 HB2 LYS 45 1.281 11.849 -8.090 371 HB3 LYS 45 HB1 LYS 45 -0.327 11.629 -7.425 372 HG2 LYS 45 HG2 LYS 45 -0.552 14.112 -7.376 373 HG3 LYS 45 HG1 LYS 45 0.988 14.202 -8.237 374 HD2 LYS 45 HD2 LYS 45 -0.128 12.572 -9.906 375 HD3 LYS 45 HD1 LYS 45 -1.639 13.123 -9.176 376 HE2 LYS 45 HE2 LYS 45 -1.031 15.438 -9.678 377 HE3 LYS 45 HE1 LYS 45 0.470 14.875 -10.409 378 HZ1 LYS 45 HZ1 LYS 45 -2.265 14.212 -11.363 379 HZ2 LYS 45 HZ2 LYS 45 -0.819 13.704 -12.080 380 HZ3 LYS 45 HZ3 LYS 45 -1.229 15.344 -12.071 381 H ASN 46 HN ASN 46 1.019 14.542 -4.711 382 HA ASN 46 HA ASN 46 3.344 15.798 -5.845 383 HB2 ASN 46 HB2 ASN 46 2.813 17.681 -4.479 384 HB3 ASN 46 HB1 ASN 46 1.275 17.029 -5.032 385 HD21 ASN 46 HD21 ASN 46 -0.075 15.974 -3.544 386 HD22 ASN 46 HD22 ASN 46 0.141 16.146 -1.838 387 H SER 47 HN SER 47 2.844 13.507 -3.454 388 HA SER 47 HA SER 47 4.793 14.329 -1.547 389 HB2 SER 47 HB2 SER 47 3.756 11.513 -2.008 390 HB3 SER 47 HB1 SER 47 4.431 12.186 -0.521 391 HG SER 47 HG SER 47 1.905 12.494 -1.642 392 H ASN 48 HN ASN 48 6.967 13.960 -1.522 393 HA ASN 48 HA ASN 48 8.368 13.162 -3.815 394 HB2 ASN 48 HB2 ASN 48 9.332 13.055 -0.937 395 HB3 ASN 48 HB1 ASN 48 10.359 13.030 -2.364 396 HD21 ASN 48 HD21 ASN 48 10.454 14.861 -0.196 397 HD22 ASN 48 HD22 ASN 48 10.143 16.435 -0.836 398 HA PRO 49 HA PRO 49 7.542 8.857 -3.859 399 HB2 PRO 49 HB2 PRO 49 9.759 8.024 -5.266 400 HB3 PRO 49 HB1 PRO 49 8.301 8.698 -5.991 401 HG2 PRO 49 HG2 PRO 49 10.900 10.031 -5.367 402 HG3 PRO 49 HG1 PRO 49 9.852 10.227 -6.783 403 HD2 PRO 49 HD2 PRO 49 9.903 12.041 -4.810 404 HD3 PRO 49 HD1 PRO 49 8.400 11.651 -5.668 405 H ASP 50 HN ASP 50 10.531 10.089 -2.575 406 HA ASP 50 HA ASP 50 11.371 7.553 -1.508 407 HB2 ASP 50 HB2 ASP 50 12.418 10.255 -0.676 408 HB3 ASP 50 HB1 ASP 50 13.240 8.704 -0.594 409 H GLU 51 HN GLU 51 9.476 10.258 -0.470 410 HA GLU 51 HA GLU 51 9.105 9.064 2.196 411 HB2 GLU 51 HB2 GLU 51 9.856 11.880 1.454 412 HB3 GLU 51 HB1 GLU 51 8.848 11.629 2.869 413 HG2 GLU 51 HG2 GLU 51 10.563 10.304 3.905 414 HG3 GLU 51 HG1 GLU 51 11.541 10.363 2.445 415 H ILE 52 HN ILE 52 7.167 8.274 0.827 416 HA ILE 52 HA ILE 52 5.439 10.329 -0.187 417 HB ILE 52 HB ILE 52 4.195 8.681 -1.248 418 HG12 ILE 52 HG12 ILE 52 5.387 6.501 0.400 419 HG13 ILE 52 HG11 ILE 52 3.921 7.340 0.911 420 HG21 ILE 52 HG21 ILE 52 6.846 7.307 -1.013 421 HG22 ILE 52 HG22 ILE 52 6.643 8.826 -1.898 422 HG23 ILE 52 HG23 ILE 52 5.768 7.382 -2.414 423 HD11 ILE 52 HD11 ILE 52 2.861 6.725 -1.211 424 HD12 ILE 52 HD12 ILE 52 3.359 5.311 -0.275 425 HD13 ILE 52 HD13 ILE 52 4.315 5.831 -1.660 426 H GLU 53 HN GLU 53 3.373 10.817 0.442 427 HA GLU 53 HA GLU 53 2.845 10.309 3.280 428 HB2 GLU 53 HB2 GLU 53 3.126 12.649 1.923 429 HB3 GLU 53 HB1 GLU 53 1.392 12.423 1.808 430 HG2 GLU 53 HG2 GLU 53 3.078 12.768 4.257 431 HG3 GLU 53 HG1 GLU 53 1.754 13.774 3.686 432 H ILE 54 HN ILE 54 1.428 8.651 3.477 433 HA ILE 54 HA ILE 54 -0.795 8.450 1.541 434 HB ILE 54 HB ILE 54 0.291 6.344 3.417 435 HG12 ILE 54 HG12 ILE 54 0.396 6.449 0.400 436 HG13 ILE 54 HG11 ILE 54 1.742 6.903 1.446 437 HG21 ILE 54 HG21 ILE 54 -1.206 4.836 2.110 438 HG22 ILE 54 HG22 ILE 54 -1.926 6.266 1.381 439 HG23 ILE 54 HG23 ILE 54 -2.054 6.002 3.121 440 HD11 ILE 54 HD11 ILE 54 1.849 4.597 0.510 441 HD12 ILE 54 HD12 ILE 54 0.440 4.196 1.487 442 HD13 ILE 54 HD13 ILE 54 1.946 4.685 2.262 443 H ASP 55 HN ASP 55 -2.880 8.617 2.219 444 HA ASP 55 HA ASP 55 -3.304 8.797 5.135 445 HB2 ASP 55 HB2 ASP 55 -3.584 10.989 3.886 446 HB3 ASP 55 HB1 ASP 55 -4.951 10.247 3.058 447 H PHE 56 HN PHE 56 -3.999 6.773 5.535 448 HA PHE 56 HA PHE 56 -5.263 5.170 3.621 449 HB2 PHE 56 HB2 PHE 56 -4.371 4.900 6.364 450 HB3 PHE 56 HB1 PHE 56 -5.819 3.950 6.023 451 HD1 PHE 56 HD1 PHE 56 -2.304 4.508 5.088 452 HD2 PHE 56 HD2 PHE 56 -5.765 2.111 4.561 453 HE1 PHE 56 HE1 PHE 56 -0.960 2.832 3.890 454 HE2 PHE 56 HE2 PHE 56 -4.448 0.440 3.376 455 HZ PHE 56 HZ PHE 56 -2.040 0.774 3.038 456 H GLU 57 HN GLU 57 -6.629 7.524 5.660 457 HA GLU 57 HA GLU 57 -9.234 6.240 5.705 458 HB2 GLU 57 HB2 GLU 57 -8.200 8.820 6.849 459 HB3 GLU 57 HB1 GLU 57 -9.874 8.298 6.993 460 HG2 GLU 57 HG2 GLU 57 -7.505 6.734 7.992 461 HG3 GLU 57 HG1 GLU 57 -8.482 7.812 8.986 462 H THR 58 HN THR 58 -7.564 7.924 3.455 463 HA THR 58 HA THR 58 -10.042 9.070 2.347 464 HB THR 58 HB THR 58 -8.687 10.839 1.270 465 HG1 THR 58 HG1 THR 58 -6.620 9.677 2.857 466 HG21 THR 58 HG21 THR 58 -8.539 10.646 4.269 467 HG22 THR 58 HG22 THR 58 -9.825 11.383 3.312 468 HG23 THR 58 HG23 THR 58 -8.225 12.123 3.359 469 H LEU 59 HN LEU 59 -7.595 6.825 1.909 470 HA LEU 59 HA LEU 59 -7.316 6.917 -0.929 471 HB2 LEU 59 HB2 LEU 59 -7.208 4.309 0.543 472 HB3 LEU 59 HB1 LEU 59 -6.265 4.850 -0.821 473 HG LEU 59 HG LEU 59 -5.917 5.720 2.039 474 HD11 LEU 59 HD11 LEU 59 -4.399 3.881 0.223 475 HD12 LEU 59 HD12 LEU 59 -5.007 3.588 1.852 476 HD13 LEU 59 HD13 LEU 59 -3.633 4.664 1.605 477 HD21 LEU 59 HD21 LEU 59 -4.656 6.698 -0.494 478 HD22 LEU 59 HD22 LEU 59 -3.820 6.805 1.045 479 HD23 LEU 59 HD23 LEU 59 -5.362 7.627 0.819 480 H LYS 60 HN LYS 60 -8.504 5.905 -2.506 481 HA LYS 60 HA LYS 60 -11.239 5.367 -2.042 482 HB2 LYS 60 HB2 LYS 60 -9.502 4.503 -4.369 483 HB3 LYS 60 HB1 LYS 60 -11.256 4.652 -4.383 484 HG2 LYS 60 HG2 LYS 60 -11.061 7.064 -4.076 485 HG3 LYS 60 HG1 LYS 60 -9.302 6.923 -4.014 486 HD2 LYS 60 HD2 LYS 60 -9.332 6.006 -6.307 487 HD3 LYS 60 HD1 LYS 60 -11.078 6.270 -6.362 488 HE2 LYS 60 HE2 LYS 60 -9.967 8.108 -7.454 489 HE3 LYS 60 HE1 LYS 60 -10.690 8.674 -5.951 490 HZ1 LYS 60 HZ1 LYS 60 -7.820 8.079 -6.439 491 HZ2 LYS 60 HZ2 LYS 60 -8.459 8.432 -4.911 492 HZ3 LYS 60 HZ3 LYS 60 -8.515 9.596 -6.141 493 HA PRO 61 HA PRO 61 -11.309 1.224 -0.466 494 HB2 PRO 61 HB2 PRO 61 -13.474 0.712 -2.426 495 HB3 PRO 61 HB1 PRO 61 -13.487 0.532 -0.672 496 HG2 PRO 61 HG2 PRO 61 -14.748 2.554 -1.947 497 HG3 PRO 61 HG1 PRO 61 -14.069 2.728 -0.322 498 HD2 PRO 61 HD2 PRO 61 -13.090 3.807 -2.904 499 HD3 PRO 61 HD1 PRO 61 -12.842 4.413 -1.255 500 H SER 62 HN SER 62 -11.442 1.768 -3.925 501 HA SER 62 HA SER 62 -10.702 -0.863 -4.698 502 HB2 SER 62 HB2 SER 62 -10.126 0.370 -6.889 503 HB3 SER 62 HB1 SER 62 -11.800 0.425 -6.337 504 HG SER 62 HG SER 62 -10.649 2.481 -7.009 505 H THR 63 HN THR 63 -8.933 2.110 -4.038 506 HA THR 63 HA THR 63 -6.382 1.245 -4.815 507 HB THR 63 HB THR 63 -6.842 3.129 -2.483 508 HG1 THR 63 HG1 THR 63 -7.193 4.767 -4.043 509 HG21 THR 63 HG21 THR 63 -4.530 2.473 -3.125 510 HG22 THR 63 HG22 THR 63 -4.843 4.196 -3.306 511 HG23 THR 63 HG23 THR 63 -4.812 3.149 -4.724 512 H LEU 64 HN LEU 64 -8.040 1.152 -1.690 513 HA LEU 64 HA LEU 64 -6.031 -0.042 -0.178 514 HB2 LEU 64 HB2 LEU 64 -9.031 -0.208 0.045 515 HB3 LEU 64 HB1 LEU 64 -7.949 -0.899 1.238 516 HG LEU 64 HG LEU 64 -7.992 2.027 0.518 517 HD11 LEU 64 HD11 LEU 64 -10.118 1.300 1.563 518 HD12 LEU 64 HD12 LEU 64 -9.182 2.382 2.589 519 HD13 LEU 64 HD13 LEU 64 -9.192 0.651 2.914 520 HD21 LEU 64 HD21 LEU 64 -5.880 1.367 1.393 521 HD22 LEU 64 HD22 LEU 64 -6.648 0.455 2.688 522 HD23 LEU 64 HD23 LEU 64 -6.762 2.215 2.659 523 H ARG 65 HN ARG 65 -8.512 -1.566 -2.193 524 HA ARG 65 HA ARG 65 -7.804 -4.193 -1.268 525 HB2 ARG 65 HB2 ARG 65 -9.818 -3.061 -3.088 526 HB3 ARG 65 HB1 ARG 65 -9.300 -4.678 -3.477 527 HG2 ARG 65 HG2 ARG 65 -10.467 -3.760 -0.872 528 HG3 ARG 65 HG1 ARG 65 -11.294 -4.751 -2.084 529 HD2 ARG 65 HD2 ARG 65 -9.655 -6.541 -1.690 530 HD3 ARG 65 HD1 ARG 65 -8.868 -5.551 -0.459 531 HE ARG 65 HE ARG 65 -11.710 -6.260 -0.197 532 HH11 ARG 65 HH11 ARG 65 -8.424 -6.623 0.993 533 HH12 ARG 65 HH12 ARG 65 -8.937 -7.032 2.608 534 HH21 ARG 65 HH21 ARG 65 -12.362 -6.826 1.905 535 HH22 ARG 65 HH22 ARG 65 -11.162 -7.153 3.120 536 H GLU 66 HN GLU 66 -6.620 -2.069 -3.652 537 HA GLU 66 HA GLU 66 -5.317 -4.156 -5.169 538 HB2 GLU 66 HB2 GLU 66 -5.925 -2.259 -6.436 539 HB3 GLU 66 HB1 GLU 66 -5.276 -1.148 -5.239 540 HG2 GLU 66 HG2 GLU 66 -3.809 -1.096 -7.063 541 HG3 GLU 66 HG1 GLU 66 -3.000 -2.038 -5.814 542 H LEU 67 HN LEU 67 -4.536 -1.765 -2.710 543 HA LEU 67 HA LEU 67 -1.760 -2.230 -2.615 544 HB2 LEU 67 HB2 LEU 67 -3.602 -1.351 -0.387 545 HB3 LEU 67 HB1 LEU 67 -1.869 -1.083 -0.448 546 HG LEU 67 HG LEU 67 -3.946 0.169 -2.254 547 HD11 LEU 67 HD11 LEU 67 -2.160 1.384 -0.159 548 HD12 LEU 67 HD12 LEU 67 -3.876 1.033 0.050 549 HD13 LEU 67 HD13 LEU 67 -3.358 2.226 -1.141 550 HD21 LEU 67 HD21 LEU 67 -1.740 -0.351 -3.333 551 HD22 LEU 67 HD22 LEU 67 -1.007 0.756 -2.175 552 HD23 LEU 67 HD23 LEU 67 -2.208 1.347 -3.318 553 H GLU 68 HN GLU 68 -4.529 -3.504 -0.847 554 HA GLU 68 HA GLU 68 -3.003 -5.123 0.927 555 HB2 GLU 68 HB2 GLU 68 -5.223 -4.267 1.512 556 HB3 GLU 68 HB1 GLU 68 -5.944 -5.235 0.238 557 HG2 GLU 68 HG2 GLU 68 -4.328 -6.662 2.258 558 HG3 GLU 68 HG1 GLU 68 -5.872 -5.995 2.775 559 H ARG 69 HN ARG 69 -5.160 -5.981 -1.815 560 HA ARG 69 HA ARG 69 -4.686 -8.706 -1.854 561 HB2 ARG 69 HB2 ARG 69 -6.315 -7.606 -3.327 562 HB3 ARG 69 HB1 ARG 69 -4.994 -6.939 -4.282 563 HG2 ARG 69 HG2 ARG 69 -4.266 -9.403 -4.533 564 HG3 ARG 69 HG1 ARG 69 -5.924 -9.759 -4.057 565 HD2 ARG 69 HD2 ARG 69 -5.609 -9.656 -6.517 566 HD3 ARG 69 HD1 ARG 69 -6.807 -8.519 -5.902 567 HE ARG 69 HE ARG 69 -4.476 -7.089 -5.983 568 HH11 ARG 69 HH11 ARG 69 -6.305 -8.931 -8.323 569 HH12 ARG 69 HH12 ARG 69 -5.870 -7.911 -9.657 570 HH21 ARG 69 HH21 ARG 69 -3.892 -5.735 -7.726 571 HH22 ARG 69 HH22 ARG 69 -4.482 -6.108 -9.320 572 H TYR 70 HN TYR 70 -2.651 -6.132 -2.994 573 HA TYR 70 HA TYR 70 -0.885 -7.847 -4.458 574 HB2 TYR 70 HB2 TYR 70 -0.994 -5.589 -5.197 575 HB3 TYR 70 HB1 TYR 70 -0.692 -4.968 -3.577 576 HD1 TYR 70 HD2 TYR 70 0.902 -6.847 -6.365 577 HD2 TYR 70 HD1 TYR 70 1.463 -4.513 -2.858 578 HE1 TYR 70 HE2 TYR 70 3.308 -6.763 -6.826 579 HE2 TYR 70 HE1 TYR 70 3.882 -4.414 -3.314 580 HH TYR 70 HH TYR 70 5.249 -5.412 -6.281 581 H VAL 71 HN VAL 71 -0.629 -6.132 -1.328 582 HA VAL 71 HA VAL 71 1.948 -7.163 -0.796 583 HB VAL 71 HB VAL 71 1.688 -6.379 1.483 584 HG11 VAL 71 HG11 VAL 71 0.527 -4.045 0.371 585 HG12 VAL 71 HG12 VAL 71 1.499 -4.831 -0.867 586 HG13 VAL 71 HG13 VAL 71 2.224 -4.393 0.678 587 HG21 VAL 71 HG21 VAL 71 -0.485 -6.851 2.146 588 HG22 VAL 71 HG22 VAL 71 -1.192 -6.059 0.738 589 HG23 VAL 71 HG23 VAL 71 -0.458 -5.091 2.019 590 H THR 72 HN THR 72 -1.277 -8.218 0.255 591 HA THR 72 HA THR 72 -0.448 -10.224 2.005 592 HB THR 72 HB THR 72 -2.807 -9.377 1.722 593 HG1 THR 72 HG1 THR 72 -3.272 -11.098 2.838 594 HG21 THR 72 HG21 THR 72 -2.836 -9.689 -0.760 595 HG22 THR 72 HG22 THR 72 -4.242 -10.332 0.082 596 HG23 THR 72 HG23 THR 72 -2.974 -11.421 -0.483 597 H SER 73 HN SER 73 -0.613 -10.171 -1.473 598 HA SER 73 HA SER 73 -0.251 -12.957 -1.841 599 HB2 SER 73 HB2 SER 73 0.102 -10.642 -3.668 600 HB3 SER 73 HB1 SER 73 0.242 -12.312 -4.193 601 HG SER 73 HG SER 73 -2.004 -10.820 -3.475 602 H CYS 74 HN CYS 74 1.872 -10.333 -1.177 603 HA CYS 74 HA CYS 74 4.217 -11.803 -2.062 604 HB2 CYS 74 HB2 CYS 74 4.146 -9.391 -2.483 605 HB3 CYS 74 HB1 CYS 74 3.988 -9.084 -0.755 606 HG CYS 74 HG CYS 74 6.585 -10.669 -0.554 607 H LEU 75 HN LEU 75 2.966 -10.427 0.974 608 HA LEU 75 HA LEU 75 4.831 -11.383 2.773 609 HB2 LEU 75 HB2 LEU 75 1.929 -11.497 3.469 610 HB3 LEU 75 HB1 LEU 75 3.274 -10.936 4.436 611 HG LEU 75 HG LEU 75 2.261 -9.432 2.049 612 HD11 LEU 75 HD11 LEU 75 1.638 -8.725 4.874 613 HD12 LEU 75 HD12 LEU 75 0.611 -9.846 3.987 614 HD13 LEU 75 HD13 LEU 75 0.848 -8.207 3.386 615 HD21 LEU 75 HD21 LEU 75 4.567 -9.027 2.840 616 HD22 LEU 75 HD22 LEU 75 3.910 -8.572 4.413 617 HD23 LEU 75 HD23 LEU 75 3.515 -7.619 2.981 618 H ARG 76 HN ARG 76 2.047 -13.000 1.390 619 HA ARG 76 HA ARG 76 2.490 -15.389 2.986 620 HB2 ARG 76 HB2 ARG 76 0.280 -14.516 1.132 621 HB3 ARG 76 HB1 ARG 76 0.342 -16.122 1.856 622 HG2 ARG 76 HG2 ARG 76 0.042 -15.285 4.008 623 HG3 ARG 76 HG1 ARG 76 0.509 -13.651 3.534 624 HD2 ARG 76 HD2 ARG 76 -1.523 -13.351 2.310 625 HD3 ARG 76 HD1 ARG 76 -1.964 -15.046 2.545 626 HE ARG 76 HE ARG 76 -2.797 -14.510 4.593 627 HH11 ARG 76 HH11 ARG 76 -0.617 -11.937 3.640 628 HH12 ARG 76 HH12 ARG 76 -0.960 -10.963 5.035 629 HH21 ARG 76 HH21 ARG 76 -3.241 -13.221 6.421 630 HH22 ARG 76 HH22 ARG 76 -2.449 -11.687 6.601 631 H LYS 77 HN LYS 77 4.442 -14.688 1.022 632 HA LYS 77 HA LYS 77 4.410 -17.130 -0.594 633 HB2 LYS 77 HB2 LYS 77 3.402 -15.245 -2.043 634 HB3 LYS 77 HB1 LYS 77 5.004 -14.503 -1.973 635 HG2 LYS 77 HG2 LYS 77 5.897 -16.627 -2.932 636 HG3 LYS 77 HG1 LYS 77 4.233 -17.150 -3.159 637 HD2 LYS 77 HD2 LYS 77 3.819 -15.116 -4.516 638 HD3 LYS 77 HD1 LYS 77 5.529 -14.713 -4.376 639 HE2 LYS 77 HE2 LYS 77 6.114 -16.810 -5.490 640 HE3 LYS 77 HE1 LYS 77 4.404 -17.212 -5.629 641 HZ1 LYS 77 HZ1 LYS 77 5.743 -14.876 -6.885 642 HZ2 LYS 77 HZ2 LYS 77 4.097 -15.243 -7.005 643 HZ3 LYS 77 HZ3 LYS 77 5.244 -16.282 -7.684 644 H LYS 78 HN LYS 78 6.712 -17.254 -1.732 645 HA LYS 78 HA LYS 78 8.553 -17.439 0.315 646 HB2 LYS 78 HB2 LYS 78 8.513 -18.216 -2.314 647 HB3 LYS 78 HB1 LYS 78 9.801 -17.015 -2.302 648 HG2 LYS 78 HG2 LYS 78 10.765 -19.162 -1.920 649 HG3 LYS 78 HG1 LYS 78 10.849 -18.230 -0.425 650 HD2 LYS 78 HD2 LYS 78 8.828 -19.402 0.383 651 HD3 LYS 78 HD1 LYS 78 8.834 -20.374 -1.088 652 HE2 LYS 78 HE2 LYS 78 11.061 -20.270 0.940 653 HE3 LYS 78 HE1 LYS 78 9.844 -21.539 0.840 654 HZ1 LYS 78 HZ1 LYS 78 10.646 -22.079 -1.376 655 HZ2 LYS 78 HZ2 LYS 78 11.896 -22.197 -0.243 656 HZ3 LYS 78 HZ3 LYS 78 11.815 -20.861 -1.274 657 H ARG 79 HN ARG 79 8.269 -14.852 -2.084 658 HA ARG 79 HA ARG 79 9.358 -12.895 -2.362 659 HB2 ARG 79 HB2 ARG 79 9.227 -11.412 -0.250 660 HB3 ARG 79 HB1 ARG 79 7.754 -11.962 -1.022 661 HG2 ARG 79 HG2 ARG 79 7.255 -12.286 1.185 662 HG3 ARG 79 HG1 ARG 79 7.876 -13.876 0.750 663 HD2 ARG 79 HD2 ARG 79 10.077 -13.222 1.650 664 HD3 ARG 79 HD1 ARG 79 9.392 -11.677 2.148 665 HE ARG 79 HE ARG 79 7.958 -13.938 3.186 666 HH11 ARG 79 HH11 ARG 79 10.725 -11.846 3.692 667 HH12 ARG 79 HH12 ARG 79 10.774 -12.113 5.404 668 HH21 ARG 79 HH21 ARG 79 8.035 -14.298 5.444 669 HH22 ARG 79 HH22 ARG 79 9.252 -13.508 6.397 670 H LYS 80 HN LYS 80 11.406 -13.459 -2.931 671 HA LYS 80 HA LYS 80 13.432 -12.785 -0.948 672 HB2 LYS 80 HB2 LYS 80 14.873 -14.686 -1.785 673 HB3 LYS 80 HB1 LYS 80 13.522 -15.142 -0.763 674 HG2 LYS 80 HG2 LYS 80 12.315 -16.031 -2.563 675 HG3 LYS 80 HG1 LYS 80 13.335 -15.222 -3.754 676 HD2 LYS 80 HD2 LYS 80 13.818 -17.625 -3.608 677 HD3 LYS 80 HD1 LYS 80 15.209 -16.642 -3.153 678 HE2 LYS 80 HE2 LYS 80 14.648 -16.991 -0.780 679 HE3 LYS 80 HE1 LYS 80 13.300 -18.020 -1.266 680 HZ1 LYS 80 HZ1 LYS 80 14.880 -19.520 -2.320 681 HZ2 LYS 80 HZ2 LYS 80 15.234 -19.331 -0.677 682 HZ3 LYS 80 HZ3 LYS 80 16.168 -18.537 -1.838 683 HA PRO 81 HA PRO 81 13.893 -10.763 -5.120 684 HB2 PRO 81 HB2 PRO 81 14.581 -8.327 -3.980 685 HB3 PRO 81 HB1 PRO 81 12.982 -8.765 -4.579 686 HG2 PRO 81 HG2 PRO 81 13.986 -8.612 -1.811 687 HG3 PRO 81 HG1 PRO 81 12.336 -8.452 -2.425 688 HD2 PRO 81 HD2 PRO 81 13.325 -10.661 -1.092 689 HD3 PRO 81 HD1 PRO 81 11.903 -10.672 -2.156 690 H GLN 82 HN GLN 82 15.756 -11.722 -5.733 691 HA GLN 82 HA GLN 82 18.256 -10.685 -4.561 692 HB2 GLN 82 HB2 GLN 82 17.771 -13.541 -5.442 693 HB3 GLN 82 HB1 GLN 82 19.263 -12.899 -4.770 694 HG2 GLN 82 HG2 GLN 82 18.277 -12.608 -2.632 695 HG3 GLN 82 HG1 GLN 82 16.662 -12.934 -3.266 696 HE21 GLN 82 HE21 GLN 82 18.047 -14.246 -1.104 697 HE22 GLN 82 HE22 GLN 82 18.158 -15.919 -1.534 698 H ALA 83 HN ALA 83 16.446 -10.407 -7.077 699 HA ALA 83 HA ALA 83 18.631 -10.176 -8.963 700 HB1 ALA 83 HB1 ALA 83 16.254 -11.934 -9.575 701 HB2 ALA 83 HB2 ALA 83 17.904 -12.491 -9.295 702 HB3 ALA 83 HB3 ALA 83 17.537 -11.495 -10.703 703 H1 GLU 201 HT1 GLU 201 -7.674 9.574 10.814 704 H2 GLU 201 HT2 GLU 201 -7.551 7.896 10.676 705 H3 GLU 201 HT3 GLU 201 -6.672 8.896 9.637 706 HA GLU 201 HA GLU 201 -5.388 9.743 11.487 707 HB2 GLU 201 HB2 GLU 201 -6.970 7.705 13.062 708 HB3 GLU 201 HB1 GLU 201 -5.584 8.596 13.672 709 HG2 GLU 201 HG2 GLU 201 -6.800 10.687 13.409 710 HG3 GLU 201 HG1 GLU 201 -8.186 9.805 12.770 711 H ILE 202 HN ILE 202 -5.225 7.832 9.295 712 HA ILE 202 HA ILE 202 -3.126 6.126 10.434 713 HB ILE 202 HB ILE 202 -5.149 5.219 8.373 714 HG12 ILE 202 HG12 ILE 202 -5.929 5.146 10.739 715 HG13 ILE 202 HG11 ILE 202 -5.814 3.553 10.002 716 HG21 ILE 202 HG21 ILE 202 -2.897 4.423 7.836 717 HG22 ILE 202 HG22 ILE 202 -3.940 3.097 8.348 718 HG23 ILE 202 HG23 ILE 202 -2.742 3.757 9.462 719 HD11 ILE 202 HD11 ILE 202 -3.661 3.210 11.140 720 HD12 ILE 202 HD12 ILE 202 -4.991 3.487 12.265 721 HD13 ILE 202 HD13 ILE 202 -3.846 4.782 11.918 722 H LYS 203 HN LYS 203 -1.331 6.955 9.634 723 HA LYS 203 HA LYS 203 -1.269 7.771 6.800 724 HB2 LYS 203 HB2 LYS 203 0.364 8.865 9.101 725 HB3 LYS 203 HB1 LYS 203 0.463 9.394 7.429 726 HG2 LYS 203 HG2 LYS 203 -1.667 10.390 7.509 727 HG3 LYS 203 HG1 LYS 203 -2.078 9.577 9.019 728 HD2 LYS 203 HD2 LYS 203 -1.569 11.903 9.442 729 HD3 LYS 203 HD1 LYS 203 -0.326 10.880 10.162 730 HE2 LYS 203 HE2 LYS 203 1.116 11.306 8.213 731 HE3 LYS 203 HE1 LYS 203 -0.121 12.370 7.548 732 HZ1 LYS 203 HZ1 LYS 203 1.592 13.621 8.691 733 HZ2 LYS 203 HZ2 LYS 203 1.302 12.769 10.121 734 HZ3 LYS 203 HZ3 LYS 203 0.111 13.790 9.490 735 H LEU 204 HN LEU 204 0.376 6.960 5.542 736 HA LEU 204 HA LEU 204 2.344 5.243 6.917 737 HB2 LEU 204 HB2 LEU 204 0.422 4.285 5.256 738 HB3 LEU 204 HB1 LEU 204 1.704 4.607 4.106 739 HG LEU 204 HG LEU 204 1.746 2.698 6.438 740 HD11 LEU 204 HD11 LEU 204 2.312 2.248 3.518 741 HD12 LEU 204 HD12 LEU 204 0.755 1.959 4.290 742 HD13 LEU 204 HD13 LEU 204 2.168 1.028 4.782 743 HD21 LEU 204 HD21 LEU 204 4.115 3.295 4.685 744 HD22 LEU 204 HD22 LEU 204 4.047 2.276 6.119 745 HD23 LEU 204 HD23 LEU 204 3.887 4.025 6.272 746 H LYS 205 HN LYS 205 4.070 6.571 6.915 747 HA LYS 205 HA LYS 205 4.924 7.887 4.473 748 HB2 LYS 205 HB2 LYS 205 6.005 7.736 7.274 749 HB3 LYS 205 HB1 LYS 205 7.005 8.340 5.964 750 HG2 LYS 205 HG2 LYS 205 4.349 9.485 6.794 751 HG3 LYS 205 HG1 LYS 205 5.934 10.133 7.226 752 HD2 LYS 205 HD2 LYS 205 6.351 10.208 4.686 753 HD3 LYS 205 HD1 LYS 205 4.600 10.034 4.542 754 HE2 LYS 205 HE2 LYS 205 6.149 12.246 5.861 755 HE3 LYS 205 HE1 LYS 205 5.064 12.355 4.477 756 HZ1 LYS 205 HZ1 LYS 205 3.211 11.750 5.951 757 HZ2 LYS 205 HZ2 LYS 205 3.976 13.183 6.440 758 HZ3 LYS 205 HZ3 LYS 205 4.275 11.745 7.272 759 H ILE 206 HN ILE 206 5.078 5.826 3.229 760 HA ILE 206 HA ILE 206 7.046 3.916 4.025 761 HB ILE 206 HB ILE 206 6.489 4.207 1.109 762 HG12 ILE 206 HG12 ILE 206 4.522 2.849 2.944 763 HG13 ILE 206 HG11 ILE 206 4.227 4.448 2.255 764 HG21 ILE 206 HG21 ILE 206 6.151 1.611 2.311 765 HG22 ILE 206 HG22 ILE 206 7.657 2.375 2.861 766 HG23 ILE 206 HG23 ILE 206 7.356 2.169 1.135 767 HD11 ILE 206 HD11 ILE 206 4.897 2.897 0.068 768 HD12 ILE 206 HD12 ILE 206 3.265 3.330 0.575 769 HD13 ILE 206 HD13 ILE 206 3.966 1.800 1.087 770 H THR 207 HN THR 207 9.153 4.330 4.114 771 HA THR 207 HA THR 207 10.284 6.330 2.301 772 HB THR 207 HB THR 207 12.332 6.021 3.843 773 HG1 THR 207 HG1 THR 207 11.655 5.274 5.975 774 HG21 THR 207 HG21 THR 207 9.773 7.174 4.961 775 HG22 THR 207 HG22 THR 207 10.893 8.003 3.880 776 HG23 THR 207 HG23 THR 207 11.402 7.561 5.510 777 H LYS 208 HN LYS 208 11.096 5.566 0.467 778 HA LYS 208 HA LYS 208 13.114 3.649 0.359 779 HB2 LYS 208 HB2 LYS 208 12.142 1.720 -0.573 780 HB3 LYS 208 HB1 LYS 208 11.126 2.131 0.793 781 HG2 LYS 208 HG2 LYS 208 10.486 2.717 -2.093 782 HG3 LYS 208 HG1 LYS 208 9.850 1.373 -1.156 783 HD2 LYS 208 HD2 LYS 208 8.129 2.795 -0.815 784 HD3 LYS 208 HD1 LYS 208 9.185 3.451 0.439 785 HE2 LYS 208 HE2 LYS 208 10.071 5.061 -1.201 786 HE3 LYS 208 HE1 LYS 208 8.938 4.439 -2.395 787 HZ1 LYS 208 HZ1 LYS 208 7.122 5.149 -1.000 788 HZ2 LYS 208 HZ2 LYS 208 8.146 6.447 -1.358 789 HZ3 LYS 208 HZ3 LYS 208 8.204 5.722 0.173 790 H THR 209 HN THR 209 12.798 2.671 -2.238 791 HA THR 209 HA THR 209 13.270 3.153 -4.367 792 HB THR 209 HB THR 209 12.161 4.952 -5.580 793 HG1 THR 209 HG1 THR 209 11.901 6.058 -3.110 794 HG21 THR 209 HG21 THR 209 10.250 3.621 -3.671 795 HG22 THR 209 HG22 THR 209 10.966 2.843 -5.082 796 HG23 THR 209 HG23 THR 209 9.886 4.223 -5.286 797 H ILE 210 HN ILE 210 14.231 5.248 -1.927 798 HA ILE 210 HA ILE 210 16.035 6.828 -3.491 799 HB ILE 210 HB ILE 210 15.279 7.658 -1.335 800 HG12 ILE 210 HG12 ILE 210 18.227 6.982 -1.210 801 HG13 ILE 210 HG11 ILE 210 17.534 8.319 -2.121 802 HG21 ILE 210 HG21 ILE 210 16.665 5.263 -0.145 803 HG22 ILE 210 HG22 ILE 210 14.927 5.560 -0.185 804 HG23 ILE 210 HG23 ILE 210 15.980 6.605 0.771 805 HD11 ILE 210 HD11 ILE 210 18.485 9.087 -0.033 806 HD12 ILE 210 HD12 ILE 210 17.449 7.980 0.866 807 HD13 ILE 210 HD13 ILE 210 16.736 9.315 -0.038 808 H GLN 211 HN GLN 211 15.968 3.677 -2.187 809 HA GLN 211 HA GLN 211 18.744 3.253 -3.051 810 HB2 GLN 211 HB2 GLN 211 17.201 1.846 -0.863 811 HB3 GLN 211 HB1 GLN 211 18.740 1.277 -1.494 812 HG2 GLN 211 HG2 GLN 211 19.775 3.403 -0.797 813 HG3 GLN 211 HG1 GLN 211 18.235 3.894 -0.095 814 HE21 GLN 211 HE21 GLN 211 17.521 2.918 1.790 815 HE22 GLN 211 HE22 GLN 211 18.567 1.965 2.787 816 H ASN 212 HN ASN 212 19.149 1.277 -4.151 817 HA ASN 212 HA ASN 212 16.758 0.253 -5.514 818 HB2 ASN 212 HB2 ASN 212 19.644 0.363 -6.408 819 HB3 ASN 212 HB1 ASN 212 18.379 -0.482 -7.292 820 HD21 ASN 212 HD21 ASN 212 19.661 2.602 -6.370 821 HD22 ASN 212 HD22 ASN 212 18.710 3.551 -7.457 Start of MODEL 14 1 H1 SER 1 HT1 SER 1 -12.143 -7.797 -14.109 2 H2 SER 1 HT2 SER 1 -13.502 -6.800 -14.033 3 H3 SER 1 HT3 SER 1 -12.827 -7.419 -12.613 4 HA SER 1 HA SER 1 -10.865 -6.145 -12.884 5 HB2 SER 1 HB2 SER 1 -12.088 -4.937 -15.360 6 HB3 SER 1 HB1 SER 1 -10.432 -4.770 -14.766 7 HG SER 1 HG SER 1 -9.977 -6.817 -15.387 8 H GLU 2 HN GLU 2 -14.251 -5.280 -13.395 9 HA GLU 2 HA GLU 2 -13.830 -2.616 -12.344 10 HB2 GLU 2 HB2 GLU 2 -16.263 -2.345 -12.552 11 HB3 GLU 2 HB1 GLU 2 -15.528 -2.875 -14.051 12 HG2 GLU 2 HG2 GLU 2 -16.317 -5.110 -13.714 13 HG3 GLU 2 HG1 GLU 2 -16.915 -4.698 -12.107 14 H GLU 3 HN GLU 3 -14.156 -5.639 -11.011 15 HA GLU 3 HA GLU 3 -15.887 -5.258 -8.862 16 HB2 GLU 3 HB2 GLU 3 -14.855 -7.207 -7.861 17 HB3 GLU 3 HB1 GLU 3 -15.117 -7.461 -9.583 18 HG2 GLU 3 HG2 GLU 3 -12.836 -7.127 -10.071 19 HG3 GLU 3 HG1 GLU 3 -12.537 -6.511 -8.449 20 H GLU 4 HN GLU 4 -12.634 -4.172 -9.308 21 HA GLU 4 HA GLU 4 -12.149 -3.756 -6.498 22 HB2 GLU 4 HB2 GLU 4 -10.086 -2.586 -7.221 23 HB3 GLU 4 HB1 GLU 4 -10.239 -4.186 -7.939 24 HG2 GLU 4 HG2 GLU 4 -11.112 -3.111 -10.005 25 HG3 GLU 4 HG1 GLU 4 -10.764 -1.543 -9.277 26 H ASP 5 HN ASP 5 -13.252 -1.771 -9.201 27 HA ASP 5 HA ASP 5 -13.207 0.664 -7.671 28 HB2 ASP 5 HB2 ASP 5 -14.495 0.026 -10.345 29 HB3 ASP 5 HB1 ASP 5 -14.493 1.625 -9.604 30 H LYS 6 HN LYS 6 -15.238 -2.020 -7.864 31 HA LYS 6 HA LYS 6 -17.536 -0.500 -6.834 32 HB2 LYS 6 HB2 LYS 6 -17.760 -1.983 -8.903 33 HB3 LYS 6 HB1 LYS 6 -17.558 -3.353 -7.823 34 HG2 LYS 6 HG2 LYS 6 -19.887 -3.061 -8.197 35 HG3 LYS 6 HG1 LYS 6 -19.555 -2.522 -6.549 36 HD2 LYS 6 HD2 LYS 6 -19.605 -0.218 -7.235 37 HD3 LYS 6 HD1 LYS 6 -19.749 -0.682 -8.931 38 HE2 LYS 6 HE2 LYS 6 -21.905 -0.005 -8.064 39 HE3 LYS 6 HE1 LYS 6 -21.918 -1.723 -8.450 40 HZ1 LYS 6 HZ1 LYS 6 -21.681 -0.508 -5.753 41 HZ2 LYS 6 HZ2 LYS 6 -21.525 -2.161 -6.065 42 HZ3 LYS 6 HZ3 LYS 6 -22.994 -1.383 -6.360 43 H CYS 7 HN CYS 7 -14.954 -1.641 -5.589 44 HA CYS 7 HA CYS 7 -15.920 -3.707 -3.826 45 HB2 CYS 7 HB2 CYS 7 -13.531 -3.463 -4.831 46 HB3 CYS 7 HB1 CYS 7 -13.272 -2.312 -3.525 47 HG CYS 7 HG CYS 7 -13.997 -4.234 -1.532 48 H LYS 8 HN LYS 8 -16.293 -3.550 -1.672 49 HA LYS 8 HA LYS 8 -16.928 -0.944 -0.635 50 HB2 LYS 8 HB2 LYS 8 -17.262 -3.761 0.323 51 HB3 LYS 8 HB1 LYS 8 -17.410 -2.440 1.471 52 HG2 LYS 8 HG2 LYS 8 -19.585 -3.090 0.660 53 HG3 LYS 8 HG1 LYS 8 -19.192 -1.462 0.115 54 HD2 LYS 8 HD2 LYS 8 -18.537 -2.383 -2.078 55 HD3 LYS 8 HD1 LYS 8 -19.004 -3.990 -1.522 56 HE2 LYS 8 HE2 LYS 8 -20.829 -1.599 -1.759 57 HE3 LYS 8 HE1 LYS 8 -20.762 -2.957 -2.879 58 HZ1 LYS 8 HZ1 LYS 8 -21.472 -4.422 -1.101 59 HZ2 LYS 8 HZ2 LYS 8 -22.589 -3.170 -1.310 60 HZ3 LYS 8 HZ3 LYS 8 -21.514 -3.130 -0.010 61 HA PRO 9 HA PRO 9 -13.118 -0.116 1.455 62 HB2 PRO 9 HB2 PRO 9 -14.584 1.015 3.709 63 HB3 PRO 9 HB1 PRO 9 -13.517 1.812 2.548 64 HG2 PRO 9 HG2 PRO 9 -16.210 2.184 2.585 65 HG3 PRO 9 HG1 PRO 9 -15.224 2.321 1.119 66 HD2 PRO 9 HD2 PRO 9 -17.024 0.116 1.999 67 HD3 PRO 9 HD1 PRO 9 -16.663 0.698 0.362 68 H MET 10 HN MET 10 -11.833 -1.151 2.859 69 HA MET 10 HA MET 10 -12.922 -3.176 4.581 70 HB2 MET 10 HB2 MET 10 -10.577 -3.645 5.151 71 HB3 MET 10 HB1 MET 10 -10.819 -3.580 3.414 72 HG2 MET 10 HG2 MET 10 -9.918 -1.311 3.378 73 HG3 MET 10 HG1 MET 10 -9.650 -1.408 5.114 74 HE1 MET 10 HE1 MET 10 -8.810 -3.032 1.661 75 HE2 MET 10 HE2 MET 10 -9.130 -4.456 2.651 76 HE3 MET 10 HE3 MET 10 -7.495 -4.129 2.077 77 H SER 11 HN SER 11 -12.274 -3.293 6.870 78 HA SER 11 HA SER 11 -13.192 -0.906 8.157 79 HB2 SER 11 HB2 SER 11 -13.070 -2.304 10.228 80 HB3 SER 11 HB1 SER 11 -14.033 -3.019 8.937 81 HG SER 11 HG SER 11 -12.043 -4.204 8.376 82 H TYR 12 HN TYR 12 -12.075 -0.523 10.462 83 HA TYR 12 HA TYR 12 -9.735 0.919 9.838 84 HB2 TYR 12 HB2 TYR 12 -11.404 1.433 11.661 85 HB3 TYR 12 HB1 TYR 12 -10.688 0.132 12.608 86 HD1 TYR 12 HD1 TYR 12 -8.052 0.352 12.936 87 HD2 TYR 12 HD2 TYR 12 -10.669 3.572 12.013 88 HE1 TYR 12 HE1 TYR 12 -6.421 1.933 13.868 89 HE2 TYR 12 HE2 TYR 12 -9.047 5.164 12.944 90 HH TYR 12 HH TYR 12 -7.194 5.229 14.466 91 H GLU 13 HN GLU 13 -10.194 -2.154 11.581 92 HA GLU 13 HA GLU 13 -7.531 -2.495 12.406 93 HB2 GLU 13 HB2 GLU 13 -9.489 -3.793 13.267 94 HB3 GLU 13 HB1 GLU 13 -9.519 -4.682 11.749 95 HG2 GLU 13 HG2 GLU 13 -7.307 -5.567 12.192 96 HG3 GLU 13 HG1 GLU 13 -7.209 -4.626 13.679 97 H GLU 14 HN GLU 14 -9.134 -3.126 9.387 98 HA GLU 14 HA GLU 14 -7.017 -4.754 8.302 99 HB2 GLU 14 HB2 GLU 14 -9.434 -3.474 7.013 100 HB3 GLU 14 HB1 GLU 14 -8.314 -4.537 6.173 101 HG2 GLU 14 HG2 GLU 14 -8.937 -6.396 7.508 102 HG3 GLU 14 HG1 GLU 14 -9.846 -5.369 8.622 103 H LYS 15 HN LYS 15 -8.214 -1.441 7.796 104 HA LYS 15 HA LYS 15 -6.365 -0.599 5.908 105 HB2 LYS 15 HB2 LYS 15 -7.801 0.890 8.094 106 HB3 LYS 15 HB1 LYS 15 -6.740 1.699 6.955 107 HG2 LYS 15 HG2 LYS 15 -8.127 1.168 5.118 108 HG3 LYS 15 HG1 LYS 15 -9.064 0.024 6.092 109 HD2 LYS 15 HD2 LYS 15 -10.355 1.634 6.973 110 HD3 LYS 15 HD1 LYS 15 -8.999 2.740 7.187 111 HE2 LYS 15 HE2 LYS 15 -9.084 3.300 4.812 112 HE3 LYS 15 HE1 LYS 15 -10.438 2.190 4.588 113 HZ1 LYS 15 HZ1 LYS 15 -10.466 4.556 6.400 114 HZ2 LYS 15 HZ2 LYS 15 -11.779 3.550 6.028 115 HZ3 LYS 15 HZ3 LYS 15 -11.111 4.539 4.832 116 H ARG 16 HN ARG 16 -6.119 -0.472 9.459 117 HA ARG 16 HA ARG 16 -3.549 0.666 9.527 118 HB2 ARG 16 HB2 ARG 16 -4.982 0.622 11.514 119 HB3 ARG 16 HB1 ARG 16 -4.900 -1.139 11.554 120 HG2 ARG 16 HG2 ARG 16 -2.451 -0.964 11.943 121 HG3 ARG 16 HG1 ARG 16 -2.627 0.781 12.026 122 HD2 ARG 16 HD2 ARG 16 -4.224 -1.000 13.796 123 HD3 ARG 16 HD1 ARG 16 -2.580 -0.539 14.218 124 HE ARG 16 HE ARG 16 -3.667 1.840 13.741 125 HH11 ARG 16 HH11 ARG 16 -4.871 -0.876 15.584 126 HH12 ARG 16 HH12 ARG 16 -5.769 0.107 16.695 127 HH21 ARG 16 HH21 ARG 16 -4.843 3.151 15.206 128 HH22 ARG 16 HH22 ARG 16 -5.761 2.400 16.474 129 H GLN 17 HN GLN 17 -4.622 -2.703 9.348 130 HA GLN 17 HA GLN 17 -2.058 -3.840 9.698 131 HB2 GLN 17 HB2 GLN 17 -4.266 -5.030 10.000 132 HB3 GLN 17 HB1 GLN 17 -4.394 -5.081 8.248 133 HG2 GLN 17 HG2 GLN 17 -3.566 -7.184 9.041 134 HG3 GLN 17 HG1 GLN 17 -2.284 -6.352 8.163 135 HE21 GLN 17 HE21 GLN 17 -0.643 -7.476 9.182 136 HE22 GLN 17 HE22 GLN 17 -0.235 -7.226 10.844 137 H LEU 18 HN LEU 18 -3.722 -2.466 7.031 138 HA LEU 18 HA LEU 18 -2.138 -3.622 4.951 139 HB2 LEU 18 HB2 LEU 18 -4.477 -2.225 5.059 140 HB3 LEU 18 HB1 LEU 18 -3.375 -0.980 4.511 141 HG LEU 18 HG LEU 18 -3.709 -3.632 3.106 142 HD11 LEU 18 HD11 LEU 18 -5.020 -0.986 2.530 143 HD12 LEU 18 HD12 LEU 18 -5.825 -2.452 3.080 144 HD13 LEU 18 HD13 LEU 18 -5.074 -2.398 1.484 145 HD21 LEU 18 HD21 LEU 18 -1.671 -2.697 2.441 146 HD22 LEU 18 HD22 LEU 18 -2.315 -1.062 2.440 147 HD23 LEU 18 HD23 LEU 18 -2.808 -2.205 1.195 148 H SER 19 HN SER 19 -2.063 -0.601 6.778 149 HA SER 19 HA SER 19 0.241 0.492 5.623 150 HB2 SER 19 HB2 SER 19 -1.171 1.741 7.200 151 HB3 SER 19 HB1 SER 19 -0.724 0.636 8.496 152 HG SER 19 HG SER 19 0.573 2.394 8.705 153 H LEU 20 HN LEU 20 -0.217 -2.010 8.007 154 HA LEU 20 HA LEU 20 2.541 -2.249 8.700 155 HB2 LEU 20 HB2 LEU 20 0.147 -3.985 9.219 156 HB3 LEU 20 HB1 LEU 20 1.744 -4.361 9.816 157 HG LEU 20 HG LEU 20 0.240 -1.844 10.511 158 HD11 LEU 20 HD11 LEU 20 -0.664 -4.120 11.285 159 HD12 LEU 20 HD12 LEU 20 -0.432 -2.855 12.489 160 HD13 LEU 20 HD13 LEU 20 0.748 -4.159 12.338 161 HD21 LEU 20 HD21 LEU 20 2.760 -1.812 10.589 162 HD22 LEU 20 HD22 LEU 20 2.659 -3.058 11.829 163 HD23 LEU 20 HD23 LEU 20 1.949 -1.468 12.114 164 H ASP 21 HN ASP 21 0.427 -3.755 6.331 165 HA ASP 21 HA ASP 21 2.239 -5.929 5.871 166 HB2 ASP 21 HB2 ASP 21 0.698 -6.646 4.117 167 HB3 ASP 21 HB1 ASP 21 -0.126 -6.339 5.634 168 H ILE 22 HN ILE 22 1.597 -2.839 4.303 169 HA ILE 22 HA ILE 22 3.340 -3.331 2.099 170 HB ILE 22 HB ILE 22 2.402 -0.737 3.335 171 HG12 ILE 22 HG12 ILE 22 1.658 -1.899 0.658 172 HG13 ILE 22 HG11 ILE 22 0.801 -2.377 2.128 173 HG21 ILE 22 HG21 ILE 22 4.483 -0.259 2.263 174 HG22 ILE 22 HG22 ILE 22 3.173 0.332 1.239 175 HG23 ILE 22 HG23 ILE 22 4.004 -1.168 0.831 176 HD11 ILE 22 HD11 ILE 22 0.123 -0.134 2.492 177 HD12 ILE 22 HD12 ILE 22 -0.321 -0.600 0.857 178 HD13 ILE 22 HD13 ILE 22 1.076 0.445 1.135 179 H ASN 23 HN ASN 23 3.741 -2.071 5.332 180 HA ASN 23 HA ASN 23 6.404 -1.226 5.213 181 HB2 ASN 23 HB2 ASN 23 5.174 -0.648 7.139 182 HB3 ASN 23 HB1 ASN 23 4.655 -2.301 7.415 183 HD21 ASN 23 HD21 ASN 23 7.222 -0.000 7.795 184 HD22 ASN 23 HD22 ASN 23 8.162 -0.931 8.904 185 H LYS 24 HN LYS 24 5.010 -4.391 5.210 186 HA LYS 24 HA LYS 24 7.360 -5.778 6.118 187 HB2 LYS 24 HB2 LYS 24 4.773 -6.694 4.880 188 HB3 LYS 24 HB1 LYS 24 6.055 -7.807 5.347 189 HG2 LYS 24 HG2 LYS 24 5.852 -7.083 7.657 190 HG3 LYS 24 HG1 LYS 24 4.621 -5.906 7.195 191 HD2 LYS 24 HD2 LYS 24 3.215 -7.789 6.376 192 HD3 LYS 24 HD1 LYS 24 4.424 -8.910 7.007 193 HE2 LYS 24 HE2 LYS 24 2.834 -6.909 8.609 194 HE3 LYS 24 HE1 LYS 24 2.584 -8.653 8.578 195 HZ1 LYS 24 HZ1 LYS 24 5.004 -7.252 9.577 196 HZ2 LYS 24 HZ2 LYS 24 4.809 -8.930 9.509 197 HZ3 LYS 24 HZ3 LYS 24 3.824 -8.008 10.522 198 H LEU 25 HN LEU 25 6.107 -4.734 3.049 199 HA LEU 25 HA LEU 25 7.444 -6.626 1.417 200 HB2 LEU 25 HB2 LEU 25 6.549 -3.852 0.709 201 HB3 LEU 25 HB1 LEU 25 6.949 -5.114 -0.424 202 HG LEU 25 HG LEU 25 4.568 -4.935 1.387 203 HD11 LEU 25 HD11 LEU 25 4.972 -5.167 -1.573 204 HD12 LEU 25 HD12 LEU 25 4.332 -3.788 -0.691 205 HD13 LEU 25 HD13 LEU 25 3.406 -5.285 -0.783 206 HD21 LEU 25 HD21 LEU 25 5.679 -7.291 -0.056 207 HD22 LEU 25 HD22 LEU 25 3.983 -7.182 0.398 208 HD23 LEU 25 HD23 LEU 25 5.238 -7.174 1.642 209 HA PRO 26 HA PRO 26 11.669 -5.014 1.527 210 HB2 PRO 26 HB2 PRO 26 11.763 -6.726 -0.911 211 HB3 PRO 26 HB1 PRO 26 12.847 -6.697 0.489 212 HG2 PRO 26 HG2 PRO 26 11.097 -8.671 0.169 213 HG3 PRO 26 HG1 PRO 26 11.417 -7.995 1.778 214 HD2 PRO 26 HD2 PRO 26 9.083 -7.538 -0.041 215 HD3 PRO 26 HD1 PRO 26 9.123 -7.725 1.725 216 H GLY 27 HN GLY 27 12.888 -3.615 0.139 217 HA2 GLY 27 HA2 GLY 27 11.501 -1.570 -0.961 218 HA3 GLY 27 HA1 GLY 27 13.146 -1.936 -1.415 219 H GLU 28 HN GLU 28 12.670 -4.358 -2.857 220 HA GLU 28 HA GLU 28 11.995 -3.421 -5.403 221 HB2 GLU 28 HB2 GLU 28 13.288 -5.473 -5.070 222 HB3 GLU 28 HB1 GLU 28 11.908 -6.246 -4.318 223 HG2 GLU 28 HG2 GLU 28 10.893 -5.508 -6.743 224 HG3 GLU 28 HG1 GLU 28 12.563 -5.918 -7.121 225 H LYS 29 HN LYS 29 10.115 -5.462 -3.231 226 HA LYS 29 HA LYS 29 7.755 -5.472 -4.806 227 HB2 LYS 29 HB2 LYS 29 8.319 -6.152 -1.920 228 HB3 LYS 29 HB1 LYS 29 6.780 -6.468 -2.717 229 HG2 LYS 29 HG2 LYS 29 9.400 -7.575 -3.675 230 HG3 LYS 29 HG1 LYS 29 8.337 -8.419 -2.549 231 HD2 LYS 29 HD2 LYS 29 6.521 -8.250 -4.258 232 HD3 LYS 29 HD1 LYS 29 7.710 -7.605 -5.387 233 HE2 LYS 29 HE2 LYS 29 7.349 -10.008 -5.704 234 HE3 LYS 29 HE1 LYS 29 9.007 -9.645 -5.235 235 HZ1 LYS 29 HZ1 LYS 29 6.881 -10.605 -3.396 236 HZ2 LYS 29 HZ2 LYS 29 8.494 -10.315 -2.982 237 HZ3 LYS 29 HZ3 LYS 29 8.104 -11.564 -4.052 238 H LEU 30 HN LEU 30 8.967 -3.559 -2.196 239 HA LEU 30 HA LEU 30 6.588 -2.267 -1.393 240 HB2 LEU 30 HB2 LEU 30 8.596 -2.344 -0.021 241 HB3 LEU 30 HB1 LEU 30 9.485 -1.422 -1.219 242 HG LEU 30 HG LEU 30 8.330 0.568 -0.702 243 HD11 LEU 30 HD11 LEU 30 6.511 -0.761 1.243 244 HD12 LEU 30 HD12 LEU 30 6.096 -0.761 -0.463 245 HD13 LEU 30 HD13 LEU 30 6.318 0.760 0.386 246 HD21 LEU 30 HD21 LEU 30 8.630 0.715 1.776 247 HD22 LEU 30 HD22 LEU 30 10.017 0.069 0.901 248 HD23 LEU 30 HD23 LEU 30 8.942 -1.019 1.778 249 H GLY 31 HN GLY 31 9.046 -1.347 -3.807 250 HA2 GLY 31 HA2 GLY 31 8.175 1.269 -4.256 251 HA3 GLY 31 HA1 GLY 31 9.005 0.287 -5.440 252 H ARG 32 HN ARG 32 6.729 -1.725 -5.313 253 HA ARG 32 HA ARG 32 5.160 -0.619 -7.396 254 HB2 ARG 32 HB2 ARG 32 5.436 -3.007 -7.284 255 HB3 ARG 32 HB1 ARG 32 4.728 -3.055 -5.678 256 HG2 ARG 32 HG2 ARG 32 3.143 -3.857 -7.344 257 HG3 ARG 32 HG1 ARG 32 2.572 -2.368 -6.603 258 HD2 ARG 32 HD2 ARG 32 2.177 -2.276 -8.986 259 HD3 ARG 32 HD1 ARG 32 3.393 -1.087 -8.531 260 HE ARG 32 HE ARG 32 4.657 -3.479 -9.343 261 HH11 ARG 32 HH11 ARG 32 2.829 -0.794 -10.630 262 HH12 ARG 32 HH12 ARG 32 3.584 -0.852 -12.191 263 HH21 ARG 32 HH21 ARG 32 5.661 -3.572 -11.409 264 HH22 ARG 32 HH22 ARG 32 5.189 -2.435 -12.636 265 H VAL 33 HN VAL 33 4.454 -1.215 -3.945 266 HA VAL 33 HA VAL 33 1.756 -0.351 -4.121 267 HB VAL 33 HB VAL 33 2.667 0.127 -1.470 268 HG11 VAL 33 HG11 VAL 33 1.012 -1.962 -2.864 269 HG12 VAL 33 HG12 VAL 33 0.482 -0.632 -1.836 270 HG13 VAL 33 HG13 VAL 33 1.299 -2.020 -1.129 271 HG21 VAL 33 HG21 VAL 33 4.668 -1.153 -2.032 272 HG22 VAL 33 HG22 VAL 33 3.665 -2.476 -2.625 273 HG23 VAL 33 HG23 VAL 33 3.634 -2.044 -0.917 274 H VAL 34 HN VAL 34 4.658 1.375 -2.930 275 HA VAL 34 HA VAL 34 3.494 3.828 -2.374 276 HB VAL 34 HB VAL 34 5.660 4.247 -1.938 277 HG11 VAL 34 HG11 VAL 34 6.209 1.948 -2.193 278 HG12 VAL 34 HG12 VAL 34 7.512 2.932 -2.852 279 HG13 VAL 34 HG13 VAL 34 6.371 2.134 -3.935 280 HG21 VAL 34 HG21 VAL 34 5.437 5.748 -3.891 281 HG22 VAL 34 HG22 VAL 34 6.074 4.468 -4.918 282 HG23 VAL 34 HG23 VAL 34 7.088 5.178 -3.664 283 H HIS 35 HN HIS 35 4.498 2.484 -5.451 284 HA HIS 35 HA HIS 35 3.825 4.745 -7.033 285 HB2 HIS 35 HB2 HIS 35 5.413 2.940 -7.709 286 HB3 HIS 35 HB1 HIS 35 4.031 1.871 -7.915 287 HD1 HIS 35 HD1 HIS 35 5.512 5.035 -9.352 288 HD2 HIS 35 HD2 HIS 35 2.753 2.092 -10.338 289 HE1 HIS 35 HE1 HIS 35 4.900 5.461 -11.750 290 HE2 HIS 35 HE2 HIS 35 3.112 3.765 -12.273 291 H ILE 36 HN ILE 36 2.082 1.754 -6.214 292 HA ILE 36 HA ILE 36 -0.134 2.082 -7.861 293 HB ILE 36 HB ILE 36 -0.163 0.902 -5.072 294 HG12 ILE 36 HG12 ILE 36 0.303 -0.330 -7.787 295 HG13 ILE 36 HG11 ILE 36 1.405 -0.306 -6.422 296 HG21 ILE 36 HG21 ILE 36 -2.352 0.578 -5.328 297 HG22 ILE 36 HG22 ILE 36 -2.077 -0.242 -6.865 298 HG23 ILE 36 HG23 ILE 36 -2.288 1.507 -6.825 299 HD11 ILE 36 HD11 ILE 36 -0.217 -1.732 -5.182 300 HD12 ILE 36 HD12 ILE 36 0.487 -2.494 -6.606 301 HD13 ILE 36 HD13 ILE 36 -1.154 -1.856 -6.668 302 H ILE 37 HN ILE 37 0.286 3.210 -4.494 303 HA ILE 37 HA ILE 37 -2.251 4.385 -4.296 304 HB ILE 37 HB ILE 37 0.242 5.291 -2.853 305 HG12 ILE 37 HG12 ILE 37 -1.509 3.861 -1.158 306 HG13 ILE 37 HG11 ILE 37 -1.340 2.892 -2.617 307 HG21 ILE 37 HG21 ILE 37 -1.952 6.707 -3.036 308 HG22 ILE 37 HG22 ILE 37 -1.108 6.550 -1.489 309 HG23 ILE 37 HG23 ILE 37 -2.539 5.569 -1.818 310 HD11 ILE 37 HD11 ILE 37 1.014 2.777 -2.358 311 HD12 ILE 37 HD12 ILE 37 0.274 2.356 -0.813 312 HD13 ILE 37 HD13 ILE 37 0.980 3.954 -1.048 313 H GLN 38 HN GLN 38 0.872 5.918 -5.041 314 HA GLN 38 HA GLN 38 -0.102 8.496 -5.464 315 HB2 GLN 38 HB2 GLN 38 2.279 7.098 -6.688 316 HB3 GLN 38 HB1 GLN 38 1.989 8.824 -6.859 317 HG2 GLN 38 HG2 GLN 38 1.899 8.706 -4.205 318 HG3 GLN 38 HG1 GLN 38 2.843 7.243 -4.475 319 HE21 GLN 38 HE21 GLN 38 3.885 9.686 -3.199 320 HE22 GLN 38 HE22 GLN 38 5.143 10.264 -4.223 321 H SER 39 HN SER 39 -0.070 5.725 -7.594 322 HA SER 39 HA SER 39 -0.713 7.264 -9.939 323 HB2 SER 39 HB2 SER 39 0.615 5.176 -10.052 324 HB3 SER 39 HB1 SER 39 -0.804 4.268 -9.527 325 HG SER 39 HG SER 39 -1.448 5.830 -11.617 326 H ARG 40 HN ARG 40 -2.538 5.517 -7.482 327 HA ARG 40 HA ARG 40 -4.968 5.665 -9.087 328 HB2 ARG 40 HB2 ARG 40 -4.673 4.755 -6.231 329 HB3 ARG 40 HB1 ARG 40 -6.074 4.524 -7.266 330 HG2 ARG 40 HG2 ARG 40 -4.366 3.234 -8.781 331 HG3 ARG 40 HG1 ARG 40 -3.459 3.107 -7.271 332 HD2 ARG 40 HD2 ARG 40 -4.811 1.165 -7.487 333 HD3 ARG 40 HD1 ARG 40 -5.451 2.177 -6.199 334 HE ARG 40 HE ARG 40 -7.054 2.972 -8.057 335 HH11 ARG 40 HH11 ARG 40 -5.831 -0.288 -7.691 336 HH12 ARG 40 HH12 ARG 40 -7.184 -1.019 -8.501 337 HH21 ARG 40 HH21 ARG 40 -8.835 1.993 -9.124 338 HH22 ARG 40 HH22 ARG 40 -8.869 0.264 -9.308 339 H GLU 41 HN GLU 41 -3.404 7.169 -6.385 340 HA GLU 41 HA GLU 41 -5.618 9.075 -6.138 341 HB2 GLU 41 HB2 GLU 41 -3.543 8.516 -4.070 342 HB3 GLU 41 HB1 GLU 41 -5.155 9.186 -3.865 343 HG2 GLU 41 HG2 GLU 41 -5.167 6.632 -5.116 344 HG3 GLU 41 HG1 GLU 41 -4.431 6.580 -3.546 345 HA PRO 42 HA PRO 42 -2.085 11.503 -7.971 346 HB2 PRO 42 HB2 PRO 42 -4.387 13.152 -8.844 347 HB3 PRO 42 HB1 PRO 42 -3.014 12.551 -9.780 348 HG2 PRO 42 HG2 PRO 42 -5.444 11.491 -10.073 349 HG3 PRO 42 HG1 PRO 42 -3.989 10.480 -10.131 350 HD2 PRO 42 HD2 PRO 42 -5.958 10.845 -7.906 351 HD3 PRO 42 HD1 PRO 42 -5.146 9.365 -8.465 352 H SER 43 HN SER 43 -4.641 12.129 -5.796 353 HA SER 43 HA SER 43 -4.188 14.835 -5.194 354 HB2 SER 43 HB2 SER 43 -5.276 12.699 -3.353 355 HB3 SER 43 HB1 SER 43 -5.586 14.435 -3.277 356 HG SER 43 HG SER 43 -6.394 14.033 -5.567 357 H LEU 44 HN LEU 44 -2.461 11.972 -4.345 358 HA LEU 44 HA LEU 44 -1.020 13.461 -2.267 359 HB2 LEU 44 HB2 LEU 44 -0.410 11.221 -1.319 360 HB3 LEU 44 HB1 LEU 44 -2.085 11.682 -1.165 361 HG LEU 44 HG LEU 44 -2.359 10.211 -3.348 362 HD11 LEU 44 HD11 LEU 44 0.090 9.836 -3.548 363 HD12 LEU 44 HD12 LEU 44 -0.848 8.351 -3.427 364 HD13 LEU 44 HD13 LEU 44 0.038 8.949 -2.025 365 HD21 LEU 44 HD21 LEU 44 -3.462 9.829 -1.213 366 HD22 LEU 44 HD22 LEU 44 -1.995 9.091 -0.570 367 HD23 LEU 44 HD23 LEU 44 -2.867 8.313 -1.891 368 H LYS 45 HN LYS 45 -0.620 13.023 -5.295 369 HA LYS 45 HA LYS 45 1.935 11.689 -5.371 370 HB2 LYS 45 HB2 LYS 45 1.971 12.116 -7.691 371 HB3 LYS 45 HB1 LYS 45 0.285 11.810 -7.309 372 HG2 LYS 45 HG2 LYS 45 -0.076 14.265 -7.257 373 HG3 LYS 45 HG1 LYS 45 1.589 14.466 -7.814 374 HD2 LYS 45 HD2 LYS 45 0.881 12.834 -9.700 375 HD3 LYS 45 HD1 LYS 45 -0.760 13.307 -9.253 376 HE2 LYS 45 HE2 LYS 45 1.454 15.200 -9.998 377 HE3 LYS 45 HE1 LYS 45 0.167 14.681 -11.083 378 HZ1 LYS 45 HZ1 LYS 45 -1.444 15.692 -9.580 379 HZ2 LYS 45 HZ2 LYS 45 -0.320 16.834 -10.118 380 HZ3 LYS 45 HZ3 LYS 45 -0.198 16.203 -8.557 381 H ASN 46 HN ASN 46 0.945 14.610 -4.233 382 HA ASN 46 HA ASN 46 3.145 16.258 -5.000 383 HB2 ASN 46 HB2 ASN 46 2.395 17.782 -3.249 384 HB3 ASN 46 HB1 ASN 46 1.014 17.218 -4.178 385 HD21 ASN 46 HD21 ASN 46 -0.572 16.056 -3.176 386 HD22 ASN 46 HD22 ASN 46 -0.592 15.729 -1.476 387 H SER 47 HN SER 47 2.595 13.829 -2.615 388 HA SER 47 HA SER 47 4.729 14.484 -0.868 389 HB2 SER 47 HB2 SER 47 3.473 11.769 -1.375 390 HB3 SER 47 HB1 SER 47 4.383 12.261 0.054 391 HG SER 47 HG SER 47 2.731 13.806 0.470 392 H ASN 48 HN ASN 48 6.877 14.077 -1.085 393 HA ASN 48 HA ASN 48 7.992 13.454 -3.568 394 HB2 ASN 48 HB2 ASN 48 9.334 13.065 -0.878 395 HB3 ASN 48 HB1 ASN 48 10.134 13.303 -2.426 396 HD21 ASN 48 HD21 ASN 48 10.469 14.814 -0.043 397 HD22 ASN 48 HD22 ASN 48 10.009 16.443 -0.403 398 HA PRO 49 HA PRO 49 7.163 9.159 -3.825 399 HB2 PRO 49 HB2 PRO 49 9.156 8.493 -5.619 400 HB3 PRO 49 HB1 PRO 49 7.562 9.116 -6.040 401 HG2 PRO 49 HG2 PRO 49 10.177 10.530 -5.878 402 HG3 PRO 49 HG1 PRO 49 8.819 10.799 -6.984 403 HD2 PRO 49 HD2 PRO 49 9.345 12.425 -4.882 404 HD3 PRO 49 HD1 PRO 49 7.701 12.141 -5.488 405 H ASP 50 HN ASP 50 10.213 10.332 -2.690 406 HA ASP 50 HA ASP 50 11.081 7.668 -1.942 407 HB2 ASP 50 HB2 ASP 50 12.350 10.367 -1.493 408 HB3 ASP 50 HB1 ASP 50 13.026 8.859 -0.889 409 H GLU 51 HN GLU 51 9.507 10.400 -0.579 410 HA GLU 51 HA GLU 51 9.366 9.067 2.046 411 HB2 GLU 51 HB2 GLU 51 10.253 11.791 1.363 412 HB3 GLU 51 HB1 GLU 51 9.006 11.754 2.602 413 HG2 GLU 51 HG2 GLU 51 10.389 10.226 3.925 414 HG3 GLU 51 HG1 GLU 51 11.640 10.307 2.692 415 H ILE 52 HN ILE 52 7.430 8.294 0.637 416 HA ILE 52 HA ILE 52 5.478 10.262 -0.052 417 HB ILE 52 HB ILE 52 4.399 8.626 -1.224 418 HG12 ILE 52 HG12 ILE 52 5.302 6.356 0.458 419 HG13 ILE 52 HG11 ILE 52 3.970 7.367 1.027 420 HG21 ILE 52 HG21 ILE 52 6.947 7.117 -0.768 421 HG22 ILE 52 HG22 ILE 52 6.850 8.571 -1.765 422 HG23 ILE 52 HG23 ILE 52 5.937 7.130 -2.216 423 HD11 ILE 52 HD11 ILE 52 2.945 6.951 -1.272 424 HD12 ILE 52 HD12 ILE 52 2.923 5.634 -0.110 425 HD13 ILE 52 HD13 ILE 52 4.113 5.639 -1.412 426 H GLU 53 HN GLU 53 3.389 10.495 0.774 427 HA GLU 53 HA GLU 53 3.048 9.462 3.504 428 HB2 GLU 53 HB2 GLU 53 3.471 11.899 3.459 429 HB3 GLU 53 HB1 GLU 53 2.112 12.117 2.374 430 HG2 GLU 53 HG2 GLU 53 0.543 11.564 4.059 431 HG3 GLU 53 HG1 GLU 53 1.811 10.949 5.128 432 H ILE 54 HN ILE 54 1.488 8.023 3.570 433 HA ILE 54 HA ILE 54 -0.721 8.177 1.623 434 HB ILE 54 HB ILE 54 0.073 5.888 3.435 435 HG12 ILE 54 HG12 ILE 54 0.383 6.086 0.433 436 HG13 ILE 54 HG11 ILE 54 1.693 6.428 1.567 437 HG21 ILE 54 HG21 ILE 54 -1.462 4.592 1.989 438 HG22 ILE 54 HG22 ILE 54 -1.964 6.098 1.230 439 HG23 ILE 54 HG23 ILE 54 -2.275 5.828 2.946 440 HD11 ILE 54 HD11 ILE 54 1.822 4.169 0.652 441 HD12 ILE 54 HD12 ILE 54 0.225 3.813 1.314 442 HD13 ILE 54 HD13 ILE 54 1.574 4.150 2.396 443 H ASP 55 HN ASP 55 -2.818 8.478 2.296 444 HA ASP 55 HA ASP 55 -3.223 8.692 5.219 445 HB2 ASP 55 HB2 ASP 55 -3.438 10.877 3.986 446 HB3 ASP 55 HB1 ASP 55 -4.769 10.170 3.074 447 H PHE 56 HN PHE 56 -4.012 6.710 5.669 448 HA PHE 56 HA PHE 56 -5.377 5.163 3.767 449 HB2 PHE 56 HB2 PHE 56 -4.454 4.832 6.507 450 HB3 PHE 56 HB1 PHE 56 -5.893 3.887 6.124 451 HD1 PHE 56 HD1 PHE 56 -2.379 4.529 5.182 452 HD2 PHE 56 HD2 PHE 56 -5.795 2.066 4.662 453 HE1 PHE 56 HE1 PHE 56 -1.014 2.894 3.941 454 HE2 PHE 56 HE2 PHE 56 -4.453 0.441 3.436 455 HZ PHE 56 HZ PHE 56 -2.059 0.834 3.074 456 H GLU 57 HN GLU 57 -6.601 7.610 5.766 457 HA GLU 57 HA GLU 57 -9.279 6.483 5.765 458 HB2 GLU 57 HB2 GLU 57 -8.069 8.949 6.966 459 HB3 GLU 57 HB1 GLU 57 -9.808 8.670 6.955 460 HG2 GLU 57 HG2 GLU 57 -7.786 6.783 8.129 461 HG3 GLU 57 HG1 GLU 57 -8.689 7.978 9.052 462 H THR 58 HN THR 58 -7.468 8.003 3.518 463 HA THR 58 HA THR 58 -9.860 9.289 2.377 464 HB THR 58 HB THR 58 -8.365 10.860 1.182 465 HG1 THR 58 HG1 THR 58 -6.408 9.458 2.680 466 HG21 THR 58 HG21 THR 58 -8.185 10.800 4.186 467 HG22 THR 58 HG22 THR 58 -9.405 11.617 3.206 468 HG23 THR 58 HG23 THR 58 -7.736 12.193 3.201 469 H LEU 59 HN LEU 59 -7.506 6.878 1.957 470 HA LEU 59 HA LEU 59 -7.276 6.875 -0.864 471 HB2 LEU 59 HB2 LEU 59 -7.241 4.289 0.641 472 HB3 LEU 59 HB1 LEU 59 -6.287 4.793 -0.729 473 HG LEU 59 HG LEU 59 -5.911 5.682 2.118 474 HD11 LEU 59 HD11 LEU 59 -4.386 3.827 0.306 475 HD12 LEU 59 HD12 LEU 59 -5.089 3.493 1.888 476 HD13 LEU 59 HD13 LEU 59 -3.685 4.549 1.755 477 HD21 LEU 59 HD21 LEU 59 -4.632 6.605 -0.432 478 HD22 LEU 59 HD22 LEU 59 -3.801 6.719 1.111 479 HD23 LEU 59 HD23 LEU 59 -5.327 7.564 0.868 480 H LYS 60 HN LYS 60 -8.410 5.873 -2.418 481 HA LYS 60 HA LYS 60 -11.178 5.387 -2.073 482 HB2 LYS 60 HB2 LYS 60 -9.358 4.507 -4.325 483 HB3 LYS 60 HB1 LYS 60 -11.105 4.689 -4.413 484 HG2 LYS 60 HG2 LYS 60 -10.852 7.106 -4.053 485 HG3 LYS 60 HG1 LYS 60 -9.100 6.904 -3.999 486 HD2 LYS 60 HD2 LYS 60 -9.140 6.028 -6.290 487 HD3 LYS 60 HD1 LYS 60 -10.888 6.270 -6.345 488 HE2 LYS 60 HE2 LYS 60 -9.882 8.124 -7.443 489 HE3 LYS 60 HE1 LYS 60 -10.475 8.694 -5.887 490 HZ1 LYS 60 HZ1 LYS 60 -8.161 8.382 -5.034 491 HZ2 LYS 60 HZ2 LYS 60 -8.327 9.595 -6.205 492 HZ3 LYS 60 HZ3 LYS 60 -7.668 8.095 -6.631 493 HA PRO 61 HA PRO 61 -11.337 1.203 -0.614 494 HB2 PRO 61 HB2 PRO 61 -13.479 0.741 -2.606 495 HB3 PRO 61 HB1 PRO 61 -13.529 0.576 -0.852 496 HG2 PRO 61 HG2 PRO 61 -14.733 2.607 -2.161 497 HG3 PRO 61 HG1 PRO 61 -14.066 2.790 -0.530 498 HD2 PRO 61 HD2 PRO 61 -13.014 3.776 -3.131 499 HD3 PRO 61 HD1 PRO 61 -12.828 4.454 -1.501 500 H SER 62 HN SER 62 -11.244 1.870 -4.050 501 HA SER 62 HA SER 62 -10.573 -0.793 -4.837 502 HB2 SER 62 HB2 SER 62 -9.886 0.364 -6.992 503 HB3 SER 62 HB1 SER 62 -11.562 0.599 -6.506 504 HG SER 62 HG SER 62 -11.173 2.653 -6.468 505 H THR 63 HN THR 63 -8.792 2.124 -4.034 506 HA THR 63 HA THR 63 -6.218 1.239 -4.714 507 HB THR 63 HB THR 63 -6.674 3.054 -2.349 508 HG1 THR 63 HG1 THR 63 -7.147 4.741 -3.774 509 HG21 THR 63 HG21 THR 63 -4.387 2.439 -3.204 510 HG22 THR 63 HG22 THR 63 -4.724 4.164 -3.155 511 HG23 THR 63 HG23 THR 63 -4.781 3.295 -4.687 512 H LEU 64 HN LEU 64 -7.975 1.185 -1.621 513 HA LEU 64 HA LEU 64 -6.048 -0.098 -0.071 514 HB2 LEU 64 HB2 LEU 64 -9.058 -0.161 0.071 515 HB3 LEU 64 HB1 LEU 64 -8.042 -0.934 1.271 516 HG LEU 64 HG LEU 64 -8.015 2.018 0.648 517 HD11 LEU 64 HD11 LEU 64 -10.121 1.311 1.714 518 HD12 LEU 64 HD12 LEU 64 -9.134 2.297 2.785 519 HD13 LEU 64 HD13 LEU 64 -9.192 0.550 3.002 520 HD21 LEU 64 HD21 LEU 64 -5.889 1.338 1.466 521 HD22 LEU 64 HD22 LEU 64 -6.628 0.354 2.722 522 HD23 LEU 64 HD23 LEU 64 -6.752 2.111 2.790 523 H ARG 65 HN ARG 65 -8.469 -1.482 -2.225 524 HA ARG 65 HA ARG 65 -7.889 -4.157 -1.324 525 HB2 ARG 65 HB2 ARG 65 -9.825 -2.907 -3.168 526 HB3 ARG 65 HB1 ARG 65 -9.374 -4.548 -3.541 527 HG2 ARG 65 HG2 ARG 65 -10.515 -3.576 -0.943 528 HG3 ARG 65 HG1 ARG 65 -11.413 -4.473 -2.179 529 HD2 ARG 65 HD2 ARG 65 -9.688 -6.333 -1.778 530 HD3 ARG 65 HD1 ARG 65 -9.248 -5.437 -0.321 531 HE ARG 65 HE ARG 65 -12.078 -6.000 -0.687 532 HH11 ARG 65 HH11 ARG 65 -9.082 -6.991 0.871 533 HH12 ARG 65 HH12 ARG 65 -9.909 -7.905 2.096 534 HH21 ARG 65 HH21 ARG 65 -13.124 -7.198 0.928 535 HH22 ARG 65 HH22 ARG 65 -12.185 -8.037 2.123 536 H GLU 66 HN GLU 66 -6.593 -2.016 -3.648 537 HA GLU 66 HA GLU 66 -5.367 -4.133 -5.194 538 HB2 GLU 66 HB2 GLU 66 -6.030 -2.134 -6.361 539 HB3 GLU 66 HB1 GLU 66 -5.100 -1.125 -5.260 540 HG2 GLU 66 HG2 GLU 66 -3.905 -1.282 -7.302 541 HG3 GLU 66 HG1 GLU 66 -3.037 -2.240 -6.102 542 H LEU 67 HN LEU 67 -4.537 -1.803 -2.697 543 HA LEU 67 HA LEU 67 -1.753 -2.309 -2.634 544 HB2 LEU 67 HB2 LEU 67 -3.588 -1.373 -0.409 545 HB3 LEU 67 HB1 LEU 67 -1.845 -1.173 -0.442 546 HG LEU 67 HG LEU 67 -3.828 0.145 -2.305 547 HD11 LEU 67 HD11 LEU 67 -2.095 1.326 -0.140 548 HD12 LEU 67 HD12 LEU 67 -3.830 1.032 -0.015 549 HD13 LEU 67 HD13 LEU 67 -3.216 2.195 -1.188 550 HD21 LEU 67 HD21 LEU 67 -1.608 -0.440 -3.313 551 HD22 LEU 67 HD22 LEU 67 -0.875 0.650 -2.134 552 HD23 LEU 67 HD23 LEU 67 -2.025 1.270 -3.315 553 H GLU 68 HN GLU 68 -4.500 -3.442 -0.721 554 HA GLU 68 HA GLU 68 -3.044 -5.190 0.966 555 HB2 GLU 68 HB2 GLU 68 -5.263 -4.299 1.522 556 HB3 GLU 68 HB1 GLU 68 -5.972 -5.241 0.219 557 HG2 GLU 68 HG2 GLU 68 -4.726 -7.188 1.554 558 HG3 GLU 68 HG1 GLU 68 -5.046 -6.074 2.882 559 H ARG 69 HN ARG 69 -5.181 -5.919 -1.842 560 HA ARG 69 HA ARG 69 -4.757 -8.655 -1.954 561 HB2 ARG 69 HB2 ARG 69 -6.364 -7.455 -3.380 562 HB3 ARG 69 HB1 ARG 69 -5.029 -6.832 -4.341 563 HG2 ARG 69 HG2 ARG 69 -4.413 -9.321 -4.641 564 HG3 ARG 69 HG1 ARG 69 -6.081 -9.614 -4.149 565 HD2 ARG 69 HD2 ARG 69 -5.867 -9.493 -6.588 566 HD3 ARG 69 HD1 ARG 69 -6.900 -8.215 -5.952 567 HE ARG 69 HE ARG 69 -4.875 -6.743 -6.175 568 HH11 ARG 69 HH11 ARG 69 -5.269 -9.582 -8.190 569 HH12 ARG 69 HH12 ARG 69 -4.327 -8.938 -9.493 570 HH21 ARG 69 HH21 ARG 69 -3.640 -5.887 -7.900 571 HH22 ARG 69 HH22 ARG 69 -3.398 -6.856 -9.328 572 H TYR 70 HN TYR 70 -2.658 -6.113 -3.139 573 HA TYR 70 HA TYR 70 -0.976 -7.913 -4.598 574 HB2 TYR 70 HB2 TYR 70 -1.025 -5.726 -5.463 575 HB3 TYR 70 HB1 TYR 70 -0.790 -5.001 -3.875 576 HD1 TYR 70 HD2 TYR 70 0.914 -6.841 -6.607 577 HD2 TYR 70 HD1 TYR 70 1.353 -4.634 -3.003 578 HE1 TYR 70 HE2 TYR 70 3.337 -6.714 -6.991 579 HE2 TYR 70 HE1 TYR 70 3.780 -4.491 -3.380 580 HH TYR 70 HH TYR 70 5.509 -5.461 -4.568 581 H VAL 71 HN VAL 71 -0.659 -6.169 -1.504 582 HA VAL 71 HA VAL 71 1.964 -7.090 -1.011 583 HB VAL 71 HB VAL 71 1.614 -6.418 1.312 584 HG11 VAL 71 HG11 VAL 71 0.461 -4.071 0.424 585 HG12 VAL 71 HG12 VAL 71 1.238 -4.741 -1.002 586 HG13 VAL 71 HG13 VAL 71 2.176 -4.445 0.463 587 HG21 VAL 71 HG21 VAL 71 -0.502 -6.942 1.960 588 HG22 VAL 71 HG22 VAL 71 -1.228 -6.366 0.457 589 HG23 VAL 71 HG23 VAL 71 -0.677 -5.211 1.672 590 H THR 72 HN THR 72 -1.196 -8.323 0.004 591 HA THR 72 HA THR 72 -0.282 -10.343 1.699 592 HB THR 72 HB THR 72 -2.676 -9.541 1.433 593 HG1 THR 72 HG1 THR 72 -2.453 -11.280 2.746 594 HG21 THR 72 HG21 THR 72 -2.745 -9.869 -1.039 595 HG22 THR 72 HG22 THR 72 -4.093 -10.608 -0.176 596 HG23 THR 72 HG23 THR 72 -2.765 -11.611 -0.762 597 H SER 73 HN SER 73 -0.504 -10.218 -1.786 598 HA SER 73 HA SER 73 -0.079 -12.955 -2.293 599 HB2 SER 73 HB2 SER 73 0.196 -12.365 -4.532 600 HB3 SER 73 HB1 SER 73 -0.722 -10.986 -3.920 601 HG SER 73 HG SER 73 1.122 -9.772 -3.863 602 H CYS 74 HN CYS 74 2.018 -10.344 -1.411 603 HA CYS 74 HA CYS 74 4.448 -11.791 -2.060 604 HB2 CYS 74 HB2 CYS 74 4.317 -9.393 -2.548 605 HB3 CYS 74 HB1 CYS 74 4.023 -9.053 -0.844 606 HG CYS 74 HG CYS 74 6.547 -9.857 0.006 607 H LEU 75 HN LEU 75 2.885 -10.426 0.854 608 HA LEU 75 HA LEU 75 4.665 -11.336 2.775 609 HB2 LEU 75 HB2 LEU 75 1.729 -11.514 3.291 610 HB3 LEU 75 HB1 LEU 75 3.008 -10.972 4.352 611 HG LEU 75 HG LEU 75 2.065 -9.412 1.969 612 HD11 LEU 75 HD11 LEU 75 1.446 -8.772 4.811 613 HD12 LEU 75 HD12 LEU 75 0.417 -9.878 3.907 614 HD13 LEU 75 HD13 LEU 75 0.639 -8.228 3.339 615 HD21 LEU 75 HD21 LEU 75 4.368 -9.028 2.790 616 HD22 LEU 75 HD22 LEU 75 3.698 -8.601 4.363 617 HD23 LEU 75 HD23 LEU 75 3.318 -7.621 2.945 618 H ARG 76 HN ARG 76 2.385 -13.102 0.876 619 HA ARG 76 HA ARG 76 2.784 -15.499 2.517 620 HB2 ARG 76 HB2 ARG 76 0.680 -14.780 0.479 621 HB3 ARG 76 HB1 ARG 76 0.807 -16.365 1.241 622 HG2 ARG 76 HG2 ARG 76 0.144 -15.576 3.296 623 HG3 ARG 76 HG1 ARG 76 0.692 -13.932 2.955 624 HD2 ARG 76 HD2 ARG 76 -1.738 -14.088 3.026 625 HD3 ARG 76 HD1 ARG 76 -1.148 -13.594 1.443 626 HE ARG 76 HE ARG 76 -1.586 -16.416 1.616 627 HH11 ARG 76 HH11 ARG 76 -3.127 -13.310 1.150 628 HH12 ARG 76 HH12 ARG 76 -4.456 -13.957 0.238 629 HH21 ARG 76 HH21 ARG 76 -3.344 -17.277 0.401 630 HH22 ARG 76 HH22 ARG 76 -4.575 -16.212 -0.193 631 H LYS 77 HN LYS 77 4.458 -14.153 0.263 632 HA LYS 77 HA LYS 77 5.556 -16.661 -0.683 633 HB2 LYS 77 HB2 LYS 77 3.723 -16.331 -2.349 634 HB3 LYS 77 HB1 LYS 77 4.451 -14.780 -2.779 635 HG2 LYS 77 HG2 LYS 77 6.564 -16.168 -3.227 636 HG3 LYS 77 HG1 LYS 77 5.470 -17.547 -3.240 637 HD2 LYS 77 HD2 LYS 77 4.125 -16.465 -4.986 638 HD3 LYS 77 HD1 LYS 77 5.246 -15.102 -4.995 639 HE2 LYS 77 HE2 LYS 77 7.064 -16.650 -5.632 640 HE3 LYS 77 HE1 LYS 77 5.888 -17.961 -5.708 641 HZ1 LYS 77 HZ1 LYS 77 6.327 -17.037 -7.892 642 HZ2 LYS 77 HZ2 LYS 77 5.843 -15.504 -7.371 643 HZ3 LYS 77 HZ3 LYS 77 4.720 -16.763 -7.446 644 H LYS 78 HN LYS 78 7.689 -16.241 -0.205 645 HA LYS 78 HA LYS 78 8.492 -13.423 -0.406 646 HB2 LYS 78 HB2 LYS 78 9.075 -15.515 1.645 647 HB3 LYS 78 HB1 LYS 78 10.220 -14.208 1.396 648 HG2 LYS 78 HG2 LYS 78 8.775 -13.638 3.213 649 HG3 LYS 78 HG1 LYS 78 8.406 -12.589 1.847 650 HD2 LYS 78 HD2 LYS 78 6.343 -13.280 2.823 651 HD3 LYS 78 HD1 LYS 78 6.525 -14.111 1.276 652 HE2 LYS 78 HE2 LYS 78 5.692 -15.638 2.972 653 HE3 LYS 78 HE1 LYS 78 7.307 -16.114 2.454 654 HZ1 LYS 78 HZ1 LYS 78 6.719 -14.552 4.909 655 HZ2 LYS 78 HZ2 LYS 78 8.227 -15.146 4.433 656 HZ3 LYS 78 HZ3 LYS 78 6.998 -16.218 4.872 657 H ARG 79 HN ARG 79 9.098 -16.345 -1.869 658 HA ARG 79 HA ARG 79 11.946 -16.297 -1.775 659 HB2 ARG 79 HB2 ARG 79 11.833 -18.153 -3.422 660 HB3 ARG 79 HB1 ARG 79 10.943 -18.426 -1.937 661 HG2 ARG 79 HG2 ARG 79 9.297 -19.101 -3.275 662 HG3 ARG 79 HG1 ARG 79 9.018 -17.383 -3.573 663 HD2 ARG 79 HD2 ARG 79 10.387 -17.436 -5.524 664 HD3 ARG 79 HD1 ARG 79 10.900 -19.086 -5.190 665 HE ARG 79 HE ARG 79 8.191 -19.272 -5.396 666 HH11 ARG 79 HH11 ARG 79 10.683 -17.963 -7.472 667 HH12 ARG 79 HH12 ARG 79 9.894 -18.436 -8.941 668 HH21 ARG 79 HH21 ARG 79 7.146 -19.912 -7.335 669 HH22 ARG 79 HH22 ARG 79 7.885 -19.548 -8.862 670 H LYS 80 HN LYS 80 12.151 -14.059 -2.433 671 HA LYS 80 HA LYS 80 13.015 -14.032 -5.209 672 HB2 LYS 80 HB2 LYS 80 10.965 -12.145 -4.107 673 HB3 LYS 80 HB1 LYS 80 12.094 -11.593 -5.333 674 HG2 LYS 80 HG2 LYS 80 11.297 -13.659 -6.661 675 HG3 LYS 80 HG1 LYS 80 9.935 -13.647 -5.540 676 HD2 LYS 80 HD2 LYS 80 9.300 -12.400 -7.477 677 HD3 LYS 80 HD1 LYS 80 9.555 -11.255 -6.160 678 HE2 LYS 80 HE2 LYS 80 11.854 -10.859 -7.049 679 HE3 LYS 80 HE1 LYS 80 11.444 -11.878 -8.425 680 HZ1 LYS 80 HZ1 LYS 80 11.092 -9.674 -9.093 681 HZ2 LYS 80 HZ2 LYS 80 10.267 -9.266 -7.674 682 HZ3 LYS 80 HZ3 LYS 80 9.548 -10.299 -8.810 683 HA PRO 81 HA PRO 81 15.959 -11.948 -2.302 684 HB2 PRO 81 HB2 PRO 81 18.150 -13.362 -2.980 685 HB3 PRO 81 HB1 PRO 81 16.990 -13.942 -1.778 686 HG2 PRO 81 HG2 PRO 81 17.264 -14.694 -4.660 687 HG3 PRO 81 HG1 PRO 81 16.973 -15.737 -3.256 688 HD2 PRO 81 HD2 PRO 81 14.997 -14.919 -4.952 689 HD3 PRO 81 HD1 PRO 81 14.723 -15.290 -3.236 690 H GLN 82 HN GLN 82 16.720 -10.062 -3.021 691 HA GLN 82 HA GLN 82 17.872 -9.948 -5.734 692 HB2 GLN 82 HB2 GLN 82 15.780 -8.599 -5.400 693 HB3 GLN 82 HB1 GLN 82 16.641 -7.655 -4.192 694 HG2 GLN 82 HG2 GLN 82 18.272 -6.992 -5.914 695 HG3 GLN 82 HG1 GLN 82 17.329 -7.875 -7.112 696 HE21 GLN 82 HE21 GLN 82 17.517 -5.060 -5.124 697 HE22 GLN 82 HE22 GLN 82 16.194 -4.207 -5.843 698 H ALA 83 HN ALA 83 18.054 -8.627 -2.460 699 HA ALA 83 HA ALA 83 20.878 -7.975 -2.898 700 HB1 ALA 83 HB1 ALA 83 20.701 -6.632 -0.862 701 HB2 ALA 83 HB2 ALA 83 19.027 -7.147 -0.664 702 HB3 ALA 83 HB3 ALA 83 19.486 -6.153 -2.046 703 H1 GLU 201 HT1 GLU 201 -5.835 8.049 13.533 704 H2 GLU 201 HT2 GLU 201 -6.708 7.632 12.150 705 H3 GLU 201 HT3 GLU 201 -6.916 9.155 12.849 706 HA GLU 201 HA GLU 201 -5.571 9.327 10.878 707 HB2 GLU 201 HB2 GLU 201 -5.112 10.850 12.762 708 HB3 GLU 201 HB1 GLU 201 -3.981 9.685 13.433 709 HG2 GLU 201 HG2 GLU 201 -2.718 11.376 12.355 710 HG3 GLU 201 HG1 GLU 201 -2.616 9.926 11.359 711 H ILE 202 HN ILE 202 -4.835 7.784 9.556 712 HA ILE 202 HA ILE 202 -2.623 6.097 10.528 713 HB ILE 202 HB ILE 202 -4.765 5.322 8.540 714 HG12 ILE 202 HG12 ILE 202 -5.480 5.277 10.917 715 HG13 ILE 202 HG11 ILE 202 -5.478 3.685 10.168 716 HG21 ILE 202 HG21 ILE 202 -3.672 3.116 8.509 717 HG22 ILE 202 HG22 ILE 202 -2.379 3.757 9.521 718 HG23 ILE 202 HG23 ILE 202 -2.618 4.388 7.893 719 HD11 ILE 202 HD11 ILE 202 -3.405 3.131 11.283 720 HD12 ILE 202 HD12 ILE 202 -4.612 3.658 12.458 721 HD13 ILE 202 HD13 ILE 202 -3.317 4.753 11.971 722 H LYS 203 HN LYS 203 -1.028 7.426 9.768 723 HA LYS 203 HA LYS 203 -0.947 7.949 6.878 724 HB2 LYS 203 HB2 LYS 203 0.748 9.086 9.106 725 HB3 LYS 203 HB1 LYS 203 0.891 9.508 7.409 726 HG2 LYS 203 HG2 LYS 203 -1.413 10.399 7.478 727 HG3 LYS 203 HG1 LYS 203 -1.455 10.061 9.211 728 HD2 LYS 203 HD2 LYS 203 0.557 11.852 7.847 729 HD3 LYS 203 HD1 LYS 203 -0.882 12.417 8.694 730 HE2 LYS 203 HE2 LYS 203 -0.073 11.647 10.779 731 HE3 LYS 203 HE1 LYS 203 1.209 10.708 10.018 732 HZ1 LYS 203 HZ1 LYS 203 2.007 12.780 11.022 733 HZ2 LYS 203 HZ2 LYS 203 1.031 13.669 9.966 734 HZ3 LYS 203 HZ3 LYS 203 2.297 12.725 9.359 735 H LEU 204 HN LEU 204 0.380 6.770 5.635 736 HA LEU 204 HA LEU 204 2.470 5.197 6.984 737 HB2 LEU 204 HB2 LEU 204 0.564 4.317 5.247 738 HB3 LEU 204 HB1 LEU 204 1.887 4.649 4.149 739 HG LEU 204 HG LEU 204 1.876 2.708 6.457 740 HD11 LEU 204 HD11 LEU 204 2.387 2.236 3.531 741 HD12 LEU 204 HD12 LEU 204 0.817 2.030 4.305 742 HD13 LEU 204 HD13 LEU 204 2.183 1.029 4.800 743 HD21 LEU 204 HD21 LEU 204 4.207 3.343 4.657 744 HD22 LEU 204 HD22 LEU 204 4.165 2.195 5.991 745 HD23 LEU 204 HD23 LEU 204 4.042 3.924 6.313 746 H LYS 205 HN LYS 205 4.265 6.407 7.019 747 HA LYS 205 HA LYS 205 5.139 7.858 4.653 748 HB2 LYS 205 HB2 LYS 205 6.438 7.406 7.350 749 HB3 LYS 205 HB1 LYS 205 7.173 8.330 6.054 750 HG2 LYS 205 HG2 LYS 205 4.537 9.039 7.309 751 HG3 LYS 205 HG1 LYS 205 6.090 9.665 7.861 752 HD2 LYS 205 HD2 LYS 205 6.235 10.195 5.203 753 HD3 LYS 205 HD1 LYS 205 4.501 10.370 5.490 754 HE2 LYS 205 HE2 LYS 205 5.050 11.877 7.408 755 HE3 LYS 205 HE1 LYS 205 6.745 11.795 6.918 756 HZ1 LYS 205 HZ1 LYS 205 6.044 12.700 4.736 757 HZ2 LYS 205 HZ2 LYS 205 5.788 13.763 6.022 758 HZ3 LYS 205 HZ3 LYS 205 4.480 12.924 5.353 759 H ILE 206 HN ILE 206 5.346 6.006 3.203 760 HA ILE 206 HA ILE 206 7.151 3.903 3.981 761 HB ILE 206 HB ILE 206 6.579 4.333 1.076 762 HG12 ILE 206 HG12 ILE 206 4.620 2.830 2.790 763 HG13 ILE 206 HG11 ILE 206 4.363 4.540 2.423 764 HG21 ILE 206 HG21 ILE 206 6.219 1.696 2.229 765 HG22 ILE 206 HG22 ILE 206 7.774 2.411 2.690 766 HG23 ILE 206 HG23 ILE 206 7.354 2.245 0.991 767 HD11 ILE 206 HD11 ILE 206 4.946 2.746 0.146 768 HD12 ILE 206 HD12 ILE 206 3.852 4.115 0.261 769 HD13 ILE 206 HD13 ILE 206 3.383 2.560 0.938 770 H THR 207 HN THR 207 9.113 4.787 4.468 771 HA THR 207 HA THR 207 10.457 6.512 2.580 772 HB THR 207 HB THR 207 12.419 6.048 4.263 773 HG1 THR 207 HG1 THR 207 11.132 4.299 5.279 774 HG21 THR 207 HG21 THR 207 11.553 7.804 5.751 775 HG22 THR 207 HG22 THR 207 9.947 7.594 5.053 776 HG23 THR 207 HG23 THR 207 11.273 8.189 4.054 777 H LYS 208 HN LYS 208 11.281 5.678 0.798 778 HA LYS 208 HA LYS 208 13.149 3.565 0.802 779 HB2 LYS 208 HB2 LYS 208 12.023 1.798 -0.260 780 HB3 LYS 208 HB1 LYS 208 10.915 2.313 0.999 781 HG2 LYS 208 HG2 LYS 208 10.671 3.280 -1.832 782 HG3 LYS 208 HG1 LYS 208 9.935 1.780 -1.283 783 HD2 LYS 208 HD2 LYS 208 8.231 2.888 -0.418 784 HD3 LYS 208 HD1 LYS 208 9.309 3.906 0.536 785 HE2 LYS 208 HE2 LYS 208 8.706 4.380 -2.373 786 HE3 LYS 208 HE1 LYS 208 7.778 5.106 -1.063 787 HZ1 LYS 208 HZ1 LYS 208 9.779 6.180 -0.278 788 HZ2 LYS 208 HZ2 LYS 208 9.494 6.581 -1.900 789 HZ3 LYS 208 HZ3 LYS 208 10.692 5.455 -1.510 790 H THR 209 HN THR 209 13.009 2.736 -1.811 791 HA THR 209 HA THR 209 13.666 3.260 -3.887 792 HB THR 209 HB THR 209 12.482 5.108 -5.097 793 HG1 THR 209 HG1 THR 209 11.967 6.556 -3.505 794 HG21 THR 209 HG21 THR 209 10.479 3.386 -3.658 795 HG22 THR 209 HG22 THR 209 11.642 2.701 -4.794 796 HG23 THR 209 HG23 THR 209 10.489 3.917 -5.341 797 H ILE 210 HN ILE 210 14.908 4.716 -1.471 798 HA ILE 210 HA ILE 210 16.032 7.089 -2.626 799 HB ILE 210 HB ILE 210 15.788 6.961 -0.214 800 HG12 ILE 210 HG12 ILE 210 18.711 6.915 -0.999 801 HG13 ILE 210 HG11 ILE 210 17.643 8.309 -1.126 802 HG21 ILE 210 HG21 ILE 210 15.998 4.576 0.111 803 HG22 ILE 210 HG22 ILE 210 17.152 5.423 1.142 804 HG23 ILE 210 HG23 ILE 210 17.704 4.636 -0.337 805 HD11 ILE 210 HD11 ILE 210 17.373 8.309 1.303 806 HD12 ILE 210 HD12 ILE 210 19.063 8.473 0.827 807 HD13 ILE 210 HD13 ILE 210 18.457 6.925 1.418 808 H GLN 211 HN GLN 211 16.794 3.722 -2.490 809 HA GLN 211 HA GLN 211 19.230 4.229 -4.063 810 HB2 GLN 211 HB2 GLN 211 18.656 2.012 -2.094 811 HB3 GLN 211 HB1 GLN 211 20.013 1.987 -3.210 812 HG2 GLN 211 HG2 GLN 211 19.542 4.130 -1.154 813 HG3 GLN 211 HG1 GLN 211 20.604 2.741 -0.931 814 HE21 GLN 211 HE21 GLN 211 20.129 5.752 -2.623 815 HE22 GLN 211 HE22 GLN 211 21.759 5.913 -3.184 816 H ASN 212 HN ASN 212 17.618 4.299 -5.816 817 HA ASN 212 HA ASN 212 16.598 1.666 -6.576 818 HB2 ASN 212 HB2 ASN 212 15.263 2.879 -8.279 819 HB3 ASN 212 HB1 ASN 212 14.919 3.417 -6.641 820 HD21 ASN 212 HD21 ASN 212 15.490 5.479 -6.015 821 HD22 ASN 212 HD22 ASN 212 15.964 6.694 -7.153 Start of MODEL 15 1 H1 SER 1 HT1 SER 1 -17.069 -7.703 -12.673 2 H2 SER 1 HT2 SER 1 -16.551 -8.400 -11.224 3 H3 SER 1 HT3 SER 1 -16.444 -9.270 -12.667 4 HA SER 1 HA SER 1 -14.294 -8.442 -11.975 5 HB2 SER 1 HB2 SER 1 -15.239 -6.983 -14.444 6 HB3 SER 1 HB1 SER 1 -13.645 -7.674 -14.129 7 HG SER 1 HG SER 1 -14.344 -9.506 -14.866 8 H GLU 2 HN GLU 2 -16.805 -6.002 -12.133 9 HA GLU 2 HA GLU 2 -14.999 -3.783 -11.817 10 HB2 GLU 2 HB2 GLU 2 -17.038 -2.429 -11.628 11 HB3 GLU 2 HB1 GLU 2 -17.081 -3.473 -13.037 12 HG2 GLU 2 HG2 GLU 2 -18.571 -4.997 -11.928 13 HG3 GLU 2 HG1 GLU 2 -18.436 -4.089 -10.424 14 H GLU 3 HN GLU 3 -16.299 -6.051 -9.724 15 HA GLU 3 HA GLU 3 -17.011 -4.567 -7.481 16 HB2 GLU 3 HB2 GLU 3 -16.894 -6.599 -6.247 17 HB3 GLU 3 HB1 GLU 3 -17.525 -6.958 -7.850 18 HG2 GLU 3 HG2 GLU 3 -15.368 -7.748 -8.559 19 HG3 GLU 3 HG1 GLU 3 -14.686 -7.281 -7.005 20 H GLU 4 HN GLU 4 -13.886 -5.121 -8.747 21 HA GLU 4 HA GLU 4 -12.579 -4.752 -6.188 22 HB2 GLU 4 HB2 GLU 4 -10.470 -4.821 -7.447 23 HB3 GLU 4 HB1 GLU 4 -11.494 -6.199 -7.827 24 HG2 GLU 4 HG2 GLU 4 -12.152 -5.171 -9.917 25 HG3 GLU 4 HG1 GLU 4 -11.206 -3.734 -9.530 26 H ASP 5 HN ASP 5 -13.434 -2.827 -8.982 27 HA ASP 5 HA ASP 5 -11.904 -0.558 -8.006 28 HB2 ASP 5 HB2 ASP 5 -13.602 -0.885 -10.496 29 HB3 ASP 5 HB1 ASP 5 -12.748 0.599 -10.067 30 H LYS 6 HN LYS 6 -15.036 -1.831 -7.668 31 HA LYS 6 HA LYS 6 -15.899 0.715 -6.468 32 HB2 LYS 6 HB2 LYS 6 -17.147 0.130 -8.573 33 HB3 LYS 6 HB1 LYS 6 -17.734 -1.317 -7.766 34 HG2 LYS 6 HG2 LYS 6 -19.415 0.437 -7.720 35 HG3 LYS 6 HG1 LYS 6 -18.853 0.101 -6.079 36 HD2 LYS 6 HD2 LYS 6 -17.383 2.054 -6.183 37 HD3 LYS 6 HD1 LYS 6 -17.934 2.388 -7.825 38 HE2 LYS 6 HE2 LYS 6 -20.198 2.732 -7.013 39 HE3 LYS 6 HE1 LYS 6 -19.689 2.335 -5.373 40 HZ1 LYS 6 HZ1 LYS 6 -18.235 4.270 -5.405 41 HZ2 LYS 6 HZ2 LYS 6 -19.839 4.718 -5.692 42 HZ3 LYS 6 HZ3 LYS 6 -18.740 4.652 -6.974 43 H CYS 7 HN CYS 7 -14.419 -1.386 -5.335 44 HA CYS 7 HA CYS 7 -16.011 -3.157 -3.783 45 HB2 CYS 7 HB2 CYS 7 -13.579 -3.470 -4.330 46 HB3 CYS 7 HB1 CYS 7 -13.205 -2.186 -3.184 47 HG CYS 7 HG CYS 7 -13.939 -3.523 -0.937 48 H LYS 8 HN LYS 8 -16.280 -3.124 -1.471 49 HA LYS 8 HA LYS 8 -16.851 -0.491 -0.417 50 HB2 LYS 8 HB2 LYS 8 -17.367 -3.302 0.465 51 HB3 LYS 8 HB1 LYS 8 -17.417 -2.021 1.662 52 HG2 LYS 8 HG2 LYS 8 -19.633 -2.524 0.810 53 HG3 LYS 8 HG1 LYS 8 -19.149 -0.880 0.405 54 HD2 LYS 8 HD2 LYS 8 -18.548 -1.635 -1.857 55 HD3 LYS 8 HD1 LYS 8 -19.080 -3.265 -1.442 56 HE2 LYS 8 HE2 LYS 8 -20.795 -2.041 -2.694 57 HE3 LYS 8 HE1 LYS 8 -21.341 -2.459 -1.072 58 HZ1 LYS 8 HZ1 LYS 8 -20.279 0.198 -1.867 59 HZ2 LYS 8 HZ2 LYS 8 -20.915 -0.216 -0.356 60 HZ3 LYS 8 HZ3 LYS 8 -21.920 -0.180 -1.714 61 HA PRO 9 HA PRO 9 -13.023 0.144 1.688 62 HB2 PRO 9 HB2 PRO 9 -14.509 1.239 3.963 63 HB3 PRO 9 HB1 PRO 9 -13.348 2.026 2.889 64 HG2 PRO 9 HG2 PRO 9 -16.003 2.554 2.812 65 HG3 PRO 9 HG1 PRO 9 -14.957 2.660 1.389 66 HD2 PRO 9 HD2 PRO 9 -16.926 0.562 2.147 67 HD3 PRO 9 HD1 PRO 9 -16.453 1.147 0.541 68 H MET 10 HN MET 10 -11.792 -1.086 2.945 69 HA MET 10 HA MET 10 -12.945 -3.044 4.694 70 HB2 MET 10 HB2 MET 10 -10.625 -3.688 5.163 71 HB3 MET 10 HB1 MET 10 -10.912 -3.558 3.439 72 HG2 MET 10 HG2 MET 10 -9.859 -1.345 3.447 73 HG3 MET 10 HG1 MET 10 -9.507 -1.552 5.161 74 HE1 MET 10 HE1 MET 10 -8.984 -3.039 1.589 75 HE2 MET 10 HE2 MET 10 -9.359 -4.500 2.503 76 HE3 MET 10 HE3 MET 10 -7.735 -4.253 1.864 77 H SER 11 HN SER 11 -12.332 -3.195 6.987 78 HA SER 11 HA SER 11 -13.178 -0.778 8.225 79 HB2 SER 11 HB2 SER 11 -13.102 -2.111 10.318 80 HB3 SER 11 HB1 SER 11 -13.988 -2.914 9.022 81 HG SER 11 HG SER 11 -12.167 -4.210 8.632 82 H TYR 12 HN TYR 12 -12.120 -0.260 10.473 83 HA TYR 12 HA TYR 12 -9.727 1.116 9.995 84 HB2 TYR 12 HB2 TYR 12 -11.403 1.629 11.766 85 HB3 TYR 12 HB1 TYR 12 -10.853 0.219 12.663 86 HD1 TYR 12 HD1 TYR 12 -8.358 0.203 13.349 87 HD2 TYR 12 HD2 TYR 12 -10.442 3.699 12.144 88 HE1 TYR 12 HE1 TYR 12 -6.705 1.587 14.537 89 HE2 TYR 12 HE2 TYR 12 -8.793 5.098 13.311 90 HH TYR 12 HH TYR 12 -7.191 4.845 15.215 91 H GLU 13 HN GLU 13 -10.288 -2.026 11.526 92 HA GLU 13 HA GLU 13 -7.658 -2.525 12.384 93 HB2 GLU 13 HB2 GLU 13 -9.677 -3.813 13.090 94 HB3 GLU 13 HB1 GLU 13 -9.721 -4.558 11.496 95 HG2 GLU 13 HG2 GLU 13 -7.519 -5.540 11.898 96 HG3 GLU 13 HG1 GLU 13 -7.499 -4.818 13.508 97 H GLU 14 HN GLU 14 -9.256 -3.000 9.312 98 HA GLU 14 HA GLU 14 -7.172 -4.656 8.216 99 HB2 GLU 14 HB2 GLU 14 -9.576 -3.326 6.966 100 HB3 GLU 14 HB1 GLU 14 -8.485 -4.394 6.097 101 HG2 GLU 14 HG2 GLU 14 -9.123 -6.264 7.390 102 HG3 GLU 14 HG1 GLU 14 -9.953 -5.248 8.573 103 H LYS 15 HN LYS 15 -8.291 -1.317 7.720 104 HA LYS 15 HA LYS 15 -6.397 -0.509 5.855 105 HB2 LYS 15 HB2 LYS 15 -7.836 1.000 8.031 106 HB3 LYS 15 HB1 LYS 15 -6.775 1.788 6.874 107 HG2 LYS 15 HG2 LYS 15 -8.184 1.397 5.091 108 HG3 LYS 15 HG1 LYS 15 -8.995 0.061 5.916 109 HD2 LYS 15 HD2 LYS 15 -10.277 1.463 7.245 110 HD3 LYS 15 HD1 LYS 15 -9.191 2.832 7.042 111 HE2 LYS 15 HE2 LYS 15 -10.520 1.835 4.592 112 HE3 LYS 15 HE1 LYS 15 -11.563 2.591 5.793 113 HZ1 LYS 15 HZ1 LYS 15 -10.758 4.211 4.215 114 HZ2 LYS 15 HZ2 LYS 15 -9.151 3.823 4.574 115 HZ3 LYS 15 HZ3 LYS 15 -10.131 4.539 5.757 116 H ARG 16 HN ARG 16 -6.244 -0.503 9.393 117 HA ARG 16 HA ARG 16 -3.680 0.609 9.678 118 HB2 ARG 16 HB2 ARG 16 -5.276 0.298 11.547 119 HB3 ARG 16 HB1 ARG 16 -5.034 -1.443 11.445 120 HG2 ARG 16 HG2 ARG 16 -2.483 -0.633 11.737 121 HG3 ARG 16 HG1 ARG 16 -3.322 0.645 12.619 122 HD2 ARG 16 HD2 ARG 16 -2.786 -1.093 14.172 123 HD3 ARG 16 HD1 ARG 16 -4.528 -1.128 13.897 124 HE ARG 16 HE ARG 16 -2.823 -2.933 12.342 125 HH11 ARG 16 HH11 ARG 16 -5.229 -2.508 14.855 126 HH12 ARG 16 HH12 ARG 16 -5.598 -4.199 14.956 127 HH21 ARG 16 HH21 ARG 16 -3.319 -5.162 12.470 128 HH22 ARG 16 HH22 ARG 16 -4.519 -5.700 13.606 129 H GLN 17 HN GLN 17 -4.727 -2.765 9.397 130 HA GLN 17 HA GLN 17 -2.175 -3.903 9.709 131 HB2 GLN 17 HB2 GLN 17 -4.390 -5.070 9.984 132 HB3 GLN 17 HB1 GLN 17 -4.519 -5.089 8.231 133 HG2 GLN 17 HG2 GLN 17 -3.710 -7.212 9.059 134 HG3 GLN 17 HG1 GLN 17 -2.478 -6.405 8.090 135 HE21 GLN 17 HE21 GLN 17 -0.802 -7.528 9.037 136 HE22 GLN 17 HE22 GLN 17 -0.286 -7.235 10.661 137 H LEU 18 HN LEU 18 -3.828 -2.526 7.032 138 HA LEU 18 HA LEU 18 -2.244 -3.686 4.961 139 HB2 LEU 18 HB2 LEU 18 -4.571 -2.246 5.098 140 HB3 LEU 18 HB1 LEU 18 -3.453 -1.045 4.490 141 HG LEU 18 HG LEU 18 -3.903 -3.727 3.181 142 HD11 LEU 18 HD11 LEU 18 -5.081 -1.042 2.509 143 HD12 LEU 18 HD12 LEU 18 -5.957 -2.424 3.163 144 HD13 LEU 18 HD13 LEU 18 -5.250 -2.507 1.549 145 HD21 LEU 18 HD21 LEU 18 -1.787 -2.803 2.560 146 HD22 LEU 18 HD22 LEU 18 -2.499 -1.216 2.298 147 HD23 LEU 18 HD23 LEU 18 -2.904 -2.555 1.225 148 H SER 19 HN SER 19 -2.141 -0.639 6.768 149 HA SER 19 HA SER 19 0.121 0.447 5.507 150 HB2 SER 19 HB2 SER 19 -0.509 0.694 8.458 151 HB3 SER 19 HB1 SER 19 0.340 1.857 7.442 152 HG SER 19 HG SER 19 -2.138 1.263 6.486 153 H LEU 20 HN LEU 20 -0.281 -1.968 7.963 154 HA LEU 20 HA LEU 20 2.472 -2.154 8.686 155 HB2 LEU 20 HB2 LEU 20 0.110 -3.946 9.199 156 HB3 LEU 20 HB1 LEU 20 1.695 -4.205 9.883 157 HG LEU 20 HG LEU 20 0.020 -1.752 10.377 158 HD11 LEU 20 HD11 LEU 20 -0.743 -4.051 11.261 159 HD12 LEU 20 HD12 LEU 20 -0.671 -2.690 12.378 160 HD13 LEU 20 HD13 LEU 20 0.616 -3.898 12.370 161 HD21 LEU 20 HD21 LEU 20 2.530 -1.552 10.532 162 HD22 LEU 20 HD22 LEU 20 2.461 -2.719 11.846 163 HD23 LEU 20 HD23 LEU 20 1.643 -1.165 12.003 164 H ASP 21 HN ASP 21 0.399 -3.729 6.337 165 HA ASP 21 HA ASP 21 2.230 -5.912 5.974 166 HB2 ASP 21 HB2 ASP 21 0.649 -6.753 4.312 167 HB3 ASP 21 HB1 ASP 21 -0.145 -6.350 5.818 168 H ILE 22 HN ILE 22 1.510 -2.918 4.267 169 HA ILE 22 HA ILE 22 3.222 -3.493 2.042 170 HB ILE 22 HB ILE 22 2.299 -0.831 3.150 171 HG12 ILE 22 HG12 ILE 22 1.295 -2.234 0.683 172 HG13 ILE 22 HG11 ILE 22 0.599 -2.571 2.270 173 HG21 ILE 22 HG21 ILE 22 4.179 -0.312 1.853 174 HG22 ILE 22 HG22 ILE 22 2.791 -0.056 0.789 175 HG23 ILE 22 HG23 ILE 22 3.763 -1.518 0.632 176 HD11 ILE 22 HD11 ILE 22 0.080 -0.211 2.501 177 HD12 ILE 22 HD12 ILE 22 -0.716 -0.930 1.110 178 HD13 ILE 22 HD13 ILE 22 0.704 0.095 0.888 179 H ASN 23 HN ASN 23 3.640 -2.009 5.183 180 HA ASN 23 HA ASN 23 6.261 -1.067 4.869 181 HB2 ASN 23 HB2 ASN 23 5.167 -0.236 6.732 182 HB3 ASN 23 HB1 ASN 23 4.532 -1.804 7.204 183 HD21 ASN 23 HD21 ASN 23 5.838 -3.143 8.528 184 HD22 ASN 23 HD22 ASN 23 7.326 -2.598 9.247 185 H LYS 24 HN LYS 24 5.006 -4.251 5.144 186 HA LYS 24 HA LYS 24 7.389 -5.504 6.132 187 HB2 LYS 24 HB2 LYS 24 4.888 -6.563 4.837 188 HB3 LYS 24 HB1 LYS 24 6.229 -7.610 5.289 189 HG2 LYS 24 HG2 LYS 24 5.982 -6.947 7.608 190 HG3 LYS 24 HG1 LYS 24 4.689 -5.829 7.170 191 HD2 LYS 24 HD2 LYS 24 3.366 -7.733 6.341 192 HD3 LYS 24 HD1 LYS 24 4.647 -8.830 6.861 193 HE2 LYS 24 HE2 LYS 24 3.059 -6.988 8.643 194 HE3 LYS 24 HE1 LYS 24 2.841 -8.730 8.502 195 HZ1 LYS 24 HZ1 LYS 24 5.326 -7.404 9.440 196 HZ2 LYS 24 HZ2 LYS 24 5.042 -9.070 9.383 197 HZ3 LYS 24 HZ3 LYS 24 4.159 -8.099 10.446 198 H LEU 25 HN LEU 25 6.057 -4.771 2.984 199 HA LEU 25 HA LEU 25 7.640 -6.502 1.438 200 HB2 LEU 25 HB2 LEU 25 6.554 -3.811 0.680 201 HB3 LEU 25 HB1 LEU 25 7.098 -5.031 -0.438 202 HG LEU 25 HG LEU 25 4.640 -5.039 1.276 203 HD11 LEU 25 HD11 LEU 25 5.146 -5.330 -1.665 204 HD12 LEU 25 HD12 LEU 25 4.479 -3.917 -0.855 205 HD13 LEU 25 HD13 LEU 25 3.567 -5.426 -0.895 206 HD21 LEU 25 HD21 LEU 25 5.939 -7.307 -0.150 207 HD22 LEU 25 HD22 LEU 25 4.253 -7.320 0.340 208 HD23 LEU 25 HD23 LEU 25 5.532 -7.218 1.555 209 HA PRO 26 HA PRO 26 11.717 -4.574 1.761 210 HB2 PRO 26 HB2 PRO 26 12.044 -6.156 -0.743 211 HB3 PRO 26 HB1 PRO 26 13.072 -6.102 0.694 212 HG2 PRO 26 HG2 PRO 26 11.494 -8.197 0.215 213 HG3 PRO 26 HG1 PRO 26 11.736 -7.592 1.864 214 HD2 PRO 26 HD2 PRO 26 9.387 -7.262 0.048 215 HD3 PRO 26 HD1 PRO 26 9.436 -7.473 1.810 216 H GLY 27 HN GLY 27 12.817 -2.977 0.535 217 HA2 GLY 27 HA2 GLY 27 11.269 -1.027 -0.530 218 HA3 GLY 27 HA1 GLY 27 12.971 -1.188 -0.897 219 H GLU 28 HN GLU 28 12.830 -3.564 -2.455 220 HA GLU 28 HA GLU 28 12.227 -2.500 -4.979 221 HB2 GLU 28 HB2 GLU 28 13.854 -4.270 -4.774 222 HB3 GLU 28 HB1 GLU 28 12.689 -5.327 -4.024 223 HG2 GLU 28 HG2 GLU 28 11.431 -5.256 -6.232 224 HG3 GLU 28 HG1 GLU 28 12.909 -4.565 -6.890 225 H LYS 29 HN LYS 29 10.526 -5.056 -3.165 226 HA LYS 29 HA LYS 29 8.274 -5.220 -4.848 227 HB2 LYS 29 HB2 LYS 29 8.665 -5.876 -1.925 228 HB3 LYS 29 HB1 LYS 29 7.214 -6.284 -2.828 229 HG2 LYS 29 HG2 LYS 29 9.953 -7.223 -3.615 230 HG3 LYS 29 HG1 LYS 29 8.889 -8.127 -2.538 231 HD2 LYS 29 HD2 LYS 29 7.161 -8.098 -4.330 232 HD3 LYS 29 HD1 LYS 29 8.352 -7.370 -5.404 233 HE2 LYS 29 HE2 LYS 29 8.157 -9.815 -5.696 234 HE3 LYS 29 HE1 LYS 29 9.775 -9.305 -5.225 235 HZ1 LYS 29 HZ1 LYS 29 9.387 -10.028 -3.006 236 HZ2 LYS 29 HZ2 LYS 29 8.928 -11.292 -4.029 237 HZ3 LYS 29 HZ3 LYS 29 7.749 -10.322 -3.312 238 H LEU 30 HN LEU 30 9.065 -3.304 -2.062 239 HA LEU 30 HA LEU 30 6.551 -2.210 -1.450 240 HB2 LEU 30 HB2 LEU 30 8.476 -2.165 0.048 241 HB3 LEU 30 HB1 LEU 30 9.343 -1.121 -1.059 242 HG LEU 30 HG LEU 30 7.979 0.729 -0.554 243 HD11 LEU 30 HD11 LEU 30 6.158 -0.753 1.242 244 HD12 LEU 30 HD12 LEU 30 5.893 -0.902 -0.484 245 HD13 LEU 30 HD13 LEU 30 5.868 0.680 0.272 246 HD21 LEU 30 HD21 LEU 30 8.161 0.889 1.890 247 HD22 LEU 30 HD22 LEU 30 9.611 0.184 1.174 248 HD23 LEU 30 HD23 LEU 30 8.431 -0.851 1.978 249 H GLY 31 HN GLY 31 9.057 -1.166 -3.730 250 HA2 GLY 31 HA2 GLY 31 8.193 1.401 -4.311 251 HA3 GLY 31 HA1 GLY 31 8.986 0.348 -5.465 252 H ARG 32 HN ARG 32 6.832 -1.642 -5.407 253 HA ARG 32 HA ARG 32 5.197 -0.673 -7.476 254 HB2 ARG 32 HB2 ARG 32 5.570 -3.058 -7.131 255 HB3 ARG 32 HB1 ARG 32 4.762 -2.974 -5.577 256 HG2 ARG 32 HG2 ARG 32 3.231 -3.943 -7.129 257 HG3 ARG 32 HG1 ARG 32 2.679 -2.309 -6.785 258 HD2 ARG 32 HD2 ARG 32 2.489 -2.683 -9.143 259 HD3 ARG 32 HD1 ARG 32 3.807 -1.547 -8.866 260 HE ARG 32 HE ARG 32 5.030 -3.987 -8.940 261 HH11 ARG 32 HH11 ARG 32 2.987 -2.163 -11.111 262 HH12 ARG 32 HH12 ARG 32 3.589 -2.945 -12.538 263 HH21 ARG 32 HH21 ARG 32 5.843 -5.014 -10.818 264 HH22 ARG 32 HH22 ARG 32 5.222 -4.562 -12.376 265 H VAL 33 HN VAL 33 4.592 -1.043 -4.010 266 HA VAL 33 HA VAL 33 1.824 -0.355 -4.177 267 HB VAL 33 HB VAL 33 3.169 0.058 -1.590 268 HG11 VAL 33 HG11 VAL 33 0.832 -1.631 -2.468 269 HG12 VAL 33 HG12 VAL 33 0.742 0.046 -1.921 270 HG13 VAL 33 HG13 VAL 33 1.266 -1.210 -0.810 271 HG21 VAL 33 HG21 VAL 33 4.560 -1.742 -2.244 272 HG22 VAL 33 HG22 VAL 33 3.219 -2.594 -3.011 273 HG23 VAL 33 HG23 VAL 33 3.283 -2.448 -1.255 274 H VAL 34 HN VAL 34 4.681 1.449 -3.040 275 HA VAL 34 HA VAL 34 3.478 3.893 -2.499 276 HB VAL 34 HB VAL 34 5.635 4.386 -2.094 277 HG11 VAL 34 HG11 VAL 34 6.147 2.056 -2.219 278 HG12 VAL 34 HG12 VAL 34 7.489 3.016 -2.840 279 HG13 VAL 34 HG13 VAL 34 6.408 2.179 -3.956 280 HG21 VAL 34 HG21 VAL 34 5.544 5.808 -4.039 281 HG22 VAL 34 HG22 VAL 34 5.954 4.461 -5.090 282 HG23 VAL 34 HG23 VAL 34 7.139 5.074 -3.938 283 H HIS 35 HN HIS 35 4.477 2.518 -5.562 284 HA HIS 35 HA HIS 35 3.686 4.687 -7.197 285 HB2 HIS 35 HB2 HIS 35 5.225 2.930 -7.969 286 HB3 HIS 35 HB1 HIS 35 3.907 1.766 -7.919 287 HD1 HIS 35 HD1 HIS 35 4.959 4.893 -9.772 288 HD2 HIS 35 HD2 HIS 35 2.379 1.663 -10.199 289 HE1 HIS 35 HE1 HIS 35 4.013 5.084 -12.095 290 HE2 HIS 35 HE2 HIS 35 2.358 3.194 -12.282 291 H ILE 36 HN ILE 36 1.974 1.727 -6.207 292 HA ILE 36 HA ILE 36 -0.315 2.049 -7.767 293 HB ILE 36 HB ILE 36 -0.218 0.813 -5.007 294 HG12 ILE 36 HG12 ILE 36 0.196 -0.376 -7.754 295 HG13 ILE 36 HG11 ILE 36 1.352 -0.326 -6.437 296 HG21 ILE 36 HG21 ILE 36 -2.439 0.648 -5.233 297 HG22 ILE 36 HG22 ILE 36 -2.147 -0.445 -6.585 298 HG23 ILE 36 HG23 ILE 36 -2.367 1.278 -6.880 299 HD11 ILE 36 HD11 ILE 36 -0.174 -1.812 -5.141 300 HD12 ILE 36 HD12 ILE 36 0.505 -2.538 -6.597 301 HD13 ILE 36 HD13 ILE 36 -1.160 -1.962 -6.594 302 H ILE 37 HN ILE 37 0.257 3.154 -4.416 303 HA ILE 37 HA ILE 37 -2.284 4.326 -4.105 304 HB ILE 37 HB ILE 37 0.269 5.136 -2.700 305 HG12 ILE 37 HG12 ILE 37 -1.512 3.717 -1.011 306 HG13 ILE 37 HG11 ILE 37 -1.361 2.781 -2.492 307 HG21 ILE 37 HG21 ILE 37 -1.906 6.613 -2.784 308 HG22 ILE 37 HG22 ILE 37 -0.990 6.425 -1.288 309 HG23 ILE 37 HG23 ILE 37 -2.454 5.475 -1.552 310 HD11 ILE 37 HD11 ILE 37 1.030 2.688 -2.234 311 HD12 ILE 37 HD12 ILE 37 0.239 2.110 -0.766 312 HD13 ILE 37 HD13 ILE 37 0.941 3.727 -0.812 313 H GLN 38 HN GLN 38 0.824 5.820 -4.964 314 HA GLN 38 HA GLN 38 -0.090 8.430 -5.283 315 HB2 GLN 38 HB2 GLN 38 2.184 6.938 -6.578 316 HB3 GLN 38 HB1 GLN 38 1.895 8.641 -6.908 317 HG2 GLN 38 HG2 GLN 38 1.881 8.558 -4.155 318 HG3 GLN 38 HG1 GLN 38 3.079 7.337 -4.574 319 HE21 GLN 38 HE21 GLN 38 4.720 8.627 -3.712 320 HE22 GLN 38 HE22 GLN 38 5.323 10.017 -4.543 321 H SER 39 HN SER 39 -0.202 5.726 -7.522 322 HA SER 39 HA SER 39 -1.005 7.272 -9.773 323 HB2 SER 39 HB2 SER 39 0.047 5.100 -10.072 324 HB3 SER 39 HB1 SER 39 -1.271 4.307 -9.206 325 HG SER 39 HG SER 39 -1.150 5.262 -11.806 326 H ARG 40 HN ARG 40 -2.790 5.314 -7.387 327 HA ARG 40 HA ARG 40 -5.308 5.827 -8.680 328 HB2 ARG 40 HB2 ARG 40 -4.855 4.707 -5.927 329 HB3 ARG 40 HB1 ARG 40 -6.311 4.563 -6.901 330 HG2 ARG 40 HG2 ARG 40 -4.606 3.405 -8.582 331 HG3 ARG 40 HG1 ARG 40 -3.759 3.085 -7.070 332 HD2 ARG 40 HD2 ARG 40 -5.140 1.227 -7.434 333 HD3 ARG 40 HD1 ARG 40 -5.892 2.201 -6.175 334 HE ARG 40 HE ARG 40 -7.170 3.112 -8.318 335 HH11 ARG 40 HH11 ARG 40 -6.495 -0.166 -7.297 336 HH12 ARG 40 HH12 ARG 40 -7.822 -0.853 -8.172 337 HH21 ARG 40 HH21 ARG 40 -8.919 2.209 -9.482 338 HH22 ARG 40 HH22 ARG 40 -9.206 0.496 -9.423 339 H GLU 41 HN GLU 41 -3.568 7.110 -5.919 340 HA GLU 41 HA GLU 41 -5.785 8.960 -5.375 341 HB2 GLU 41 HB2 GLU 41 -3.390 8.324 -3.668 342 HB3 GLU 41 HB1 GLU 41 -4.736 9.351 -3.212 343 HG2 GLU 41 HG2 GLU 41 -4.750 6.382 -3.653 344 HG3 GLU 41 HG1 GLU 41 -5.006 7.254 -2.144 345 HA PRO 42 HA PRO 42 -2.913 11.808 -7.568 346 HB2 PRO 42 HB2 PRO 42 -5.409 13.404 -7.568 347 HB3 PRO 42 HB1 PRO 42 -4.313 13.031 -8.902 348 HG2 PRO 42 HG2 PRO 42 -6.701 11.857 -8.718 349 HG3 PRO 42 HG1 PRO 42 -5.281 10.964 -9.292 350 HD2 PRO 42 HD2 PRO 42 -6.607 10.890 -6.612 351 HD3 PRO 42 HD1 PRO 42 -5.923 9.558 -7.570 352 H SER 43 HN SER 43 -4.998 12.115 -4.816 353 HA SER 43 HA SER 43 -4.440 14.769 -4.087 354 HB2 SER 43 HB2 SER 43 -5.215 12.483 -2.267 355 HB3 SER 43 HB1 SER 43 -5.464 14.205 -1.972 356 HG SER 43 HG SER 43 -6.668 14.011 -4.129 357 H LEU 44 HN LEU 44 -2.511 11.934 -3.823 358 HA LEU 44 HA LEU 44 -0.679 13.390 -2.043 359 HB2 LEU 44 HB2 LEU 44 0.040 11.198 -1.125 360 HB3 LEU 44 HB1 LEU 44 -1.604 11.640 -0.730 361 HG LEU 44 HG LEU 44 -2.141 10.137 -2.849 362 HD11 LEU 44 HD11 LEU 44 0.236 9.721 -3.344 363 HD12 LEU 44 HD12 LEU 44 -0.662 8.240 -3.018 364 HD13 LEU 44 HD13 LEU 44 0.400 8.916 -1.784 365 HD21 LEU 44 HD21 LEU 44 -3.035 9.786 -0.630 366 HD22 LEU 44 HD22 LEU 44 -1.501 9.104 -0.090 367 HD23 LEU 44 HD23 LEU 44 -2.468 8.255 -1.296 368 H LYS 45 HN LYS 45 -0.959 12.806 -5.081 369 HA LYS 45 HA LYS 45 1.392 11.307 -5.722 370 HB2 LYS 45 HB2 LYS 45 0.998 11.886 -8.002 371 HB3 LYS 45 HB1 LYS 45 -0.576 11.617 -7.271 372 HG2 LYS 45 HG2 LYS 45 -0.767 14.099 -7.010 373 HG3 LYS 45 HG1 LYS 45 0.715 14.238 -7.967 374 HD2 LYS 45 HD2 LYS 45 -0.512 12.747 -9.661 375 HD3 LYS 45 HD1 LYS 45 -1.972 13.216 -8.793 376 HE2 LYS 45 HE2 LYS 45 -1.480 15.560 -9.188 377 HE3 LYS 45 HE1 LYS 45 0.021 15.114 -9.998 378 HZ1 LYS 45 HZ1 LYS 45 -1.245 14.019 -11.715 379 HZ2 LYS 45 HZ2 LYS 45 -1.769 15.620 -11.564 380 HZ3 LYS 45 HZ3 LYS 45 -2.698 14.363 -10.921 381 H ASN 46 HN ASN 46 0.916 14.354 -4.505 382 HA ASN 46 HA ASN 46 3.220 15.627 -5.689 383 HB2 ASN 46 HB2 ASN 46 2.677 17.365 -3.867 384 HB3 ASN 46 HB1 ASN 46 1.484 17.124 -5.142 385 HD21 ASN 46 HD21 ASN 46 2.205 16.688 -1.774 386 HD22 ASN 46 HD22 ASN 46 0.609 16.217 -1.298 387 H SER 47 HN SER 47 2.828 13.271 -3.411 388 HA SER 47 HA SER 47 4.807 14.128 -1.519 389 HB2 SER 47 HB2 SER 47 3.816 11.293 -1.957 390 HB3 SER 47 HB1 SER 47 4.504 11.991 -0.487 391 HG SER 47 HG SER 47 1.960 12.370 -1.622 392 H ASN 48 HN ASN 48 6.986 13.819 -1.640 393 HA ASN 48 HA ASN 48 8.267 13.099 -4.023 394 HB2 ASN 48 HB2 ASN 48 9.382 12.965 -1.201 395 HB3 ASN 48 HB1 ASN 48 10.339 12.951 -2.678 396 HD21 ASN 48 HD21 ASN 48 10.451 14.780 -0.474 397 HD22 ASN 48 HD22 ASN 48 10.128 16.355 -1.115 398 HA PRO 49 HA PRO 49 7.552 8.782 -4.143 399 HB2 PRO 49 HB2 PRO 49 9.722 8.043 -5.679 400 HB3 PRO 49 HB1 PRO 49 8.199 8.668 -6.308 401 HG2 PRO 49 HG2 PRO 49 10.784 10.087 -5.826 402 HG3 PRO 49 HG1 PRO 49 9.633 10.277 -7.163 403 HD2 PRO 49 HD2 PRO 49 9.769 12.048 -5.147 404 HD3 PRO 49 HD1 PRO 49 8.226 11.637 -5.921 405 H ASP 50 HN ASP 50 10.569 10.046 -2.943 406 HA ASP 50 HA ASP 50 11.482 7.492 -1.979 407 HB2 ASP 50 HB2 ASP 50 12.492 10.233 -1.190 408 HB3 ASP 50 HB1 ASP 50 13.320 8.699 -0.975 409 H GLU 51 HN GLU 51 9.635 10.178 -0.764 410 HA GLU 51 HA GLU 51 9.301 8.841 1.836 411 HB2 GLU 51 HB2 GLU 51 10.092 11.670 1.248 412 HB3 GLU 51 HB1 GLU 51 9.017 11.398 2.610 413 HG2 GLU 51 HG2 GLU 51 10.699 9.831 3.546 414 HG3 GLU 51 HG1 GLU 51 11.777 10.268 2.222 415 H ILE 52 HN ILE 52 7.241 8.064 0.830 416 HA ILE 52 HA ILE 52 5.509 10.154 -0.183 417 HB ILE 52 HB ILE 52 4.216 8.512 -1.224 418 HG12 ILE 52 HG12 ILE 52 5.576 6.328 0.259 419 HG13 ILE 52 HG11 ILE 52 4.110 7.091 0.879 420 HG21 ILE 52 HG21 ILE 52 6.910 7.196 -1.216 421 HG22 ILE 52 HG22 ILE 52 6.632 8.754 -2.013 422 HG23 ILE 52 HG23 ILE 52 5.750 7.322 -2.548 423 HD11 ILE 52 HD11 ILE 52 2.937 6.505 -1.157 424 HD12 ILE 52 HD12 ILE 52 3.613 5.067 -0.386 425 HD13 ILE 52 HD13 ILE 52 4.399 5.763 -1.800 426 H GLU 53 HN GLU 53 3.377 10.450 0.482 427 HA GLU 53 HA GLU 53 3.068 10.017 3.371 428 HB2 GLU 53 HB2 GLU 53 3.207 12.317 1.887 429 HB3 GLU 53 HB1 GLU 53 1.477 12.075 1.978 430 HG2 GLU 53 HG2 GLU 53 3.417 12.483 4.225 431 HG3 GLU 53 HG1 GLU 53 2.125 13.554 3.709 432 H ILE 54 HN ILE 54 1.655 8.307 3.655 433 HA ILE 54 HA ILE 54 -0.609 8.021 1.780 434 HB ILE 54 HB ILE 54 0.083 6.110 4.012 435 HG12 ILE 54 HG12 ILE 54 2.002 6.255 2.437 436 HG13 ILE 54 HG11 ILE 54 1.219 4.678 2.428 437 HG21 ILE 54 HG21 ILE 54 -1.233 4.536 2.653 438 HG22 ILE 54 HG22 ILE 54 -1.573 5.835 1.514 439 HG23 ILE 54 HG23 ILE 54 -2.168 5.938 3.171 440 HD11 ILE 54 HD11 ILE 54 1.716 5.170 0.231 441 HD12 ILE 54 HD12 ILE 54 1.093 6.822 0.352 442 HD13 ILE 54 HD13 ILE 54 -0.021 5.451 0.389 443 H ASP 55 HN ASP 55 -2.673 8.486 2.387 444 HA ASP 55 HA ASP 55 -3.176 8.755 5.282 445 HB2 ASP 55 HB2 ASP 55 -3.330 10.942 4.089 446 HB3 ASP 55 HB1 ASP 55 -4.603 10.260 3.077 447 H PHE 56 HN PHE 56 -4.032 6.790 5.742 448 HA PHE 56 HA PHE 56 -5.208 5.206 3.743 449 HB2 PHE 56 HB2 PHE 56 -4.434 4.880 6.510 450 HB3 PHE 56 HB1 PHE 56 -5.900 3.981 6.113 451 HD1 PHE 56 HD1 PHE 56 -2.363 4.492 5.162 452 HD2 PHE 56 HD2 PHE 56 -5.835 2.085 4.756 453 HE1 PHE 56 HE1 PHE 56 -1.041 2.782 3.985 454 HE2 PHE 56 HE2 PHE 56 -4.536 0.379 3.590 455 HZ PHE 56 HZ PHE 56 -2.129 0.705 3.204 456 H GLU 57 HN GLU 57 -6.650 7.614 5.644 457 HA GLU 57 HA GLU 57 -9.277 6.403 5.454 458 HB2 GLU 57 HB2 GLU 57 -8.240 8.895 6.752 459 HB3 GLU 57 HB1 GLU 57 -9.964 8.563 6.616 460 HG2 GLU 57 HG2 GLU 57 -7.971 6.723 7.912 461 HG3 GLU 57 HG1 GLU 57 -8.977 7.878 8.780 462 H THR 58 HN THR 58 -7.368 8.122 3.394 463 HA THR 58 HA THR 58 -9.744 9.270 2.084 464 HB THR 58 HB THR 58 -8.189 10.895 0.990 465 HG1 THR 58 HG1 THR 58 -6.343 10.127 3.012 466 HG21 THR 58 HG21 THR 58 -8.354 10.846 3.994 467 HG22 THR 58 HG22 THR 58 -9.490 11.614 2.878 468 HG23 THR 58 HG23 THR 58 -7.857 12.258 3.060 469 H LEU 59 HN LEU 59 -7.372 6.905 1.844 470 HA LEU 59 HA LEU 59 -7.079 6.801 -0.992 471 HB2 LEU 59 HB2 LEU 59 -7.086 4.272 0.597 472 HB3 LEU 59 HB1 LEU 59 -6.073 4.737 -0.746 473 HG LEU 59 HG LEU 59 -5.807 5.671 2.102 474 HD11 LEU 59 HD11 LEU 59 -4.260 3.761 0.379 475 HD12 LEU 59 HD12 LEU 59 -4.965 3.500 1.974 476 HD13 LEU 59 HD13 LEU 59 -3.548 4.533 1.796 477 HD21 LEU 59 HD21 LEU 59 -4.441 6.583 -0.397 478 HD22 LEU 59 HD22 LEU 59 -3.624 6.654 1.154 479 HD23 LEU 59 HD23 LEU 59 -5.127 7.540 0.907 480 H LYS 60 HN LYS 60 -8.364 5.846 -2.514 481 HA LYS 60 HA LYS 60 -11.093 5.356 -1.975 482 HB2 LYS 60 HB2 LYS 60 -9.416 4.464 -4.337 483 HB3 LYS 60 HB1 LYS 60 -11.172 4.583 -4.306 484 HG2 LYS 60 HG2 LYS 60 -11.016 6.995 -4.022 485 HG3 LYS 60 HG1 LYS 60 -9.253 6.891 -3.999 486 HD2 LYS 60 HD2 LYS 60 -9.344 5.928 -6.287 487 HD3 LYS 60 HD1 LYS 60 -11.084 6.236 -6.300 488 HE2 LYS 60 HE2 LYS 60 -9.883 8.037 -7.414 489 HE3 LYS 60 HE1 LYS 60 -10.662 8.619 -5.944 490 HZ1 LYS 60 HZ1 LYS 60 -8.469 8.318 -4.818 491 HZ2 LYS 60 HZ2 LYS 60 -8.487 9.520 -6.009 492 HZ3 LYS 60 HZ3 LYS 60 -7.782 8.016 -6.339 493 HA PRO 61 HA PRO 61 -11.242 1.237 -0.415 494 HB2 PRO 61 HB2 PRO 61 -13.458 0.688 -2.289 495 HB3 PRO 61 HB1 PRO 61 -13.443 0.639 -0.527 496 HG2 PRO 61 HG2 PRO 61 -14.679 2.589 -1.924 497 HG3 PRO 61 HG1 PRO 61 -13.963 2.865 -0.329 498 HD2 PRO 61 HD2 PRO 61 -12.982 3.675 -3.016 499 HD3 PRO 61 HD1 PRO 61 -12.752 4.462 -1.442 500 H SER 62 HN SER 62 -11.308 1.752 -3.870 501 HA SER 62 HA SER 62 -10.660 -0.934 -4.587 502 HB2 SER 62 HB2 SER 62 -10.069 0.228 -6.811 503 HB3 SER 62 HB1 SER 62 -11.741 0.345 -6.263 504 HG SER 62 HG SER 62 -10.863 2.373 -6.951 505 H THR 63 HN THR 63 -8.876 2.009 -3.908 506 HA THR 63 HA THR 63 -6.324 1.124 -4.688 507 HB THR 63 HB THR 63 -6.791 3.043 -2.389 508 HG1 THR 63 HG1 THR 63 -7.102 4.656 -4.014 509 HG21 THR 63 HG21 THR 63 -4.475 2.388 -3.019 510 HG22 THR 63 HG22 THR 63 -4.794 4.105 -3.237 511 HG23 THR 63 HG23 THR 63 -4.763 3.026 -4.633 512 H LEU 64 HN LEU 64 -7.980 1.099 -1.548 513 HA LEU 64 HA LEU 64 -6.005 -0.172 -0.047 514 HB2 LEU 64 HB2 LEU 64 -9.013 -0.290 0.166 515 HB3 LEU 64 HB1 LEU 64 -7.940 -0.990 1.361 516 HG LEU 64 HG LEU 64 -7.977 1.938 0.640 517 HD11 LEU 64 HD11 LEU 64 -10.085 1.274 1.699 518 HD12 LEU 64 HD12 LEU 64 -9.107 2.269 2.776 519 HD13 LEU 64 HD13 LEU 64 -9.182 0.524 3.013 520 HD21 LEU 64 HD21 LEU 64 -5.852 1.296 1.491 521 HD22 LEU 64 HD22 LEU 64 -6.596 0.365 2.785 522 HD23 LEU 64 HD23 LEU 64 -6.726 2.122 2.777 523 H ARG 65 HN ARG 65 -8.493 -1.569 -2.124 524 HA ARG 65 HA ARG 65 -7.856 -4.256 -1.308 525 HB2 ARG 65 HB2 ARG 65 -9.887 -2.964 -2.929 526 HB3 ARG 65 HB1 ARG 65 -9.346 -4.457 -3.647 527 HG2 ARG 65 HG2 ARG 65 -10.513 -4.077 -0.910 528 HG3 ARG 65 HG1 ARG 65 -11.275 -4.901 -2.274 529 HD2 ARG 65 HD2 ARG 65 -9.209 -6.474 -2.135 530 HD3 ARG 65 HD1 ARG 65 -9.019 -5.806 -0.517 531 HE ARG 65 HE ARG 65 -11.683 -6.618 -0.853 532 HH11 ARG 65 HH11 ARG 65 -8.479 -7.976 -0.402 533 HH12 ARG 65 HH12 ARG 65 -9.086 -9.504 0.157 534 HH21 ARG 65 HH21 ARG 65 -12.458 -8.628 -0.100 535 HH22 ARG 65 HH22 ARG 65 -11.331 -9.878 0.322 536 H GLU 66 HN GLU 66 -6.579 -2.051 -3.579 537 HA GLU 66 HA GLU 66 -5.375 -4.143 -5.180 538 HB2 GLU 66 HB2 GLU 66 -6.067 -2.135 -6.312 539 HB3 GLU 66 HB1 GLU 66 -5.117 -1.136 -5.220 540 HG2 GLU 66 HG2 GLU 66 -4.008 -1.320 -7.342 541 HG3 GLU 66 HG1 GLU 66 -3.064 -2.171 -6.112 542 H LEU 67 HN LEU 67 -4.535 -1.853 -2.661 543 HA LEU 67 HA LEU 67 -1.750 -2.332 -2.641 544 HB2 LEU 67 HB2 LEU 67 -3.560 -1.474 -0.370 545 HB3 LEU 67 HB1 LEU 67 -1.823 -1.235 -0.437 546 HG LEU 67 HG LEU 67 -3.893 0.098 -2.192 547 HD11 LEU 67 HD11 LEU 67 -2.024 1.257 -0.130 548 HD12 LEU 67 HD12 LEU 67 -3.734 0.913 0.140 549 HD13 LEU 67 HD13 LEU 67 -3.256 2.117 -1.056 550 HD21 LEU 67 HD21 LEU 67 -1.697 -0.473 -3.308 551 HD22 LEU 67 HD22 LEU 67 -0.949 0.648 -2.169 552 HD23 LEU 67 HD23 LEU 67 -2.167 1.224 -3.301 553 H GLU 68 HN GLU 68 -4.451 -3.510 -0.708 554 HA GLU 68 HA GLU 68 -2.979 -5.259 0.938 555 HB2 GLU 68 HB2 GLU 68 -5.158 -4.485 1.604 556 HB3 GLU 68 HB1 GLU 68 -5.902 -5.208 0.186 557 HG2 GLU 68 HG2 GLU 68 -4.542 -7.268 1.512 558 HG3 GLU 68 HG1 GLU 68 -5.402 -6.351 2.744 559 H ARG 69 HN ARG 69 -5.099 -5.990 -1.866 560 HA ARG 69 HA ARG 69 -4.655 -8.720 -2.008 561 HB2 ARG 69 HB2 ARG 69 -6.295 -7.512 -3.399 562 HB3 ARG 69 HB1 ARG 69 -4.977 -6.877 -4.376 563 HG2 ARG 69 HG2 ARG 69 -4.355 -9.356 -4.716 564 HG3 ARG 69 HG1 ARG 69 -6.005 -9.670 -4.181 565 HD2 ARG 69 HD2 ARG 69 -5.817 -9.518 -6.638 566 HD3 ARG 69 HD1 ARG 69 -6.905 -8.314 -5.952 567 HE ARG 69 HE ARG 69 -4.929 -6.749 -6.163 568 HH11 ARG 69 HH11 ARG 69 -5.370 -9.486 -8.300 569 HH12 ARG 69 HH12 ARG 69 -4.513 -8.750 -9.616 570 HH21 ARG 69 HH21 ARG 69 -3.814 -5.773 -7.898 571 HH22 ARG 69 HH22 ARG 69 -3.638 -6.653 -9.390 572 H TYR 70 HN TYR 70 -2.610 -6.129 -3.156 573 HA TYR 70 HA TYR 70 -0.906 -7.835 -4.691 574 HB2 TYR 70 HB2 TYR 70 -0.966 -5.569 -5.392 575 HB3 TYR 70 HB1 TYR 70 -0.664 -4.975 -3.761 576 HD1 TYR 70 HD2 TYR 70 0.910 -6.745 -6.624 577 HD2 TYR 70 HD1 TYR 70 1.510 -4.637 -2.979 578 HE1 TYR 70 HE2 TYR 70 3.328 -6.724 -7.049 579 HE2 TYR 70 HE1 TYR 70 3.933 -4.600 -3.399 580 HH TYR 70 HH TYR 70 5.317 -5.334 -6.363 581 H VAL 71 HN VAL 71 -0.553 -6.207 -1.535 582 HA VAL 71 HA VAL 71 2.036 -7.234 -1.061 583 HB VAL 71 HB VAL 71 1.769 -6.512 1.238 584 HG11 VAL 71 HG11 VAL 71 0.566 -4.176 0.399 585 HG12 VAL 71 HG12 VAL 71 1.268 -4.850 -1.065 586 HG13 VAL 71 HG13 VAL 71 2.283 -4.546 0.345 587 HG21 VAL 71 HG21 VAL 71 -0.305 -7.005 2.023 588 HG22 VAL 71 HG22 VAL 71 -1.110 -6.513 0.532 589 HG23 VAL 71 HG23 VAL 71 -0.526 -5.292 1.663 590 H THR 72 HN THR 72 -1.176 -8.369 -0.074 591 HA THR 72 HA THR 72 -0.314 -10.445 1.612 592 HB THR 72 HB THR 72 -2.718 -9.490 1.189 593 HG1 THR 72 HG1 THR 72 -3.157 -11.001 2.589 594 HG21 THR 72 HG21 THR 72 -2.675 -10.302 -1.214 595 HG22 THR 72 HG22 THR 72 -4.113 -10.696 -0.277 596 HG23 THR 72 HG23 THR 72 -2.883 -11.925 -0.565 597 H SER 73 HN SER 73 -0.429 -10.189 -1.853 598 HA SER 73 HA SER 73 -0.103 -12.944 -2.404 599 HB2 SER 73 HB2 SER 73 0.442 -10.513 -4.016 600 HB3 SER 73 HB1 SER 73 0.576 -12.138 -4.664 601 HG SER 73 HG SER 73 -1.717 -10.720 -3.801 602 H CYS 74 HN CYS 74 2.047 -10.363 -1.553 603 HA CYS 74 HA CYS 74 4.417 -11.896 -2.258 604 HB2 CYS 74 HB2 CYS 74 4.404 -9.478 -2.697 605 HB3 CYS 74 HB1 CYS 74 4.162 -9.153 -0.980 606 HG CYS 74 HG CYS 74 6.773 -11.001 -1.025 607 H LEU 75 HN LEU 75 3.126 -10.354 0.693 608 HA LEU 75 HA LEU 75 4.833 -11.319 2.584 609 HB2 LEU 75 HB2 LEU 75 1.885 -11.297 3.097 610 HB3 LEU 75 HB1 LEU 75 3.192 -10.868 4.183 611 HG LEU 75 HG LEU 75 2.500 -9.239 1.766 612 HD11 LEU 75 HD11 LEU 75 1.692 -8.625 4.578 613 HD12 LEU 75 HD12 LEU 75 0.634 -9.475 3.453 614 HD13 LEU 75 HD13 LEU 75 1.187 -7.845 3.080 615 HD21 LEU 75 HD21 LEU 75 4.746 -9.016 2.667 616 HD22 LEU 75 HD22 LEU 75 4.078 -8.643 4.255 617 HD23 LEU 75 HD23 LEU 75 3.802 -7.546 2.898 618 H ARG 76 HN ARG 76 1.853 -12.953 1.478 619 HA ARG 76 HA ARG 76 2.254 -15.068 3.355 620 HB2 ARG 76 HB2 ARG 76 0.260 -15.031 1.116 621 HB3 ARG 76 HB1 ARG 76 0.170 -15.919 2.628 622 HG2 ARG 76 HG2 ARG 76 0.046 -13.735 3.778 623 HG3 ARG 76 HG1 ARG 76 -0.040 -12.959 2.221 624 HD2 ARG 76 HD2 ARG 76 -2.227 -13.276 3.194 625 HD3 ARG 76 HD1 ARG 76 -2.002 -14.184 1.712 626 HE ARG 76 HE ARG 76 -1.490 -15.668 4.128 627 HH11 ARG 76 HH11 ARG 76 -3.875 -14.765 1.733 628 HH12 ARG 76 HH12 ARG 76 -4.913 -16.113 2.073 629 HH21 ARG 76 HH21 ARG 76 -2.851 -17.457 4.564 630 HH22 ARG 76 HH22 ARG 76 -4.324 -17.648 3.672 631 H LYS 77 HN LYS 77 3.697 -14.492 0.487 632 HA LYS 77 HA LYS 77 4.042 -17.364 -0.036 633 HB2 LYS 77 HB2 LYS 77 3.507 -15.177 -2.015 634 HB3 LYS 77 HB1 LYS 77 4.324 -16.660 -2.494 635 HG2 LYS 77 HG2 LYS 77 2.451 -17.985 -1.894 636 HG3 LYS 77 HG1 LYS 77 1.662 -16.615 -1.117 637 HD2 LYS 77 HD2 LYS 77 1.428 -15.507 -3.275 638 HD3 LYS 77 HD1 LYS 77 2.284 -16.835 -4.063 639 HE2 LYS 77 HE2 LYS 77 -0.106 -17.071 -4.390 640 HE3 LYS 77 HE1 LYS 77 0.498 -18.375 -3.369 641 HZ1 LYS 77 HZ1 LYS 77 -1.564 -17.475 -2.516 642 HZ2 LYS 77 HZ2 LYS 77 -0.891 -15.929 -2.416 643 HZ3 LYS 77 HZ3 LYS 77 -0.305 -17.174 -1.431 644 H LYS 78 HN LYS 78 6.050 -17.748 0.679 645 HA LYS 78 HA LYS 78 8.187 -15.865 0.074 646 HB2 LYS 78 HB2 LYS 78 7.891 -18.183 1.919 647 HB3 LYS 78 HB1 LYS 78 9.501 -17.788 1.348 648 HG2 LYS 78 HG2 LYS 78 9.186 -16.737 3.451 649 HG3 LYS 78 HG1 LYS 78 9.172 -15.481 2.214 650 HD2 LYS 78 HD2 LYS 78 6.782 -15.332 2.316 651 HD3 LYS 78 HD1 LYS 78 6.698 -16.714 3.413 652 HE2 LYS 78 HE2 LYS 78 8.037 -15.412 5.057 653 HE3 LYS 78 HE1 LYS 78 7.941 -14.026 3.976 654 HZ1 LYS 78 HZ1 LYS 78 5.514 -14.118 4.179 655 HZ2 LYS 78 HZ2 LYS 78 6.266 -13.863 5.673 656 HZ3 LYS 78 HZ3 LYS 78 5.653 -15.393 5.285 657 H ARG 79 HN ARG 79 10.341 -17.022 -0.523 658 HA ARG 79 HA ARG 79 11.601 -18.169 -2.005 659 HB2 ARG 79 HB2 ARG 79 9.479 -20.196 -1.397 660 HB3 ARG 79 HB1 ARG 79 10.732 -20.535 -2.577 661 HG2 ARG 79 HG2 ARG 79 11.442 -21.480 -0.540 662 HG3 ARG 79 HG1 ARG 79 12.421 -20.037 -0.793 663 HD2 ARG 79 HD2 ARG 79 11.056 -18.799 0.773 664 HD3 ARG 79 HD1 ARG 79 9.976 -20.179 0.971 665 HE ARG 79 HE ARG 79 12.696 -20.807 1.599 666 HH11 ARG 79 HH11 ARG 79 9.758 -19.398 2.875 667 HH12 ARG 79 HH12 ARG 79 10.173 -19.710 4.528 668 HH21 ARG 79 HH21 ARG 79 13.249 -21.215 3.773 669 HH22 ARG 79 HH22 ARG 79 12.169 -20.732 5.040 670 H LYS 80 HN LYS 80 9.917 -16.301 -3.169 671 HA LYS 80 HA LYS 80 9.934 -17.349 -5.856 672 HB2 LYS 80 HB2 LYS 80 7.631 -16.641 -6.386 673 HB3 LYS 80 HB1 LYS 80 7.685 -17.965 -5.234 674 HG2 LYS 80 HG2 LYS 80 7.074 -16.565 -3.438 675 HG3 LYS 80 HG1 LYS 80 7.376 -15.102 -4.379 676 HD2 LYS 80 HD2 LYS 80 5.184 -17.123 -4.856 677 HD3 LYS 80 HD1 LYS 80 4.989 -15.501 -4.190 678 HE2 LYS 80 HE2 LYS 80 5.858 -16.240 -6.982 679 HE3 LYS 80 HE1 LYS 80 4.359 -15.451 -6.504 680 HZ1 LYS 80 HZ1 LYS 80 5.625 -13.533 -5.789 681 HZ2 LYS 80 HZ2 LYS 80 5.954 -13.875 -7.408 682 HZ3 LYS 80 HZ3 LYS 80 7.079 -14.286 -6.214 683 HA PRO 81 HA PRO 81 11.080 -12.854 -5.405 684 HB2 PRO 81 HB2 PRO 81 13.597 -13.044 -6.352 685 HB3 PRO 81 HB1 PRO 81 13.207 -13.338 -4.654 686 HG2 PRO 81 HG2 PRO 81 13.653 -15.308 -6.859 687 HG3 PRO 81 HG1 PRO 81 14.248 -15.349 -5.190 688 HD2 PRO 81 HD2 PRO 81 12.087 -16.773 -6.030 689 HD3 PRO 81 HD1 PRO 81 12.259 -16.167 -4.371 690 H GLN 82 HN GLN 82 10.882 -11.423 -7.040 691 HA GLN 82 HA GLN 82 10.395 -12.472 -9.711 692 HB2 GLN 82 HB2 GLN 82 8.857 -10.820 -8.669 693 HB3 GLN 82 HB1 GLN 82 10.167 -9.651 -8.635 694 HG2 GLN 82 HG2 GLN 82 8.646 -9.235 -10.482 695 HG3 GLN 82 HG1 GLN 82 10.259 -9.646 -11.059 696 HE21 GLN 82 HE21 GLN 82 9.475 -10.268 -13.061 697 HE22 GLN 82 HE22 GLN 82 8.601 -11.739 -13.296 698 H ALA 83 HN ALA 83 12.837 -10.903 -7.916 699 HA ALA 83 HA ALA 83 14.540 -10.838 -10.294 700 HB1 ALA 83 HB1 ALA 83 14.389 -8.611 -8.261 701 HB2 ALA 83 HB2 ALA 83 13.798 -8.535 -9.920 702 HB3 ALA 83 HB3 ALA 83 15.524 -8.708 -9.607 703 H1 GLU 201 HT1 GLU 201 -5.262 9.232 10.815 704 H2 GLU 201 HT2 GLU 201 -3.848 10.005 11.329 705 H3 GLU 201 HT3 GLU 201 -5.310 10.294 12.132 706 HA GLU 201 HA GLU 201 -3.829 8.816 13.363 707 HB2 GLU 201 HB2 GLU 201 -6.404 7.569 12.379 708 HB3 GLU 201 HB1 GLU 201 -5.502 7.020 13.781 709 HG2 GLU 201 HG2 GLU 201 -7.238 8.321 14.640 710 HG3 GLU 201 HG1 GLU 201 -5.815 9.357 14.715 711 H ILE 202 HN ILE 202 -5.306 6.934 10.708 712 HA ILE 202 HA ILE 202 -3.105 5.056 10.798 713 HB ILE 202 HB ILE 202 -5.418 5.112 8.852 714 HG12 ILE 202 HG12 ILE 202 -6.305 4.995 11.109 715 HG13 ILE 202 HG11 ILE 202 -6.450 3.414 10.345 716 HG21 ILE 202 HG21 ILE 202 -3.518 3.744 8.149 717 HG22 ILE 202 HG22 ILE 202 -4.911 2.740 8.555 718 HG23 ILE 202 HG23 ILE 202 -3.565 2.882 9.686 719 HD11 ILE 202 HD11 ILE 202 -4.426 2.686 11.543 720 HD12 ILE 202 HD12 ILE 202 -5.734 3.159 12.623 721 HD13 ILE 202 HD13 ILE 202 -4.374 4.249 12.354 722 H LYS 203 HN LYS 203 -1.270 5.808 9.949 723 HA LYS 203 HA LYS 203 -1.393 7.001 7.265 724 HB2 LYS 203 HB2 LYS 203 0.450 7.839 9.511 725 HB3 LYS 203 HB1 LYS 203 0.428 8.510 7.888 726 HG2 LYS 203 HG2 LYS 203 -1.916 9.248 8.302 727 HG3 LYS 203 HG1 LYS 203 -1.725 8.724 9.973 728 HD2 LYS 203 HD2 LYS 203 -1.341 11.112 9.777 729 HD3 LYS 203 HD1 LYS 203 0.147 10.285 10.238 730 HE2 LYS 203 HE2 LYS 203 0.961 10.405 7.970 731 HE3 LYS 203 HE1 LYS 203 -0.566 11.093 7.423 732 HZ1 LYS 203 HZ1 LYS 203 1.348 12.362 9.300 733 HZ2 LYS 203 HZ2 LYS 203 -0.131 13.024 8.824 734 HZ3 LYS 203 HZ3 LYS 203 1.098 12.798 7.686 735 H LEU 204 HN LEU 204 0.862 6.992 6.250 736 HA LEU 204 HA LEU 204 2.574 4.806 7.044 737 HB2 LEU 204 HB2 LEU 204 0.478 4.067 5.522 738 HB3 LEU 204 HB1 LEU 204 1.577 4.589 4.258 739 HG LEU 204 HG LEU 204 1.908 2.313 6.196 740 HD11 LEU 204 HD11 LEU 204 2.009 2.526 3.190 741 HD12 LEU 204 HD12 LEU 204 0.697 1.846 4.156 742 HD13 LEU 204 HD13 LEU 204 2.269 1.051 4.125 743 HD21 LEU 204 HD21 LEU 204 4.037 3.535 4.448 744 HD22 LEU 204 HD22 LEU 204 4.172 1.987 5.287 745 HD23 LEU 204 HD23 LEU 204 4.031 3.483 6.212 746 H LYS 205 HN LYS 205 4.166 6.489 7.086 747 HA LYS 205 HA LYS 205 4.847 7.839 4.648 748 HB2 LYS 205 HB2 LYS 205 6.112 7.561 7.339 749 HB3 LYS 205 HB1 LYS 205 7.113 8.088 5.995 750 HG2 LYS 205 HG2 LYS 205 4.588 9.437 6.929 751 HG3 LYS 205 HG1 LYS 205 6.237 9.966 7.281 752 HD2 LYS 205 HD2 LYS 205 6.510 9.979 4.700 753 HD3 LYS 205 HD1 LYS 205 4.747 9.983 4.680 754 HE2 LYS 205 HE2 LYS 205 6.586 12.029 5.897 755 HE3 LYS 205 HE1 LYS 205 5.472 12.245 4.550 756 HZ1 LYS 205 HZ1 LYS 205 3.629 11.796 6.137 757 HZ2 LYS 205 HZ2 LYS 205 4.507 13.201 6.485 758 HZ3 LYS 205 HZ3 LYS 205 4.763 11.804 7.399 759 H ILE 206 HN ILE 206 4.759 5.826 3.318 760 HA ILE 206 HA ILE 206 6.671 3.774 3.645 761 HB ILE 206 HB ILE 206 5.734 4.615 0.903 762 HG12 ILE 206 HG12 ILE 206 4.240 2.843 2.829 763 HG13 ILE 206 HG11 ILE 206 3.704 4.432 2.294 764 HG21 ILE 206 HG21 ILE 206 5.906 1.807 1.778 765 HG22 ILE 206 HG22 ILE 206 7.436 2.710 1.685 766 HG23 ILE 206 HG23 ILE 206 6.410 2.572 0.257 767 HD11 ILE 206 HD11 ILE 206 4.288 2.612 0.099 768 HD12 ILE 206 HD12 ILE 206 2.850 3.593 0.409 769 HD13 ILE 206 HD13 ILE 206 3.025 2.022 1.182 770 H THR 207 HN THR 207 8.750 4.344 3.915 771 HA THR 207 HA THR 207 9.916 6.277 2.030 772 HB THR 207 HB THR 207 11.195 5.332 4.596 773 HG1 THR 207 HG1 THR 207 8.990 6.327 4.834 774 HG21 THR 207 HG21 THR 207 12.155 7.690 4.420 775 HG22 THR 207 HG22 THR 207 11.538 7.699 2.769 776 HG23 THR 207 HG23 THR 207 12.741 6.504 3.255 777 H LYS 208 HN LYS 208 11.116 5.440 0.433 778 HA LYS 208 HA LYS 208 12.933 3.332 0.757 779 HB2 LYS 208 HB2 LYS 208 11.906 1.491 -0.354 780 HB3 LYS 208 HB1 LYS 208 10.814 2.012 0.910 781 HG2 LYS 208 HG2 LYS 208 10.508 2.629 -2.030 782 HG3 LYS 208 HG1 LYS 208 9.640 1.385 -1.141 783 HD2 LYS 208 HD2 LYS 208 8.071 2.979 -0.945 784 HD3 LYS 208 HD1 LYS 208 9.105 3.583 0.353 785 HE2 LYS 208 HE2 LYS 208 10.243 5.043 -1.245 786 HE3 LYS 208 HE1 LYS 208 9.192 4.452 -2.529 787 HZ1 LYS 208 HZ1 LYS 208 8.460 6.567 -1.646 788 HZ2 LYS 208 HZ2 LYS 208 8.285 5.887 -0.099 789 HZ3 LYS 208 HZ3 LYS 208 7.306 5.360 -1.375 790 H THR 209 HN THR 209 12.525 2.265 -1.962 791 HA THR 209 HA THR 209 13.292 2.581 -4.039 792 HB THR 209 HB THR 209 12.678 4.705 -5.243 793 HG1 THR 209 HG1 THR 209 12.496 5.782 -2.941 794 HG21 THR 209 HG21 THR 209 10.370 3.426 -3.786 795 HG22 THR 209 HG22 THR 209 11.231 2.671 -5.128 796 HG23 THR 209 HG23 THR 209 10.351 4.178 -5.382 797 H ILE 210 HN ILE 210 15.164 2.851 -2.110 798 HA ILE 210 HA ILE 210 16.969 4.864 -3.287 799 HB ILE 210 HB ILE 210 16.584 5.405 -0.966 800 HG12 ILE 210 HG12 ILE 210 19.285 4.075 -1.263 801 HG13 ILE 210 HG11 ILE 210 18.879 5.688 -1.836 802 HG21 ILE 210 HG21 ILE 210 17.396 2.571 -0.355 803 HG22 ILE 210 HG22 ILE 210 15.797 3.283 -0.147 804 HG23 ILE 210 HG23 ILE 210 17.143 3.834 0.849 805 HD11 ILE 210 HD11 ILE 210 18.480 6.404 0.461 806 HD12 ILE 210 HD12 ILE 210 20.114 5.776 0.248 807 HD13 ILE 210 HD13 ILE 210 18.885 4.785 1.034 808 H GLN 211 HN GLN 211 16.539 1.576 -2.185 809 HA GLN 211 HA GLN 211 19.084 0.802 -3.431 810 HB2 GLN 211 HB2 GLN 211 18.599 0.130 -1.045 811 HB3 GLN 211 HB1 GLN 211 17.282 -0.855 -1.651 812 HG2 GLN 211 HG2 GLN 211 19.263 -2.184 -1.188 813 HG3 GLN 211 HG1 GLN 211 18.846 -2.224 -2.899 814 HE21 GLN 211 HE21 GLN 211 21.094 -1.044 -0.524 815 HE22 GLN 211 HE22 GLN 211 22.347 -0.609 -1.633 816 H ASN 212 HN ASN 212 16.218 1.430 -4.443 817 HA ASN 212 HA ASN 212 16.306 -0.437 -6.617 818 HB2 ASN 212 HB2 ASN 212 14.990 -1.764 -5.045 819 HB3 ASN 212 HB1 ASN 212 13.896 -0.411 -4.780 820 HD21 ASN 212 HD21 ASN 212 14.967 -2.815 -7.085 821 HD22 ASN 212 HD22 ASN 212 13.573 -2.733 -8.101 Start of MODEL 16 1 H1 SER 1 HT1 SER 1 -14.199 -7.235 -12.256 2 H2 SER 1 HT2 SER 1 -13.680 -7.586 -13.824 3 H3 SER 1 HT3 SER 1 -15.322 -7.379 -13.509 4 HA SER 1 HA SER 1 -13.223 -5.311 -13.322 5 HB2 SER 1 HB2 SER 1 -15.579 -5.396 -15.207 6 HB3 SER 1 HB1 SER 1 -14.149 -4.362 -15.289 7 HG SER 1 HG SER 1 -13.562 -5.875 -16.657 8 H GLU 2 HN GLU 2 -16.560 -6.258 -12.661 9 HA GLU 2 HA GLU 2 -17.306 -3.580 -11.910 10 HB2 GLU 2 HB2 GLU 2 -19.457 -4.639 -11.190 11 HB3 GLU 2 HB1 GLU 2 -19.051 -4.879 -12.878 12 HG2 GLU 2 HG2 GLU 2 -18.190 -7.133 -12.283 13 HG3 GLU 2 HG1 GLU 2 -18.790 -6.872 -10.646 14 H GLU 3 HN GLU 3 -15.998 -6.346 -10.294 15 HA GLU 3 HA GLU 3 -16.977 -5.685 -7.699 16 HB2 GLU 3 HB2 GLU 3 -14.802 -7.546 -8.621 17 HB3 GLU 3 HB1 GLU 3 -15.164 -7.292 -6.920 18 HG2 GLU 3 HG2 GLU 3 -17.540 -7.957 -7.466 19 HG3 GLU 3 HG1 GLU 3 -16.928 -8.486 -9.030 20 H GLU 4 HN GLU 4 -14.308 -4.545 -9.576 21 HA GLU 4 HA GLU 4 -12.895 -3.570 -7.247 22 HB2 GLU 4 HB2 GLU 4 -11.358 -2.483 -8.850 23 HB3 GLU 4 HB1 GLU 4 -11.547 -4.204 -9.158 24 HG2 GLU 4 HG2 GLU 4 -12.961 -3.786 -11.031 25 HG3 GLU 4 HG1 GLU 4 -13.033 -2.065 -10.657 26 H ASP 5 HN ASP 5 -15.285 -2.376 -9.468 27 HA ASP 5 HA ASP 5 -15.058 0.321 -8.393 28 HB2 ASP 5 HB2 ASP 5 -16.946 -0.870 -10.439 29 HB3 ASP 5 HB1 ASP 5 -17.073 0.789 -9.857 30 H LYS 6 HN LYS 6 -16.564 -2.584 -7.589 31 HA LYS 6 HA LYS 6 -18.497 -1.169 -5.876 32 HB2 LYS 6 HB2 LYS 6 -19.518 -2.546 -7.712 33 HB3 LYS 6 HB1 LYS 6 -18.776 -3.966 -6.996 34 HG2 LYS 6 HG2 LYS 6 -20.921 -4.082 -6.187 35 HG3 LYS 6 HG1 LYS 6 -20.083 -3.271 -4.869 36 HD2 LYS 6 HD2 LYS 6 -21.618 -1.824 -7.024 37 HD3 LYS 6 HD1 LYS 6 -22.313 -2.299 -5.478 38 HE2 LYS 6 HE2 LYS 6 -20.408 -0.975 -4.413 39 HE3 LYS 6 HE1 LYS 6 -20.135 -0.306 -6.019 40 HZ1 LYS 6 HZ1 LYS 6 -22.395 0.516 -6.037 41 HZ2 LYS 6 HZ2 LYS 6 -21.564 1.118 -4.693 42 HZ3 LYS 6 HZ3 LYS 6 -22.678 -0.143 -4.506 43 H CYS 7 HN CYS 7 -15.761 -1.732 -5.310 44 HA CYS 7 HA CYS 7 -15.607 -4.044 -3.620 45 HB2 CYS 7 HB2 CYS 7 -13.332 -2.844 -2.983 46 HB3 CYS 7 HB1 CYS 7 -13.546 -3.422 -4.642 47 HG CYS 7 HG CYS 7 -13.341 -1.135 -5.819 48 H LYS 8 HN LYS 8 -15.773 -4.125 -1.426 49 HA LYS 8 HA LYS 8 -17.089 -1.899 -0.151 50 HB2 LYS 8 HB2 LYS 8 -16.491 -4.720 0.667 51 HB3 LYS 8 HB1 LYS 8 -17.011 -3.534 1.850 52 HG2 LYS 8 HG2 LYS 8 -18.908 -4.788 1.107 53 HG3 LYS 8 HG1 LYS 8 -19.035 -3.127 0.526 54 HD2 LYS 8 HD2 LYS 8 -18.192 -3.850 -1.668 55 HD3 LYS 8 HD1 LYS 8 -18.098 -5.507 -1.076 56 HE2 LYS 8 HE2 LYS 8 -20.515 -5.510 -0.704 57 HE3 LYS 8 HE1 LYS 8 -20.607 -3.854 -1.296 58 HZ1 LYS 8 HZ1 LYS 8 -19.691 -4.674 -3.430 59 HZ2 LYS 8 HZ2 LYS 8 -21.207 -5.324 -3.055 60 HZ3 LYS 8 HZ3 LYS 8 -19.816 -6.258 -2.844 61 HA PRO 9 HA PRO 9 -13.472 -0.160 1.721 62 HB2 PRO 9 HB2 PRO 9 -15.129 0.747 3.934 63 HB3 PRO 9 HB1 PRO 9 -14.292 1.693 2.701 64 HG2 PRO 9 HG2 PRO 9 -17.005 1.428 2.820 65 HG3 PRO 9 HG1 PRO 9 -16.109 1.758 1.328 66 HD2 PRO 9 HD2 PRO 9 -17.339 -0.783 2.284 67 HD3 PRO 9 HD1 PRO 9 -17.118 -0.179 0.634 68 H MET 10 HN MET 10 -12.019 -1.281 2.858 69 HA MET 10 HA MET 10 -12.777 -3.152 4.881 70 HB2 MET 10 HB2 MET 10 -10.376 -3.481 5.209 71 HB3 MET 10 HB1 MET 10 -10.790 -3.537 3.508 72 HG2 MET 10 HG2 MET 10 -9.975 -1.280 3.208 73 HG3 MET 10 HG1 MET 10 -9.596 -1.185 4.924 74 HE1 MET 10 HE1 MET 10 -8.885 -3.142 1.604 75 HE2 MET 10 HE2 MET 10 -9.085 -4.456 2.763 76 HE3 MET 10 HE3 MET 10 -7.501 -4.136 2.058 77 H SER 11 HN SER 11 -12.141 -3.034 7.101 78 HA SER 11 HA SER 11 -12.978 -0.507 8.161 79 HB2 SER 11 HB2 SER 11 -12.869 -1.741 10.358 80 HB3 SER 11 HB1 SER 11 -13.916 -2.468 9.138 81 HG SER 11 HG SER 11 -12.050 -3.845 8.615 82 H TYR 12 HN TYR 12 -11.909 0.228 10.304 83 HA TYR 12 HA TYR 12 -9.415 1.368 9.799 84 HB2 TYR 12 HB2 TYR 12 -11.041 2.109 11.534 85 HB3 TYR 12 HB1 TYR 12 -10.611 0.704 12.508 86 HD1 TYR 12 HD1 TYR 12 -8.088 0.522 13.157 87 HD2 TYR 12 HD2 TYR 12 -9.949 4.124 11.892 88 HE1 TYR 12 HE1 TYR 12 -6.334 1.817 14.288 89 HE2 TYR 12 HE2 TYR 12 -8.191 5.431 13.018 90 HH TYR 12 HH TYR 12 -5.322 3.964 14.255 91 H GLU 13 HN GLU 13 -10.207 -1.650 11.446 92 HA GLU 13 HA GLU 13 -7.704 -2.369 12.429 93 HB2 GLU 13 HB2 GLU 13 -10.033 -3.483 12.696 94 HB3 GLU 13 HB1 GLU 13 -9.641 -4.340 11.218 95 HG2 GLU 13 HG2 GLU 13 -8.048 -4.449 13.771 96 HG3 GLU 13 HG1 GLU 13 -9.201 -5.661 13.230 97 H GLU 14 HN GLU 14 -9.182 -2.978 9.286 98 HA GLU 14 HA GLU 14 -7.008 -4.575 8.329 99 HB2 GLU 14 HB2 GLU 14 -9.389 -3.367 6.919 100 HB3 GLU 14 HB1 GLU 14 -8.262 -4.494 6.174 101 HG2 GLU 14 HG2 GLU 14 -8.954 -6.269 7.526 102 HG3 GLU 14 HG1 GLU 14 -9.735 -5.191 8.688 103 H LYS 15 HN LYS 15 -8.149 -1.270 7.713 104 HA LYS 15 HA LYS 15 -6.238 -0.484 5.853 105 HB2 LYS 15 HB2 LYS 15 -7.684 1.056 8.002 106 HB3 LYS 15 HB1 LYS 15 -6.610 1.827 6.847 107 HG2 LYS 15 HG2 LYS 15 -8.005 1.339 5.032 108 HG3 LYS 15 HG1 LYS 15 -8.911 0.142 5.965 109 HD2 LYS 15 HD2 LYS 15 -10.198 1.697 6.989 110 HD3 LYS 15 HD1 LYS 15 -8.913 2.906 7.024 111 HE2 LYS 15 HE2 LYS 15 -9.238 3.356 4.667 112 HE3 LYS 15 HE1 LYS 15 -10.456 2.082 4.559 113 HZ1 LYS 15 HZ1 LYS 15 -11.369 4.369 4.757 114 HZ2 LYS 15 HZ2 LYS 15 -10.693 4.480 6.310 115 HZ3 LYS 15 HZ3 LYS 15 -11.891 3.330 5.985 116 H ARG 16 HN ARG 16 -6.109 -0.446 9.391 117 HA ARG 16 HA ARG 16 -3.541 0.677 9.658 118 HB2 ARG 16 HB2 ARG 16 -5.042 0.511 11.555 119 HB3 ARG 16 HB1 ARG 16 -5.029 -1.247 11.462 120 HG2 ARG 16 HG2 ARG 16 -2.441 -0.923 11.789 121 HG3 ARG 16 HG1 ARG 16 -2.952 0.616 12.485 122 HD2 ARG 16 HD2 ARG 16 -2.776 -1.085 14.213 123 HD3 ARG 16 HD1 ARG 16 -4.446 -0.570 14.005 124 HE ARG 16 HE ARG 16 -4.731 -2.648 12.646 125 HH11 ARG 16 HH11 ARG 16 -2.219 -2.444 15.074 126 HH12 ARG 16 HH12 ARG 16 -2.227 -4.145 15.405 127 HH21 ARG 16 HH21 ARG 16 -4.760 -4.896 13.090 128 HH22 ARG 16 HH22 ARG 16 -3.658 -5.535 14.276 129 H GLN 17 HN GLN 17 -4.592 -2.714 9.508 130 HA GLN 17 HA GLN 17 -2.031 -3.832 9.785 131 HB2 GLN 17 HB2 GLN 17 -4.171 -5.048 10.160 132 HB3 GLN 17 HB1 GLN 17 -4.431 -5.045 8.422 133 HG2 GLN 17 HG2 GLN 17 -3.557 -7.174 9.085 134 HG3 GLN 17 HG1 GLN 17 -2.346 -6.317 8.135 135 HE21 GLN 17 HE21 GLN 17 -0.665 -7.519 8.986 136 HE22 GLN 17 HE22 GLN 17 -0.098 -7.303 10.606 137 H LEU 18 HN LEU 18 -3.751 -2.562 7.077 138 HA LEU 18 HA LEU 18 -2.149 -3.715 5.022 139 HB2 LEU 18 HB2 LEU 18 -4.481 -2.313 5.095 140 HB3 LEU 18 HB1 LEU 18 -3.377 -1.063 4.567 141 HG LEU 18 HG LEU 18 -3.680 -3.707 3.146 142 HD11 LEU 18 HD11 LEU 18 -4.991 -1.070 2.556 143 HD12 LEU 18 HD12 LEU 18 -5.802 -2.533 3.106 144 HD13 LEU 18 HD13 LEU 18 -5.037 -2.487 1.517 145 HD21 LEU 18 HD21 LEU 18 -1.632 -2.737 2.531 146 HD22 LEU 18 HD22 LEU 18 -2.319 -1.120 2.476 147 HD23 LEU 18 HD23 LEU 18 -2.754 -2.308 1.249 148 H SER 19 HN SER 19 -2.043 -0.677 6.822 149 HA SER 19 HA SER 19 0.251 0.377 5.595 150 HB2 SER 19 HB2 SER 19 -0.578 0.654 8.498 151 HB3 SER 19 HB1 SER 19 0.479 1.745 7.605 152 HG SER 19 HG SER 19 -2.096 1.232 6.617 153 H LEU 20 HN LEU 20 -0.210 -2.081 7.999 154 HA LEU 20 HA LEU 20 2.555 -2.273 8.725 155 HB2 LEU 20 HB2 LEU 20 0.160 -3.984 9.322 156 HB3 LEU 20 HB1 LEU 20 1.760 -4.338 9.927 157 HG LEU 20 HG LEU 20 0.273 -1.786 10.521 158 HD11 LEU 20 HD11 LEU 20 -0.638 -4.041 11.394 159 HD12 LEU 20 HD12 LEU 20 -0.439 -2.702 12.521 160 HD13 LEU 20 HD13 LEU 20 0.755 -4.001 12.468 161 HD21 LEU 20 HD21 LEU 20 2.792 -1.780 10.598 162 HD22 LEU 20 HD22 LEU 20 2.678 -2.978 11.884 163 HD23 LEU 20 HD23 LEU 20 1.988 -1.372 12.110 164 H ASP 21 HN ASP 21 0.420 -3.852 6.429 165 HA ASP 21 HA ASP 21 2.232 -6.036 6.001 166 HB2 ASP 21 HB2 ASP 21 0.652 -6.795 4.288 167 HB3 ASP 21 HB1 ASP 21 -0.131 -6.467 5.822 168 H ILE 22 HN ILE 22 1.542 -2.997 4.361 169 HA ILE 22 HA ILE 22 3.280 -3.523 2.156 170 HB ILE 22 HB ILE 22 2.369 -0.894 3.337 171 HG12 ILE 22 HG12 ILE 22 1.467 -2.199 0.769 172 HG13 ILE 22 HG11 ILE 22 0.674 -2.534 2.313 173 HG21 ILE 22 HG21 ILE 22 4.317 -0.346 2.165 174 HG22 ILE 22 HG22 ILE 22 2.992 -0.013 1.044 175 HG23 ILE 22 HG23 ILE 22 3.949 -1.483 0.864 176 HD11 ILE 22 HD11 ILE 22 0.185 -0.186 2.546 177 HD12 ILE 22 HD12 ILE 22 -0.505 -0.833 1.067 178 HD13 ILE 22 HD13 ILE 22 0.955 0.158 1.007 179 H ASN 23 HN ASN 23 3.687 -2.166 5.353 180 HA ASN 23 HA ASN 23 6.321 -1.264 5.178 181 HB2 ASN 23 HB2 ASN 23 5.041 -0.679 7.085 182 HB3 ASN 23 HB1 ASN 23 4.664 -2.356 7.445 183 HD21 ASN 23 HD21 ASN 23 7.080 0.135 7.589 184 HD22 ASN 23 HD22 ASN 23 8.114 -0.650 8.730 185 H LYS 24 HN LYS 24 5.029 -4.453 5.182 186 HA LYS 24 HA LYS 24 7.398 -5.802 6.099 187 HB2 LYS 24 HB2 LYS 24 4.854 -6.749 4.796 188 HB3 LYS 24 HB1 LYS 24 6.163 -7.845 5.230 189 HG2 LYS 24 HG2 LYS 24 5.918 -7.235 7.566 190 HG3 LYS 24 HG1 LYS 24 4.673 -6.057 7.146 191 HD2 LYS 24 HD2 LYS 24 3.291 -7.895 6.244 192 HD3 LYS 24 HD1 LYS 24 4.520 -9.044 6.771 193 HE2 LYS 24 HE2 LYS 24 2.986 -7.172 8.572 194 HE3 LYS 24 HE1 LYS 24 2.651 -8.886 8.354 195 HZ1 LYS 24 HZ1 LYS 24 5.143 -7.723 9.469 196 HZ2 LYS 24 HZ2 LYS 24 4.863 -9.372 9.226 197 HZ3 LYS 24 HZ3 LYS 24 3.932 -8.514 10.345 198 H LEU 25 HN LEU 25 6.025 -4.914 2.997 199 HA LEU 25 HA LEU 25 7.444 -6.682 1.353 200 HB2 LEU 25 HB2 LEU 25 6.512 -3.901 0.726 201 HB3 LEU 25 HB1 LEU 25 6.970 -5.093 -0.457 202 HG LEU 25 HG LEU 25 4.547 -5.049 1.298 203 HD11 LEU 25 HD11 LEU 25 5.006 -5.225 -1.659 204 HD12 LEU 25 HD12 LEU 25 4.412 -3.827 -0.772 205 HD13 LEU 25 HD13 LEU 25 3.432 -5.289 -0.879 206 HD21 LEU 25 HD21 LEU 25 5.671 -7.326 -0.266 207 HD22 LEU 25 HD22 LEU 25 4.012 -7.264 0.309 208 HD23 LEU 25 HD23 LEU 25 5.350 -7.289 1.460 209 HA PRO 26 HA PRO 26 11.656 -5.066 1.533 210 HB2 PRO 26 HB2 PRO 26 11.746 -6.546 -1.052 211 HB3 PRO 26 HB1 PRO 26 12.847 -6.627 0.330 212 HG2 PRO 26 HG2 PRO 26 11.116 -8.590 -0.139 213 HG3 PRO 26 HG1 PRO 26 11.455 -8.055 1.519 214 HD2 PRO 26 HD2 PRO 26 9.082 -7.490 -0.210 215 HD3 PRO 26 HD1 PRO 26 9.160 -7.798 1.538 216 H GLY 27 HN GLY 27 12.805 -3.496 0.357 217 HA2 GLY 27 HA2 GLY 27 11.459 -1.379 -0.607 218 HA3 GLY 27 HA1 GLY 27 13.108 -1.721 -1.081 219 H GLU 28 HN GLU 28 12.715 -3.946 -2.723 220 HA GLU 28 HA GLU 28 12.046 -2.746 -5.156 221 HB2 GLU 28 HB2 GLU 28 13.524 -4.666 -5.104 222 HB3 GLU 28 HB1 GLU 28 12.287 -5.657 -4.371 223 HG2 GLU 28 HG2 GLU 28 10.965 -5.239 -6.541 224 HG3 GLU 28 HG1 GLU 28 12.530 -4.767 -7.191 225 H LYS 29 HN LYS 29 10.252 -5.208 -3.335 226 HA LYS 29 HA LYS 29 7.939 -5.171 -4.939 227 HB2 LYS 29 HB2 LYS 29 8.453 -6.026 -2.091 228 HB3 LYS 29 HB1 LYS 29 6.920 -6.296 -2.917 229 HG2 LYS 29 HG2 LYS 29 9.554 -7.331 -3.922 230 HG3 LYS 29 HG1 LYS 29 8.479 -8.249 -2.868 231 HD2 LYS 29 HD2 LYS 29 6.692 -8.032 -4.554 232 HD3 LYS 29 HD1 LYS 29 7.820 -7.207 -5.622 233 HE2 LYS 29 HE2 LYS 29 7.549 -9.596 -6.159 234 HE3 LYS 29 HE1 LYS 29 9.208 -9.162 -5.766 235 HZ1 LYS 29 HZ1 LYS 29 8.598 -11.220 -4.711 236 HZ2 LYS 29 HZ2 LYS 29 7.268 -10.497 -3.956 237 HZ3 LYS 29 HZ3 LYS 29 8.840 -10.039 -3.526 238 H LEU 30 HN LEU 30 8.948 -3.414 -2.135 239 HA LEU 30 HA LEU 30 6.525 -2.175 -1.412 240 HB2 LEU 30 HB2 LEU 30 8.496 -2.309 0.017 241 HB3 LEU 30 HB1 LEU 30 9.400 -1.299 -1.093 242 HG LEU 30 HG LEU 30 8.213 0.627 -0.476 243 HD11 LEU 30 HD11 LEU 30 6.304 -0.800 1.293 244 HD12 LEU 30 HD12 LEU 30 5.984 -0.771 -0.434 245 HD13 LEU 30 HD13 LEU 30 6.133 0.735 0.457 246 HD21 LEU 30 HD21 LEU 30 8.455 0.658 1.976 247 HD22 LEU 30 HD22 LEU 30 9.833 -0.092 1.171 248 HD23 LEU 30 HD23 LEU 30 8.619 -1.098 1.961 249 H GLY 31 HN GLY 31 9.047 -1.187 -3.715 250 HA2 GLY 31 HA2 GLY 31 8.231 1.431 -4.190 251 HA3 GLY 31 HA1 GLY 31 9.026 0.413 -5.374 252 H ARG 32 HN ARG 32 6.795 -1.545 -5.357 253 HA ARG 32 HA ARG 32 5.227 -0.448 -7.421 254 HB2 ARG 32 HB2 ARG 32 5.527 -2.841 -7.250 255 HB3 ARG 32 HB1 ARG 32 4.767 -2.855 -5.668 256 HG2 ARG 32 HG2 ARG 32 3.227 -3.703 -7.335 257 HG3 ARG 32 HG1 ARG 32 2.643 -2.174 -6.693 258 HD2 ARG 32 HD2 ARG 32 2.373 -2.275 -9.130 259 HD3 ARG 32 HD1 ARG 32 3.474 -0.989 -8.646 260 HE ARG 32 HE ARG 32 5.024 -3.234 -9.180 261 HH11 ARG 32 HH11 ARG 32 2.860 -1.107 -10.920 262 HH12 ARG 32 HH12 ARG 32 3.714 -1.258 -12.422 263 HH21 ARG 32 HH21 ARG 32 6.138 -3.461 -11.157 264 HH22 ARG 32 HH22 ARG 32 5.576 -2.612 -12.562 265 H VAL 33 HN VAL 33 4.568 -0.950 -3.976 266 HA VAL 33 HA VAL 33 1.822 -0.211 -4.120 267 HB VAL 33 HB VAL 33 3.173 0.244 -1.539 268 HG11 VAL 33 HG11 VAL 33 0.827 -1.432 -2.423 269 HG12 VAL 33 HG12 VAL 33 0.761 0.219 -1.797 270 HG13 VAL 33 HG13 VAL 33 1.286 -1.097 -0.753 271 HG21 VAL 33 HG21 VAL 33 4.576 -1.561 -2.185 272 HG22 VAL 33 HG22 VAL 33 3.224 -2.443 -2.895 273 HG23 VAL 33 HG23 VAL 33 3.324 -2.243 -1.147 274 H VAL 34 HN VAL 34 4.691 1.563 -2.996 275 HA VAL 34 HA VAL 34 3.508 4.009 -2.449 276 HB VAL 34 HB VAL 34 5.664 4.461 -2.014 277 HG11 VAL 34 HG11 VAL 34 6.135 2.109 -2.219 278 HG12 VAL 34 HG12 VAL 34 7.502 3.082 -2.760 279 HG13 VAL 34 HG13 VAL 34 6.445 2.308 -3.941 280 HG21 VAL 34 HG21 VAL 34 5.519 5.898 -3.994 281 HG22 VAL 34 HG22 VAL 34 6.088 4.570 -4.998 282 HG23 VAL 34 HG23 VAL 34 7.147 5.268 -3.773 283 H HIS 35 HN HIS 35 4.502 2.645 -5.524 284 HA HIS 35 HA HIS 35 3.776 4.869 -7.130 285 HB2 HIS 35 HB2 HIS 35 5.324 3.089 -7.878 286 HB3 HIS 35 HB1 HIS 35 3.972 1.966 -7.925 287 HD1 HIS 35 HD1 HIS 35 5.257 5.070 -9.644 288 HD2 HIS 35 HD2 HIS 35 2.500 2.020 -10.249 289 HE1 HIS 35 HE1 HIS 35 4.417 5.374 -11.991 290 HE2 HIS 35 HE2 HIS 35 2.865 3.429 -12.385 291 H ILE 36 HN ILE 36 2.052 1.897 -6.207 292 HA ILE 36 HA ILE 36 -0.196 2.196 -7.810 293 HB ILE 36 HB ILE 36 -0.166 1.026 -5.017 294 HG12 ILE 36 HG12 ILE 36 0.266 -0.213 -7.737 295 HG13 ILE 36 HG11 ILE 36 1.400 -0.163 -6.401 296 HG21 ILE 36 HG21 ILE 36 -2.362 0.698 -5.248 297 HG22 ILE 36 HG22 ILE 36 -2.088 -0.153 -6.769 298 HG23 ILE 36 HG23 ILE 36 -2.317 1.593 -6.767 299 HD11 ILE 36 HD11 ILE 36 -0.147 -1.620 -5.114 300 HD12 ILE 36 HD12 ILE 36 0.506 -2.367 -6.570 301 HD13 ILE 36 HD13 ILE 36 -1.144 -1.750 -6.561 302 H ILE 37 HN ILE 37 0.223 3.329 -4.441 303 HA ILE 37 HA ILE 37 -2.328 4.485 -4.269 304 HB ILE 37 HB ILE 37 0.123 5.385 -2.758 305 HG12 ILE 37 HG12 ILE 37 -1.609 3.859 -1.134 306 HG13 ILE 37 HG11 ILE 37 -1.407 2.945 -2.623 307 HG21 ILE 37 HG21 ILE 37 -2.091 6.761 -2.925 308 HG22 ILE 37 HG22 ILE 37 -1.283 6.560 -1.367 309 HG23 ILE 37 HG23 ILE 37 -2.685 5.567 -1.769 310 HD11 ILE 37 HD11 ILE 37 0.932 2.836 -2.341 311 HD12 ILE 37 HD12 ILE 37 0.203 2.411 -0.791 312 HD13 ILE 37 HD13 ILE 37 0.891 4.015 -1.035 313 H GLN 38 HN GLN 38 0.804 6.044 -4.908 314 HA GLN 38 HA GLN 38 -0.115 8.633 -5.345 315 HB2 GLN 38 HB2 GLN 38 2.230 7.153 -6.537 316 HB3 GLN 38 HB1 GLN 38 1.959 8.867 -6.820 317 HG2 GLN 38 HG2 GLN 38 1.831 8.628 -4.058 318 HG3 GLN 38 HG1 GLN 38 3.102 7.505 -4.525 319 HE21 GLN 38 HE21 GLN 38 4.690 8.801 -3.588 320 HE22 GLN 38 HE22 GLN 38 5.216 10.279 -4.315 321 H SER 39 HN SER 39 -0.166 5.869 -7.473 322 HA SER 39 HA SER 39 -0.793 7.404 -9.818 323 HB2 SER 39 HB2 SER 39 0.453 5.310 -9.999 324 HB3 SER 39 HB1 SER 39 -0.910 4.424 -9.316 325 HG SER 39 HG SER 39 -1.202 5.989 -11.648 326 H ARG 40 HN ARG 40 -2.650 5.758 -7.306 327 HA ARG 40 HA ARG 40 -5.053 5.863 -8.957 328 HB2 ARG 40 HB2 ARG 40 -4.808 4.932 -6.102 329 HB3 ARG 40 HB1 ARG 40 -6.157 4.655 -7.189 330 HG2 ARG 40 HG2 ARG 40 -4.313 3.458 -8.644 331 HG3 ARG 40 HG1 ARG 40 -3.503 3.323 -7.080 332 HD2 ARG 40 HD2 ARG 40 -4.783 1.351 -7.439 333 HD3 ARG 40 HD1 ARG 40 -5.526 2.306 -6.162 334 HE ARG 40 HE ARG 40 -6.952 3.131 -8.222 335 HH11 ARG 40 HH11 ARG 40 -5.950 -0.117 -7.393 336 HH12 ARG 40 HH12 ARG 40 -7.308 -0.873 -8.155 337 HH21 ARG 40 HH21 ARG 40 -8.735 2.143 -9.243 338 HH22 ARG 40 HH22 ARG 40 -8.899 0.418 -9.213 339 H GLU 41 HN GLU 41 -3.579 7.364 -6.191 340 HA GLU 41 HA GLU 41 -5.906 9.092 -5.802 341 HB2 GLU 41 HB2 GLU 41 -3.606 8.665 -3.953 342 HB3 GLU 41 HB1 GLU 41 -5.228 9.229 -3.582 343 HG2 GLU 41 HG2 GLU 41 -4.981 6.660 -4.884 344 HG3 GLU 41 HG1 GLU 41 -4.480 6.732 -3.233 345 HA PRO 42 HA PRO 42 -3.074 12.145 -7.741 346 HB2 PRO 42 HB2 PRO 42 -5.579 13.692 -7.846 347 HB3 PRO 42 HB1 PRO 42 -4.450 13.294 -9.142 348 HG2 PRO 42 HG2 PRO 42 -6.864 12.137 -8.969 349 HG3 PRO 42 HG1 PRO 42 -5.444 11.259 -9.564 350 HD2 PRO 42 HD2 PRO 42 -6.775 11.121 -6.892 351 HD3 PRO 42 HD1 PRO 42 -6.060 9.822 -7.872 352 H SER 43 HN SER 43 -4.990 12.150 -4.928 353 HA SER 43 HA SER 43 -4.543 14.917 -4.229 354 HB2 SER 43 HB2 SER 43 -6.579 13.994 -3.344 355 HB3 SER 43 HB1 SER 43 -5.717 12.622 -2.639 356 HG SER 43 HG SER 43 -4.607 14.300 -1.337 357 H LEU 44 HN LEU 44 -2.556 12.235 -4.193 358 HA LEU 44 HA LEU 44 -0.832 13.540 -2.218 359 HB2 LEU 44 HB2 LEU 44 -0.188 11.346 -1.288 360 HB3 LEU 44 HB1 LEU 44 -1.850 11.784 -0.974 361 HG LEU 44 HG LEU 44 -2.170 10.273 -3.206 362 HD11 LEU 44 HD11 LEU 44 0.228 9.758 -3.302 363 HD12 LEU 44 HD12 LEU 44 -0.761 8.321 -3.049 364 HD13 LEU 44 HD13 LEU 44 0.121 9.032 -1.698 365 HD21 LEU 44 HD21 LEU 44 -3.413 10.067 -1.132 366 HD22 LEU 44 HD22 LEU 44 -2.019 9.318 -0.350 367 HD23 LEU 44 HD23 LEU 44 -2.842 8.487 -1.669 368 H LYS 45 HN LYS 45 -0.861 13.320 -5.216 369 HA LYS 45 HA LYS 45 1.393 11.585 -5.720 370 HB2 LYS 45 HB2 LYS 45 0.833 11.595 -7.892 371 HB3 LYS 45 HB1 LYS 45 -0.695 12.193 -7.303 372 HG2 LYS 45 HG2 LYS 45 1.384 14.175 -8.025 373 HG3 LYS 45 HG1 LYS 45 0.591 13.298 -9.335 374 HD2 LYS 45 HD2 LYS 45 -0.830 15.068 -9.154 375 HD3 LYS 45 HD1 LYS 45 -1.562 14.010 -7.938 376 HE2 LYS 45 HE2 LYS 45 -0.062 15.095 -6.265 377 HE3 LYS 45 HE1 LYS 45 0.362 16.275 -7.500 378 HZ1 LYS 45 HZ1 LYS 45 -2.385 15.785 -6.480 379 HZ2 LYS 45 HZ2 LYS 45 -1.953 16.924 -7.655 380 HZ3 LYS 45 HZ3 LYS 45 -1.403 17.100 -6.066 381 H ASN 46 HN ASN 46 1.159 14.628 -4.499 382 HA ASN 46 HA ASN 46 3.562 15.662 -5.784 383 HB2 ASN 46 HB2 ASN 46 1.779 16.762 -3.609 384 HB3 ASN 46 HB1 ASN 46 3.298 17.525 -4.058 385 HD21 ASN 46 HD21 ASN 46 0.622 18.584 -4.206 386 HD22 ASN 46 HD22 ASN 46 0.354 19.000 -5.864 387 H SER 47 HN SER 47 2.813 13.541 -3.339 388 HA SER 47 HA SER 47 4.692 14.190 -1.348 389 HB2 SER 47 HB2 SER 47 3.678 11.420 -2.056 390 HB3 SER 47 HB1 SER 47 4.277 11.976 -0.491 391 HG SER 47 HG SER 47 1.794 12.194 -1.585 392 H ASN 48 HN ASN 48 6.867 13.819 -1.203 393 HA ASN 48 HA ASN 48 8.441 13.183 -3.422 394 HB2 ASN 48 HB2 ASN 48 9.209 12.720 -0.522 395 HB3 ASN 48 HB1 ASN 48 10.309 12.927 -1.878 396 HD21 ASN 48 HD21 ASN 48 10.038 14.389 0.640 397 HD22 ASN 48 HD22 ASN 48 9.828 16.047 0.188 398 HA PRO 49 HA PRO 49 7.490 8.918 -3.834 399 HB2 PRO 49 HB2 PRO 49 9.682 8.170 -5.327 400 HB3 PRO 49 HB1 PRO 49 8.220 8.912 -5.976 401 HG2 PRO 49 HG2 PRO 49 10.854 10.154 -5.327 402 HG3 PRO 49 HG1 PRO 49 9.751 10.499 -6.670 403 HD2 PRO 49 HD2 PRO 49 9.943 12.102 -4.501 404 HD3 PRO 49 HD1 PRO 49 8.418 11.880 -5.385 405 H ASP 50 HN ASP 50 10.478 10.002 -2.440 406 HA ASP 50 HA ASP 50 11.289 7.372 -1.593 407 HB2 ASP 50 HB2 ASP 50 12.365 10.031 -0.646 408 HB3 ASP 50 HB1 ASP 50 13.145 8.464 -0.499 409 H GLU 51 HN GLU 51 9.439 10.010 -0.318 410 HA GLU 51 HA GLU 51 9.065 8.610 2.238 411 HB2 GLU 51 HB2 GLU 51 10.107 11.361 1.776 412 HB3 GLU 51 HB1 GLU 51 8.920 11.194 3.063 413 HG2 GLU 51 HG2 GLU 51 10.316 9.554 4.165 414 HG3 GLU 51 HG1 GLU 51 11.476 9.627 2.843 415 H ILE 52 HN ILE 52 7.159 8.086 0.711 416 HA ILE 52 HA ILE 52 5.493 10.227 -0.139 417 HB ILE 52 HB ILE 52 4.168 8.634 -1.218 418 HG12 ILE 52 HG12 ILE 52 5.337 6.401 0.379 419 HG13 ILE 52 HG11 ILE 52 3.906 7.270 0.937 420 HG21 ILE 52 HG21 ILE 52 6.807 7.204 -1.042 421 HG22 ILE 52 HG22 ILE 52 6.598 8.726 -1.925 422 HG23 ILE 52 HG23 ILE 52 5.697 7.293 -2.420 423 HD11 ILE 52 HD11 ILE 52 2.771 6.684 -1.148 424 HD12 ILE 52 HD12 ILE 52 3.280 5.255 -0.247 425 HD13 ILE 52 HD13 ILE 52 4.195 5.781 -1.658 426 H GLU 53 HN GLU 53 3.261 10.535 0.395 427 HA GLU 53 HA GLU 53 2.734 9.981 3.232 428 HB2 GLU 53 HB2 GLU 53 3.096 12.377 2.569 429 HB3 GLU 53 HB1 GLU 53 1.663 12.258 1.561 430 HG2 GLU 53 HG2 GLU 53 0.354 12.692 3.288 431 HG3 GLU 53 HG1 GLU 53 1.045 11.344 4.197 432 H ILE 54 HN ILE 54 1.356 8.328 3.353 433 HA ILE 54 HA ILE 54 -0.891 8.200 1.443 434 HB ILE 54 HB ILE 54 0.115 6.076 3.344 435 HG12 ILE 54 HG12 ILE 54 0.313 6.125 0.330 436 HG13 ILE 54 HG11 ILE 54 1.625 6.639 1.393 437 HG21 ILE 54 HG21 ILE 54 -1.370 4.600 2.009 438 HG22 ILE 54 HG22 ILE 54 -2.016 6.036 1.218 439 HG23 ILE 54 HG23 ILE 54 -2.232 5.811 2.956 440 HD11 ILE 54 HD11 ILE 54 1.806 4.312 0.547 441 HD12 ILE 54 HD12 ILE 54 0.367 3.914 1.483 442 HD13 ILE 54 HD13 ILE 54 1.833 4.451 2.301 443 H ASP 55 HN ASP 55 -2.969 8.477 2.149 444 HA ASP 55 HA ASP 55 -3.321 8.741 5.073 445 HB2 ASP 55 HB2 ASP 55 -3.588 10.883 3.699 446 HB3 ASP 55 HB1 ASP 55 -5.019 10.136 2.995 447 H PHE 56 HN PHE 56 -4.085 6.738 5.556 448 HA PHE 56 HA PHE 56 -5.345 5.117 3.651 449 HB2 PHE 56 HB2 PHE 56 -4.426 4.857 6.386 450 HB3 PHE 56 HB1 PHE 56 -5.850 3.872 6.047 451 HD1 PHE 56 HD1 PHE 56 -2.343 4.516 5.106 452 HD2 PHE 56 HD2 PHE 56 -5.750 2.046 4.554 453 HE1 PHE 56 HE1 PHE 56 -0.963 2.873 3.898 454 HE2 PHE 56 HE2 PHE 56 -4.394 0.415 3.358 455 HZ PHE 56 HZ PHE 56 -1.996 0.802 3.029 456 H GLU 57 HN GLU 57 -6.755 7.408 5.785 457 HA GLU 57 HA GLU 57 -9.341 6.130 5.743 458 HB2 GLU 57 HB2 GLU 57 -8.323 8.705 6.867 459 HB3 GLU 57 HB1 GLU 57 -10.043 8.349 6.817 460 HG2 GLU 57 HG2 GLU 57 -8.016 6.547 8.098 461 HG3 GLU 57 HG1 GLU 57 -8.898 7.802 8.969 462 H THR 58 HN THR 58 -7.654 7.977 3.540 463 HA THR 58 HA THR 58 -10.181 8.956 2.392 464 HB THR 58 HB THR 58 -8.858 10.742 1.278 465 HG1 THR 58 HG1 THR 58 -6.776 10.413 3.098 466 HG21 THR 58 HG21 THR 58 -8.714 10.599 4.280 467 HG22 THR 58 HG22 THR 58 -10.076 11.200 3.328 468 HG23 THR 58 HG23 THR 58 -8.545 12.079 3.334 469 H LEU 59 HN LEU 59 -7.690 6.772 1.946 470 HA LEU 59 HA LEU 59 -7.445 6.826 -0.886 471 HB2 LEU 59 HB2 LEU 59 -7.294 4.237 0.623 472 HB3 LEU 59 HB1 LEU 59 -6.388 4.760 -0.773 473 HG LEU 59 HG LEU 59 -5.977 5.683 2.060 474 HD11 LEU 59 HD11 LEU 59 -4.431 3.875 0.220 475 HD12 LEU 59 HD12 LEU 59 -5.080 3.524 1.822 476 HD13 LEU 59 HD13 LEU 59 -3.719 4.630 1.645 477 HD21 LEU 59 HD21 LEU 59 -4.804 6.635 -0.524 478 HD22 LEU 59 HD22 LEU 59 -3.919 6.774 0.987 479 HD23 LEU 59 HD23 LEU 59 -5.477 7.577 0.799 480 H LYS 60 HN LYS 60 -8.494 5.636 -2.441 481 HA LYS 60 HA LYS 60 -11.254 5.073 -2.092 482 HB2 LYS 60 HB2 LYS 60 -9.383 4.111 -4.266 483 HB3 LYS 60 HB1 LYS 60 -11.137 4.196 -4.372 484 HG2 LYS 60 HG2 LYS 60 -11.018 6.633 -4.220 485 HG3 LYS 60 HG1 LYS 60 -9.257 6.540 -4.113 486 HD2 LYS 60 HD2 LYS 60 -9.188 5.481 -6.322 487 HD3 LYS 60 HD1 LYS 60 -10.946 5.601 -6.431 488 HE2 LYS 60 HE2 LYS 60 -9.959 7.411 -7.663 489 HE3 LYS 60 HE1 LYS 60 -10.749 8.056 -6.227 490 HZ1 LYS 60 HZ1 LYS 60 -8.679 9.131 -6.414 491 HZ2 LYS 60 HZ2 LYS 60 -7.845 7.689 -6.694 492 HZ3 LYS 60 HZ3 LYS 60 -8.484 8.011 -5.157 493 HA PRO 61 HA PRO 61 -11.231 0.940 -0.440 494 HB2 PRO 61 HB2 PRO 61 -13.408 0.337 -2.347 495 HB3 PRO 61 HB1 PRO 61 -13.404 0.244 -0.585 496 HG2 PRO 61 HG2 PRO 61 -14.712 2.179 -1.934 497 HG3 PRO 61 HG1 PRO 61 -14.004 2.449 -0.335 498 HD2 PRO 61 HD2 PRO 61 -13.055 3.351 -3.006 499 HD3 PRO 61 HD1 PRO 61 -12.863 4.114 -1.416 500 H SER 62 HN SER 62 -11.349 1.485 -3.908 501 HA SER 62 HA SER 62 -10.499 -1.139 -4.624 502 HB2 SER 62 HB2 SER 62 -9.989 0.060 -6.858 503 HB3 SER 62 HB1 SER 62 -11.667 -0.002 -6.313 504 HG SER 62 HG SER 62 -11.657 2.098 -5.973 505 H THR 63 HN THR 63 -8.881 1.926 -4.005 506 HA THR 63 HA THR 63 -6.277 1.162 -4.724 507 HB THR 63 HB THR 63 -6.783 2.966 -2.349 508 HG1 THR 63 HG1 THR 63 -7.237 4.647 -3.819 509 HG21 THR 63 HG21 THR 63 -4.472 2.407 -3.198 510 HG22 THR 63 HG22 THR 63 -4.858 4.118 -3.119 511 HG23 THR 63 HG23 THR 63 -4.880 3.280 -4.667 512 H LEU 64 HN LEU 64 -7.986 1.032 -1.609 513 HA LEU 64 HA LEU 64 -5.980 -0.189 -0.105 514 HB2 LEU 64 HB2 LEU 64 -8.980 -0.362 0.135 515 HB3 LEU 64 HB1 LEU 64 -7.880 -1.015 1.331 516 HG LEU 64 HG LEU 64 -8.001 1.898 0.556 517 HD11 LEU 64 HD11 LEU 64 -10.067 1.174 1.697 518 HD12 LEU 64 HD12 LEU 64 -9.098 2.258 2.690 519 HD13 LEU 64 HD13 LEU 64 -9.086 0.527 3.009 520 HD21 LEU 64 HD21 LEU 64 -5.840 1.329 1.365 521 HD22 LEU 64 HD22 LEU 64 -6.526 0.401 2.694 522 HD23 LEU 64 HD23 LEU 64 -6.706 2.154 2.658 523 H ARG 65 HN ARG 65 -8.508 -1.679 -2.095 524 HA ARG 65 HA ARG 65 -7.768 -4.332 -1.272 525 HB2 ARG 65 HB2 ARG 65 -9.837 -3.134 -2.974 526 HB3 ARG 65 HB1 ARG 65 -9.266 -4.676 -3.554 527 HG2 ARG 65 HG2 ARG 65 -10.423 -4.105 -0.842 528 HG3 ARG 65 HG1 ARG 65 -11.234 -4.974 -2.152 529 HD2 ARG 65 HD2 ARG 65 -9.389 -6.689 -1.989 530 HD3 ARG 65 HD1 ARG 65 -8.849 -5.864 -0.524 531 HE ARG 65 HE ARG 65 -11.556 -6.349 -0.214 532 HH11 ARG 65 HH11 ARG 65 -8.596 -8.208 -0.426 533 HH12 ARG 65 HH12 ARG 65 -9.281 -9.605 0.344 534 HH21 ARG 65 HH21 ARG 65 -12.434 -8.175 0.830 535 HH22 ARG 65 HH22 ARG 65 -11.448 -9.581 1.070 536 H GLU 66 HN GLU 66 -6.575 -2.101 -3.537 537 HA GLU 66 HA GLU 66 -5.300 -4.102 -5.186 538 HB2 GLU 66 HB2 GLU 66 -5.988 -2.051 -6.248 539 HB3 GLU 66 HB1 GLU 66 -5.091 -1.091 -5.078 540 HG2 GLU 66 HG2 GLU 66 -3.857 -1.086 -7.086 541 HG3 GLU 66 HG1 GLU 66 -2.997 -2.139 -5.963 542 H LEU 67 HN LEU 67 -4.475 -1.805 -2.652 543 HA LEU 67 HA LEU 67 -1.695 -2.279 -2.622 544 HB2 LEU 67 HB2 LEU 67 -3.494 -1.399 -0.351 545 HB3 LEU 67 HB1 LEU 67 -1.763 -1.128 -0.454 546 HG LEU 67 HG LEU 67 -3.868 0.105 -2.243 547 HD11 LEU 67 HD11 LEU 67 -2.102 1.395 -0.169 548 HD12 LEU 67 HD12 LEU 67 -3.794 0.970 0.079 549 HD13 LEU 67 HD13 LEU 67 -3.358 2.170 -1.136 550 HD21 LEU 67 HD21 LEU 67 -1.642 -0.388 -3.305 551 HD22 LEU 67 HD22 LEU 67 -0.946 0.759 -2.161 552 HD23 LEU 67 HD23 LEU 67 -2.158 1.295 -3.319 553 H GLU 68 HN GLU 68 -4.426 -3.519 -0.769 554 HA GLU 68 HA GLU 68 -2.931 -5.191 0.952 555 HB2 GLU 68 HB2 GLU 68 -5.147 -4.401 1.540 556 HB3 GLU 68 HB1 GLU 68 -5.850 -5.254 0.178 557 HG2 GLU 68 HG2 GLU 68 -4.331 -6.829 2.171 558 HG3 GLU 68 HG1 GLU 68 -5.909 -6.205 2.626 559 H ARG 69 HN ARG 69 -5.019 -6.029 -1.854 560 HA ARG 69 HA ARG 69 -4.477 -8.749 -1.910 561 HB2 ARG 69 HB2 ARG 69 -6.136 -7.814 -3.403 562 HB3 ARG 69 HB1 ARG 69 -4.900 -6.917 -4.276 563 HG2 ARG 69 HG2 ARG 69 -3.879 -9.050 -4.975 564 HG3 ARG 69 HG1 ARG 69 -5.194 -9.919 -4.196 565 HD2 ARG 69 HD2 ARG 69 -5.626 -9.667 -6.577 566 HD3 ARG 69 HD1 ARG 69 -6.769 -8.700 -5.651 567 HE ARG 69 HE ARG 69 -4.414 -7.275 -6.512 568 HH11 ARG 69 HH11 ARG 69 -7.691 -8.188 -7.347 569 HH12 ARG 69 HH12 ARG 69 -7.939 -6.823 -8.383 570 HH21 ARG 69 HH21 ARG 69 -4.742 -5.466 -7.862 571 HH22 ARG 69 HH22 ARG 69 -6.264 -5.280 -8.680 572 H TYR 70 HN TYR 70 -2.525 -6.119 -3.069 573 HA TYR 70 HA TYR 70 -0.781 -7.790 -4.610 574 HB2 TYR 70 HB2 TYR 70 -0.930 -5.554 -5.359 575 HB3 TYR 70 HB1 TYR 70 -0.664 -4.910 -3.741 576 HD1 TYR 70 HD2 TYR 70 1.012 -6.688 -6.539 577 HD2 TYR 70 HD1 TYR 70 1.466 -4.435 -2.965 578 HE1 TYR 70 HE2 TYR 70 3.424 -6.512 -6.973 579 HE2 TYR 70 HE1 TYR 70 3.884 -4.246 -3.387 580 HH TYR 70 HH TYR 70 5.607 -5.126 -4.600 581 H VAL 71 HN VAL 71 -0.582 -6.222 -1.430 582 HA VAL 71 HA VAL 71 2.045 -7.193 -0.942 583 HB VAL 71 HB VAL 71 1.714 -6.541 1.370 584 HG11 VAL 71 HG11 VAL 71 0.592 -4.155 0.506 585 HG12 VAL 71 HG12 VAL 71 1.380 -4.827 -0.914 586 HG13 VAL 71 HG13 VAL 71 2.300 -4.557 0.568 587 HG21 VAL 71 HG21 VAL 71 -0.405 -7.017 2.044 588 HG22 VAL 71 HG22 VAL 71 -1.136 -6.409 0.558 589 HG23 VAL 71 HG23 VAL 71 -0.543 -5.279 1.777 590 H THR 72 HN THR 72 -1.184 -8.320 0.022 591 HA THR 72 HA THR 72 -0.327 -10.411 1.662 592 HB THR 72 HB THR 72 -2.688 -9.511 1.469 593 HG1 THR 72 HG1 THR 72 -3.237 -11.273 2.503 594 HG21 THR 72 HG21 THR 72 -2.855 -9.718 -0.976 595 HG22 THR 72 HG22 THR 72 -4.179 -10.520 -0.133 596 HG23 THR 72 HG23 THR 72 -2.857 -11.472 -0.814 597 H SER 73 HN SER 73 -0.676 -10.185 -1.816 598 HA SER 73 HA SER 73 -0.324 -12.900 -2.442 599 HB2 SER 73 HB2 SER 73 -0.028 -12.207 -4.658 600 HB3 SER 73 HB1 SER 73 -0.932 -10.859 -3.965 601 HG SER 73 HG SER 73 0.914 -9.661 -3.854 602 H CYS 74 HN CYS 74 1.900 -10.416 -1.484 603 HA CYS 74 HA CYS 74 4.239 -11.976 -2.214 604 HB2 CYS 74 HB2 CYS 74 4.244 -9.557 -2.633 605 HB3 CYS 74 HB1 CYS 74 4.024 -9.245 -0.911 606 HG CYS 74 HG CYS 74 6.566 -10.901 -0.596 607 H LEU 75 HN LEU 75 2.869 -10.560 0.773 608 HA LEU 75 HA LEU 75 4.683 -11.486 2.627 609 HB2 LEU 75 HB2 LEU 75 1.758 -11.567 3.243 610 HB3 LEU 75 HB1 LEU 75 3.085 -11.072 4.267 611 HG LEU 75 HG LEU 75 2.165 -9.490 1.890 612 HD11 LEU 75 HD11 LEU 75 1.580 -8.828 4.740 613 HD12 LEU 75 HD12 LEU 75 0.494 -9.857 3.808 614 HD13 LEU 75 HD13 LEU 75 0.825 -8.216 3.268 615 HD21 LEU 75 HD21 LEU 75 4.489 -9.191 2.693 616 HD22 LEU 75 HD22 LEU 75 3.845 -8.720 4.264 617 HD23 LEU 75 HD23 LEU 75 3.495 -7.743 2.836 618 H ARG 76 HN ARG 76 2.008 -13.229 1.151 619 HA ARG 76 HA ARG 76 2.223 -15.435 2.992 620 HB2 ARG 76 HB2 ARG 76 0.484 -14.895 0.599 621 HB3 ARG 76 HB1 ARG 76 0.455 -16.438 1.448 622 HG2 ARG 76 HG2 ARG 76 -0.446 -15.513 3.366 623 HG3 ARG 76 HG1 ARG 76 0.089 -13.883 2.951 624 HD2 ARG 76 HD2 ARG 76 -2.322 -14.118 2.706 625 HD3 ARG 76 HD1 ARG 76 -1.547 -13.786 1.159 626 HE ARG 76 HE ARG 76 -1.869 -16.580 1.552 627 HH11 ARG 76 HH11 ARG 76 -3.635 -13.668 0.745 628 HH12 ARG 76 HH12 ARG 76 -4.854 -14.505 -0.165 629 HH21 ARG 76 HH21 ARG 76 -3.456 -17.687 0.344 630 HH22 ARG 76 HH22 ARG 76 -4.744 -16.795 -0.403 631 H LYS 77 HN LYS 77 4.154 -14.578 0.568 632 HA LYS 77 HA LYS 77 4.753 -17.368 -0.110 633 HB2 LYS 77 HB2 LYS 77 4.556 -15.042 -2.001 634 HB3 LYS 77 HB1 LYS 77 5.438 -16.511 -2.400 635 HG2 LYS 77 HG2 LYS 77 3.489 -17.829 -2.298 636 HG3 LYS 77 HG1 LYS 77 2.572 -16.527 -1.544 637 HD2 LYS 77 HD2 LYS 77 2.754 -15.211 -3.602 638 HD3 LYS 77 HD1 LYS 77 3.689 -16.508 -4.349 639 HE2 LYS 77 HE2 LYS 77 1.384 -16.612 -5.085 640 HE3 LYS 77 HE1 LYS 77 1.768 -18.018 -4.097 641 HZ1 LYS 77 HZ1 LYS 77 0.319 -15.600 -3.162 642 HZ2 LYS 77 HZ2 LYS 77 0.667 -16.966 -2.229 643 HZ3 LYS 77 HZ3 LYS 77 -0.392 -17.087 -3.538 644 H LYS 78 HN LYS 78 6.933 -17.878 -0.319 645 HA LYS 78 HA LYS 78 8.688 -16.049 1.058 646 HB2 LYS 78 HB2 LYS 78 8.942 -18.907 0.185 647 HB3 LYS 78 HB1 LYS 78 10.351 -18.000 0.714 648 HG2 LYS 78 HG2 LYS 78 9.470 -19.305 2.541 649 HG3 LYS 78 HG1 LYS 78 9.254 -17.587 2.874 650 HD2 LYS 78 HD2 LYS 78 6.918 -17.755 2.132 651 HD3 LYS 78 HD1 LYS 78 7.141 -19.484 1.855 652 HE2 LYS 78 HE2 LYS 78 6.065 -19.136 3.990 653 HE3 LYS 78 HE1 LYS 78 7.690 -19.768 4.241 654 HZ1 LYS 78 HZ1 LYS 78 8.460 -17.587 4.808 655 HZ2 LYS 78 HZ2 LYS 78 7.103 -17.932 5.755 656 HZ3 LYS 78 HZ3 LYS 78 6.964 -16.898 4.428 657 H ARG 79 HN ARG 79 8.500 -14.528 -0.846 658 HA ARG 79 HA ARG 79 10.832 -15.055 -2.538 659 HB2 ARG 79 HB2 ARG 79 9.742 -13.684 -4.348 660 HB3 ARG 79 HB1 ARG 79 9.057 -15.278 -4.074 661 HG2 ARG 79 HG2 ARG 79 7.651 -13.435 -2.445 662 HG3 ARG 79 HG1 ARG 79 7.755 -12.767 -4.075 663 HD2 ARG 79 HD2 ARG 79 6.804 -15.536 -3.378 664 HD3 ARG 79 HD1 ARG 79 5.756 -14.169 -3.753 665 HE ARG 79 HE ARG 79 7.650 -15.369 -5.677 666 HH11 ARG 79 HH11 ARG 79 4.580 -13.841 -4.953 667 HH12 ARG 79 HH12 ARG 79 3.993 -13.957 -6.580 668 HH21 ARG 79 HH21 ARG 79 6.864 -15.530 -7.825 669 HH22 ARG 79 HH22 ARG 79 5.287 -14.915 -8.209 670 H LYS 80 HN LYS 80 11.807 -13.964 -0.679 671 HA LYS 80 HA LYS 80 11.836 -11.055 -1.153 672 HB2 LYS 80 HB2 LYS 80 12.180 -12.383 1.542 673 HB3 LYS 80 HB1 LYS 80 12.229 -10.660 1.219 674 HG2 LYS 80 HG2 LYS 80 9.858 -10.762 0.521 675 HG3 LYS 80 HG1 LYS 80 9.832 -12.468 0.974 676 HD2 LYS 80 HD2 LYS 80 10.440 -10.163 2.829 677 HD3 LYS 80 HD1 LYS 80 8.910 -11.037 2.745 678 HE2 LYS 80 HE2 LYS 80 9.980 -13.072 3.475 679 HE3 LYS 80 HE1 LYS 80 11.565 -12.305 3.415 680 HZ1 LYS 80 HZ1 LYS 80 9.346 -11.528 5.232 681 HZ2 LYS 80 HZ2 LYS 80 10.880 -10.815 5.179 682 HZ3 LYS 80 HZ3 LYS 80 10.713 -12.423 5.671 683 HA PRO 81 HA PRO 81 16.079 -13.224 -1.606 684 HB2 PRO 81 HB2 PRO 81 16.118 -11.450 -3.981 685 HB3 PRO 81 HB1 PRO 81 16.613 -13.140 -3.830 686 HG2 PRO 81 HG2 PRO 81 14.341 -12.419 -5.081 687 HG3 PRO 81 HG1 PRO 81 14.477 -13.929 -4.164 688 HD2 PRO 81 HD2 PRO 81 13.069 -11.397 -3.456 689 HD3 PRO 81 HD1 PRO 81 12.688 -13.083 -3.024 690 H GLN 82 HN GLN 82 15.216 -9.889 -2.528 691 HA GLN 82 HA GLN 82 17.536 -8.938 -0.980 692 HB2 GLN 82 HB2 GLN 82 17.766 -8.522 -3.382 693 HB3 GLN 82 HB1 GLN 82 16.207 -7.714 -3.406 694 HG2 GLN 82 HG2 GLN 82 17.119 -6.008 -1.869 695 HG3 GLN 82 HG1 GLN 82 18.693 -6.788 -1.995 696 HE21 GLN 82 HE21 GLN 82 19.642 -4.974 -2.890 697 HE22 GLN 82 HE22 GLN 82 19.334 -4.473 -4.515 698 H ALA 83 HN ALA 83 17.064 -7.760 0.763 699 HA ALA 83 HA ALA 83 14.677 -6.085 0.785 700 HB1 ALA 83 HB1 ALA 83 13.974 -8.228 1.768 701 HB2 ALA 83 HB2 ALA 83 13.936 -6.912 2.942 702 HB3 ALA 83 HB3 ALA 83 15.256 -8.081 2.972 703 H1 GLU 201 HT1 GLU 201 -7.061 7.983 12.818 704 H2 GLU 201 HT2 GLU 201 -7.397 9.623 12.594 705 H3 GLU 201 HT3 GLU 201 -5.868 9.137 13.124 706 HA GLU 201 HA GLU 201 -7.031 8.445 10.501 707 HB2 GLU 201 HB2 GLU 201 -4.936 10.505 11.216 708 HB3 GLU 201 HB1 GLU 201 -5.400 10.056 9.582 709 HG2 GLU 201 HG2 GLU 201 -7.670 10.871 10.015 710 HG3 GLU 201 HG1 GLU 201 -7.179 11.344 11.639 711 H ILE 202 HN ILE 202 -5.450 7.516 9.057 712 HA ILE 202 HA ILE 202 -3.200 6.216 10.447 713 HB ILE 202 HB ILE 202 -5.090 4.974 8.438 714 HG12 ILE 202 HG12 ILE 202 -5.818 5.027 10.831 715 HG13 ILE 202 HG11 ILE 202 -5.639 3.404 10.173 716 HG21 ILE 202 HG21 ILE 202 -2.827 4.311 7.889 717 HG22 ILE 202 HG22 ILE 202 -3.698 2.951 8.597 718 HG23 ILE 202 HG23 ILE 202 -2.529 3.851 9.564 719 HD11 ILE 202 HD11 ILE 202 -3.502 3.164 11.297 720 HD12 ILE 202 HD12 ILE 202 -4.777 3.574 12.447 721 HD13 ILE 202 HD13 ILE 202 -3.632 4.809 11.923 722 H LYS 203 HN LYS 203 -1.434 7.169 9.631 723 HA LYS 203 HA LYS 203 -1.369 7.694 6.735 724 HB2 LYS 203 HB2 LYS 203 -1.337 9.758 8.029 725 HB3 LYS 203 HB1 LYS 203 0.025 9.172 8.972 726 HG2 LYS 203 HG2 LYS 203 1.436 9.203 7.006 727 HG3 LYS 203 HG1 LYS 203 0.078 9.709 6.012 728 HD2 LYS 203 HD2 LYS 203 1.478 11.616 6.558 729 HD3 LYS 203 HD1 LYS 203 -0.102 11.778 7.325 730 HE2 LYS 203 HE2 LYS 203 0.838 10.988 9.435 731 HE3 LYS 203 HE1 LYS 203 2.414 10.795 8.668 732 HZ1 LYS 203 HZ1 LYS 203 2.268 12.859 9.912 733 HZ2 LYS 203 HZ2 LYS 203 0.949 13.362 8.979 734 HZ3 LYS 203 HZ3 LYS 203 2.469 13.172 8.264 735 H LEU 204 HN LEU 204 0.092 6.634 5.588 736 HA LEU 204 HA LEU 204 2.266 5.260 7.019 737 HB2 LEU 204 HB2 LEU 204 0.451 4.219 5.262 738 HB3 LEU 204 HB1 LEU 204 1.780 4.601 4.188 739 HG LEU 204 HG LEU 204 1.820 2.709 6.537 740 HD11 LEU 204 HD11 LEU 204 2.406 2.226 3.628 741 HD12 LEU 204 HD12 LEU 204 0.848 1.920 4.392 742 HD13 LEU 204 HD13 LEU 204 2.275 1.023 4.910 743 HD21 LEU 204 HD21 LEU 204 4.164 3.358 4.770 744 HD22 LEU 204 HD22 LEU 204 4.135 2.342 6.210 745 HD23 LEU 204 HD23 LEU 204 3.922 4.085 6.356 746 H LYS 205 HN LYS 205 4.192 6.190 6.871 747 HA LYS 205 HA LYS 205 4.834 7.788 4.490 748 HB2 LYS 205 HB2 LYS 205 6.158 7.657 7.209 749 HB3 LYS 205 HB1 LYS 205 6.765 8.605 5.860 750 HG2 LYS 205 HG2 LYS 205 4.053 8.974 7.108 751 HG3 LYS 205 HG1 LYS 205 5.489 9.910 7.530 752 HD2 LYS 205 HD2 LYS 205 4.461 9.719 4.715 753 HD3 LYS 205 HD1 LYS 205 3.895 10.954 5.843 754 HE2 LYS 205 HE2 LYS 205 6.231 11.703 6.132 755 HE3 LYS 205 HE1 LYS 205 6.740 10.505 4.942 756 HZ1 LYS 205 HZ1 LYS 205 6.421 12.808 4.071 757 HZ2 LYS 205 HZ2 LYS 205 4.756 12.632 4.348 758 HZ3 LYS 205 HZ3 LYS 205 5.552 11.614 3.250 759 H ILE 206 HN ILE 206 5.073 5.744 3.282 760 HA ILE 206 HA ILE 206 6.985 3.816 4.078 761 HB ILE 206 HB ILE 206 6.475 4.211 1.157 762 HG12 ILE 206 HG12 ILE 206 4.517 2.830 2.990 763 HG13 ILE 206 HG11 ILE 206 4.211 4.397 2.237 764 HG21 ILE 206 HG21 ILE 206 6.178 1.578 2.331 765 HG22 ILE 206 HG22 ILE 206 7.714 2.349 2.774 766 HG23 ILE 206 HG23 ILE 206 7.293 2.150 1.074 767 HD11 ILE 206 HD11 ILE 206 4.854 2.891 0.077 768 HD12 ILE 206 HD12 ILE 206 3.210 3.107 0.678 769 HD13 ILE 206 HD13 ILE 206 4.127 1.676 1.128 770 H THR 207 HN THR 207 9.117 4.009 4.133 771 HA THR 207 HA THR 207 10.392 6.112 2.531 772 HB THR 207 HB THR 207 12.353 5.716 4.068 773 HG1 THR 207 HG1 THR 207 11.672 3.593 4.747 774 HG21 THR 207 HG21 THR 207 9.740 6.513 5.360 775 HG22 THR 207 HG22 THR 207 10.817 7.572 4.450 776 HG23 THR 207 HG23 THR 207 11.346 6.886 5.985 777 H LYS 208 HN LYS 208 11.068 5.353 0.608 778 HA LYS 208 HA LYS 208 13.028 3.354 0.462 779 HB2 LYS 208 HB2 LYS 208 11.976 1.542 -0.612 780 HB3 LYS 208 HB1 LYS 208 10.953 1.931 0.755 781 HG2 LYS 208 HG2 LYS 208 10.425 2.732 -2.098 782 HG3 LYS 208 HG1 LYS 208 9.676 1.382 -1.260 783 HD2 LYS 208 HD2 LYS 208 8.048 2.883 -0.842 784 HD3 LYS 208 HD1 LYS 208 9.134 3.421 0.443 785 HE2 LYS 208 HE2 LYS 208 10.138 5.025 -1.153 786 HE3 LYS 208 HE1 LYS 208 8.927 4.547 -2.340 787 HZ1 LYS 208 HZ1 LYS 208 8.378 5.780 0.302 788 HZ2 LYS 208 HZ2 LYS 208 7.209 5.314 -0.834 789 HZ3 LYS 208 HZ3 LYS 208 8.301 6.554 -1.206 790 H THR 209 HN THR 209 12.905 2.546 -2.135 791 HA THR 209 HA THR 209 13.597 3.163 -4.184 792 HB THR 209 HB THR 209 12.355 4.882 -5.424 793 HG1 THR 209 HG1 THR 209 11.877 5.885 -3.002 794 HG21 THR 209 HG21 THR 209 10.334 3.389 -3.800 795 HG22 THR 209 HG22 THR 209 11.426 2.541 -4.896 796 HG23 THR 209 HG23 THR 209 10.314 3.760 -5.523 797 H ILE 210 HN ILE 210 14.863 4.360 -1.773 798 HA ILE 210 HA ILE 210 15.711 6.979 -2.657 799 HB ILE 210 HB ILE 210 15.336 6.742 -0.298 800 HG12 ILE 210 HG12 ILE 210 17.581 7.382 0.610 801 HG13 ILE 210 HG11 ILE 210 18.278 6.952 -0.949 802 HG21 ILE 210 HG21 ILE 210 16.682 5.241 1.117 803 HG22 ILE 210 HG22 ILE 210 17.365 4.519 -0.341 804 HG23 ILE 210 HG23 ILE 210 15.638 4.377 -0.011 805 HD11 ILE 210 HD11 ILE 210 16.194 9.074 -0.491 806 HD12 ILE 210 HD12 ILE 210 16.947 8.664 -2.033 807 HD13 ILE 210 HD13 ILE 210 17.918 9.352 -0.732 808 H GLN 211 HN GLN 211 17.240 7.196 -4.103 809 HA GLN 211 HA GLN 211 18.974 5.025 -4.799 810 HB2 GLN 211 HB2 GLN 211 18.054 6.563 -6.496 811 HB3 GLN 211 HB1 GLN 211 18.963 7.886 -5.779 812 HG2 GLN 211 HG2 GLN 211 21.051 6.789 -6.340 813 HG3 GLN 211 HG1 GLN 211 20.169 5.413 -6.997 814 HE21 GLN 211 HE21 GLN 211 22.079 7.171 -8.285 815 HE22 GLN 211 HE22 GLN 211 21.260 7.852 -9.649 816 H ASN 212 HN ASN 212 20.565 4.534 -3.435 817 HA ASN 212 HA ASN 212 22.571 6.583 -2.942 818 HB2 ASN 212 HB2 ASN 212 22.840 6.005 -0.594 819 HB3 ASN 212 HB1 ASN 212 21.188 6.530 -0.886 820 HD21 ASN 212 HD21 ASN 212 19.519 4.988 -0.834 821 HD22 ASN 212 HD22 ASN 212 19.727 3.467 -0.044 Start of MODEL 17 1 H1 SER 1 HT1 SER 1 -14.732 -8.666 -12.406 2 H2 SER 1 HT2 SER 1 -14.406 -9.447 -13.869 3 H3 SER 1 HT3 SER 1 -15.576 -8.235 -13.805 4 HA SER 1 HA SER 1 -12.682 -7.874 -13.339 5 HB2 SER 1 HB2 SER 1 -14.396 -6.996 -15.676 6 HB3 SER 1 HB1 SER 1 -12.663 -6.722 -15.492 7 HG SER 1 HG SER 1 -13.319 -8.576 -16.825 8 H GLU 2 HN GLU 2 -15.880 -6.657 -12.934 9 HA GLU 2 HA GLU 2 -14.909 -3.922 -12.585 10 HB2 GLU 2 HB2 GLU 2 -17.751 -4.950 -12.639 11 HB3 GLU 2 HB1 GLU 2 -17.261 -3.265 -12.566 12 HG2 GLU 2 HG2 GLU 2 -16.166 -3.503 -14.751 13 HG3 GLU 2 HG1 GLU 2 -16.728 -5.171 -14.831 14 H GLU 3 HN GLU 3 -15.491 -6.634 -10.697 15 HA GLU 3 HA GLU 3 -16.795 -5.509 -8.455 16 HB2 GLU 3 HB2 GLU 3 -14.934 -7.880 -8.603 17 HB3 GLU 3 HB1 GLU 3 -15.920 -7.466 -7.211 18 HG2 GLU 3 HG2 GLU 3 -17.937 -7.765 -8.567 19 HG3 GLU 3 HG1 GLU 3 -16.929 -8.223 -9.939 20 H GLU 4 HN GLU 4 -13.542 -5.326 -9.556 21 HA GLU 4 HA GLU 4 -12.378 -4.725 -6.998 22 HB2 GLU 4 HB2 GLU 4 -10.378 -4.028 -8.305 23 HB3 GLU 4 HB1 GLU 4 -10.940 -5.645 -8.719 24 HG2 GLU 4 HG2 GLU 4 -11.984 -4.816 -10.728 25 HG3 GLU 4 HG1 GLU 4 -11.565 -3.158 -10.295 26 H ASP 5 HN ASP 5 -13.826 -2.871 -9.582 27 HA ASP 5 HA ASP 5 -13.111 -0.352 -8.316 28 HB2 ASP 5 HB2 ASP 5 -14.788 -0.937 -10.780 29 HB3 ASP 5 HB1 ASP 5 -14.464 0.683 -10.165 30 H LYS 6 HN LYS 6 -15.478 -2.725 -8.084 31 HA LYS 6 HA LYS 6 -17.408 -0.869 -6.867 32 HB2 LYS 6 HB2 LYS 6 -18.109 -2.400 -8.789 33 HB3 LYS 6 HB1 LYS 6 -17.924 -3.736 -7.666 34 HG2 LYS 6 HG2 LYS 6 -20.235 -3.137 -7.751 35 HG3 LYS 6 HG1 LYS 6 -19.606 -2.633 -6.181 36 HD2 LYS 6 HD2 LYS 6 -21.029 -0.900 -7.091 37 HD3 LYS 6 HD1 LYS 6 -19.360 -0.338 -7.044 38 HE2 LYS 6 HE2 LYS 6 -20.375 0.322 -9.131 39 HE3 LYS 6 HE1 LYS 6 -19.137 -0.890 -9.441 40 HZ1 LYS 6 HZ1 LYS 6 -20.893 -2.565 -9.593 41 HZ2 LYS 6 HZ2 LYS 6 -21.113 -1.335 -10.730 42 HZ3 LYS 6 HZ3 LYS 6 -22.066 -1.373 -9.336 43 H CYS 7 HN CYS 7 -14.988 -1.695 -5.632 44 HA CYS 7 HA CYS 7 -15.633 -3.799 -3.745 45 HB2 CYS 7 HB2 CYS 7 -13.327 -3.462 -4.759 46 HB3 CYS 7 HB1 CYS 7 -13.181 -2.035 -3.735 47 HG CYS 7 HG CYS 7 -13.194 -3.350 -1.348 48 H LYS 8 HN LYS 8 -15.879 -3.536 -1.546 49 HA LYS 8 HA LYS 8 -16.751 -0.895 -0.697 50 HB2 LYS 8 HB2 LYS 8 -17.084 -3.678 0.365 51 HB3 LYS 8 HB1 LYS 8 -17.328 -2.308 1.433 52 HG2 LYS 8 HG2 LYS 8 -19.438 -3.027 0.549 53 HG3 LYS 8 HG1 LYS 8 -19.038 -1.439 -0.096 54 HD2 LYS 8 HD2 LYS 8 -18.260 -2.509 -2.176 55 HD3 LYS 8 HD1 LYS 8 -18.724 -4.081 -1.521 56 HE2 LYS 8 HE2 LYS 8 -20.438 -3.223 -3.027 57 HE3 LYS 8 HE1 LYS 8 -21.048 -3.339 -1.377 58 HZ1 LYS 8 HZ1 LYS 8 -20.102 -0.854 -2.705 59 HZ2 LYS 8 HZ2 LYS 8 -20.678 -0.961 -1.118 60 HZ3 LYS 8 HZ3 LYS 8 -21.714 -1.270 -2.413 61 HA PRO 9 HA PRO 9 -13.125 0.093 1.613 62 HB2 PRO 9 HB2 PRO 9 -14.750 1.001 3.870 63 HB3 PRO 9 HB1 PRO 9 -13.680 1.921 2.809 64 HG2 PRO 9 HG2 PRO 9 -16.375 2.148 2.719 65 HG3 PRO 9 HG1 PRO 9 -15.340 2.374 1.299 66 HD2 PRO 9 HD2 PRO 9 -17.039 0.045 2.060 67 HD3 PRO 9 HD1 PRO 9 -16.678 0.705 0.453 68 H MET 10 HN MET 10 -11.793 -0.899 2.990 69 HA MET 10 HA MET 10 -12.818 -3.001 4.689 70 HB2 MET 10 HB2 MET 10 -10.420 -3.457 5.151 71 HB3 MET 10 HB1 MET 10 -10.811 -3.486 3.443 72 HG2 MET 10 HG2 MET 10 -9.890 -1.258 3.173 73 HG3 MET 10 HG1 MET 10 -9.504 -1.215 4.890 74 HE1 MET 10 HE1 MET 10 -8.863 -3.168 1.521 75 HE2 MET 10 HE2 MET 10 -9.199 -4.454 2.676 76 HE3 MET 10 HE3 MET 10 -7.578 -4.270 2.013 77 H SER 11 HN SER 11 -12.177 -3.115 6.970 78 HA SER 11 HA SER 11 -13.043 -0.699 8.225 79 HB2 SER 11 HB2 SER 11 -12.912 -2.059 10.318 80 HB3 SER 11 HB1 SER 11 -13.867 -2.812 9.042 81 HG SER 11 HG SER 11 -12.015 -4.086 8.528 82 H TYR 12 HN TYR 12 -11.924 -0.212 10.483 83 HA TYR 12 HA TYR 12 -9.517 1.121 9.891 84 HB2 TYR 12 HB2 TYR 12 -11.156 1.697 11.717 85 HB3 TYR 12 HB1 TYR 12 -10.503 0.350 12.650 86 HD1 TYR 12 HD1 TYR 12 -7.988 0.423 13.195 87 HD2 TYR 12 HD2 TYR 12 -10.176 3.804 11.847 88 HE1 TYR 12 HE1 TYR 12 -6.265 1.904 14.134 89 HE2 TYR 12 HE2 TYR 12 -8.458 5.297 12.774 90 HH TYR 12 HH TYR 12 -5.417 4.139 13.877 91 H GLU 13 HN GLU 13 -10.114 -1.972 11.520 92 HA GLU 13 HA GLU 13 -7.491 -2.527 12.332 93 HB2 GLU 13 HB2 GLU 13 -9.690 -3.765 12.875 94 HB3 GLU 13 HB1 GLU 13 -9.426 -4.632 11.372 95 HG2 GLU 13 HG2 GLU 13 -7.420 -4.566 13.613 96 HG3 GLU 13 HG1 GLU 13 -8.675 -5.792 13.470 97 H GLU 14 HN GLU 14 -9.197 -3.159 9.314 98 HA GLU 14 HA GLU 14 -7.118 -4.707 8.134 99 HB2 GLU 14 HB2 GLU 14 -9.547 -3.356 6.966 100 HB3 GLU 14 HB1 GLU 14 -8.460 -4.371 6.027 101 HG2 GLU 14 HG2 GLU 14 -9.033 -6.301 7.265 102 HG3 GLU 14 HG1 GLU 14 -9.853 -5.345 8.503 103 H LYS 15 HN LYS 15 -8.201 -1.342 7.691 104 HA LYS 15 HA LYS 15 -6.324 -0.532 5.812 105 HB2 LYS 15 HB2 LYS 15 -7.695 0.956 8.044 106 HB3 LYS 15 HB1 LYS 15 -6.614 1.753 6.914 107 HG2 LYS 15 HG2 LYS 15 -8.032 1.364 5.091 108 HG3 LYS 15 HG1 LYS 15 -8.967 0.162 5.989 109 HD2 LYS 15 HD2 LYS 15 -10.232 1.713 7.020 110 HD3 LYS 15 HD1 LYS 15 -8.894 2.848 7.199 111 HE2 LYS 15 HE2 LYS 15 -9.099 3.473 4.856 112 HE3 LYS 15 HE1 LYS 15 -10.402 2.301 4.638 113 HZ1 LYS 15 HZ1 LYS 15 -10.487 4.625 6.502 114 HZ2 LYS 15 HZ2 LYS 15 -11.756 3.548 6.171 115 HZ3 LYS 15 HZ3 LYS 15 -11.199 4.591 4.964 116 H ARG 16 HN ARG 16 -6.103 -0.594 9.336 117 HA ARG 16 HA ARG 16 -3.499 0.471 9.531 118 HB2 ARG 16 HB2 ARG 16 -5.014 0.368 11.447 119 HB3 ARG 16 HB1 ARG 16 -4.965 -1.393 11.410 120 HG2 ARG 16 HG2 ARG 16 -2.341 -0.864 11.617 121 HG3 ARG 16 HG1 ARG 16 -3.009 0.539 12.450 122 HD2 ARG 16 HD2 ARG 16 -2.566 -1.338 13.982 123 HD3 ARG 16 HD1 ARG 16 -4.267 -0.876 13.931 124 HE ARG 16 HE ARG 16 -4.586 -2.822 12.413 125 HH11 ARG 16 HH11 ARG 16 -1.845 -2.767 14.598 126 HH12 ARG 16 HH12 ARG 16 -1.755 -4.492 14.723 127 HH21 ARG 16 HH21 ARG 16 -4.482 -5.096 12.586 128 HH22 ARG 16 HH22 ARG 16 -3.244 -5.813 13.581 129 H GLN 17 HN GLN 17 -4.653 -2.888 9.385 130 HA GLN 17 HA GLN 17 -2.134 -4.099 9.600 131 HB2 GLN 17 HB2 GLN 17 -4.283 -5.289 9.892 132 HB3 GLN 17 HB1 GLN 17 -4.581 -5.123 8.168 133 HG2 GLN 17 HG2 GLN 17 -3.759 -7.336 8.679 134 HG3 GLN 17 HG1 GLN 17 -2.602 -6.444 7.691 135 HE21 GLN 17 HE21 GLN 17 -0.897 -7.716 8.326 136 HE22 GLN 17 HE22 GLN 17 -0.199 -7.608 9.903 137 H LEU 18 HN LEU 18 -3.781 -2.617 6.962 138 HA LEU 18 HA LEU 18 -2.170 -3.691 4.868 139 HB2 LEU 18 HB2 LEU 18 -4.485 -2.232 5.019 140 HB3 LEU 18 HB1 LEU 18 -3.345 -1.020 4.481 141 HG LEU 18 HG LEU 18 -3.797 -3.645 3.062 142 HD11 LEU 18 HD11 LEU 18 -4.926 -0.925 2.456 143 HD12 LEU 18 HD12 LEU 18 -5.832 -2.311 3.056 144 HD13 LEU 18 HD13 LEU 18 -5.097 -2.361 1.454 145 HD21 LEU 18 HD21 LEU 18 -1.670 -2.758 2.493 146 HD22 LEU 18 HD22 LEU 18 -2.316 -1.131 2.333 147 HD23 LEU 18 HD23 LEU 18 -2.759 -2.376 1.169 148 H SER 19 HN SER 19 -2.083 -0.721 6.789 149 HA SER 19 HA SER 19 0.229 0.384 5.655 150 HB2 SER 19 HB2 SER 19 -1.213 1.599 7.255 151 HB3 SER 19 HB1 SER 19 -0.709 0.505 8.540 152 HG SER 19 HG SER 19 1.489 1.274 8.054 153 H LEU 20 HN LEU 20 -0.253 -2.175 7.959 154 HA LEU 20 HA LEU 20 2.502 -2.423 8.689 155 HB2 LEU 20 HB2 LEU 20 0.111 -4.190 9.121 156 HB3 LEU 20 HB1 LEU 20 1.700 -4.559 9.742 157 HG LEU 20 HG LEU 20 0.135 -2.088 10.466 158 HD11 LEU 20 HD11 LEU 20 -0.708 -4.426 11.167 159 HD12 LEU 20 HD12 LEU 20 -0.572 -3.162 12.388 160 HD13 LEU 20 HD13 LEU 20 0.668 -4.412 12.267 161 HD21 LEU 20 HD21 LEU 20 2.659 -2.011 10.589 162 HD22 LEU 20 HD22 LEU 20 2.553 -3.276 11.811 163 HD23 LEU 20 HD23 LEU 20 1.808 -1.704 12.101 164 H ASP 21 HN ASP 21 0.370 -3.923 6.323 165 HA ASP 21 HA ASP 21 2.185 -6.071 5.811 166 HB2 ASP 21 HB2 ASP 21 0.634 -6.751 4.048 167 HB3 ASP 21 HB1 ASP 21 -0.183 -6.474 5.572 168 H ILE 22 HN ILE 22 1.567 -2.947 4.336 169 HA ILE 22 HA ILE 22 3.319 -3.377 2.116 170 HB ILE 22 HB ILE 22 2.332 -0.837 3.428 171 HG12 ILE 22 HG12 ILE 22 1.682 -1.834 0.671 172 HG13 ILE 22 HG11 ILE 22 0.822 -2.482 2.074 173 HG21 ILE 22 HG21 ILE 22 4.344 -0.150 2.474 174 HG22 ILE 22 HG22 ILE 22 3.111 0.252 1.279 175 HG23 ILE 22 HG23 ILE 22 4.123 -1.175 1.060 176 HD11 ILE 22 HD11 ILE 22 0.005 -0.342 2.617 177 HD12 ILE 22 HD12 ILE 22 -0.332 -0.628 0.915 178 HD13 ILE 22 HD13 ILE 22 0.994 0.437 1.390 179 H ASN 23 HN ASN 23 3.694 -2.203 5.392 180 HA ASN 23 HA ASN 23 6.331 -1.283 5.278 181 HB2 ASN 23 HB2 ASN 23 4.987 -0.783 7.185 182 HB3 ASN 23 HB1 ASN 23 4.685 -2.484 7.501 183 HD21 ASN 23 HD21 ASN 23 6.951 0.126 7.762 184 HD22 ASN 23 HD22 ASN 23 8.046 -0.653 8.845 185 H LYS 24 HN LYS 24 5.016 -4.489 5.272 186 HA LYS 24 HA LYS 24 7.362 -5.867 6.156 187 HB2 LYS 24 HB2 LYS 24 4.895 -6.759 4.674 188 HB3 LYS 24 HB1 LYS 24 6.183 -7.864 5.136 189 HG2 LYS 24 HG2 LYS 24 5.784 -7.397 7.473 190 HG3 LYS 24 HG1 LYS 24 4.571 -6.173 7.038 191 HD2 LYS 24 HD2 LYS 24 3.214 -7.912 5.972 192 HD3 LYS 24 HD1 LYS 24 4.413 -9.128 6.369 193 HE2 LYS 24 HE2 LYS 24 3.910 -9.031 8.668 194 HE3 LYS 24 HE1 LYS 24 3.008 -7.515 8.494 195 HZ1 LYS 24 HZ1 LYS 24 1.352 -8.751 7.210 196 HZ2 LYS 24 HZ2 LYS 24 1.530 -9.381 8.766 197 HZ3 LYS 24 HZ3 LYS 24 2.222 -10.181 7.448 198 H LEU 25 HN LEU 25 6.032 -4.945 3.039 199 HA LEU 25 HA LEU 25 7.503 -6.623 1.374 200 HB2 LEU 25 HB2 LEU 25 6.572 -3.829 0.792 201 HB3 LEU 25 HB1 LEU 25 7.026 -5.011 -0.403 202 HG LEU 25 HG LEU 25 4.589 -4.966 1.340 203 HD11 LEU 25 HD11 LEU 25 5.085 -5.104 -1.616 204 HD12 LEU 25 HD12 LEU 25 4.440 -3.735 -0.714 205 HD13 LEU 25 HD13 LEU 25 3.498 -5.219 -0.865 206 HD21 LEU 25 HD21 LEU 25 5.719 -7.244 -0.220 207 HD22 LEU 25 HD22 LEU 25 4.048 -7.172 0.318 208 HD23 LEU 25 HD23 LEU 25 5.359 -7.213 1.500 209 HA PRO 26 HA PRO 26 11.704 -4.978 1.628 210 HB2 PRO 26 HB2 PRO 26 11.844 -6.464 -0.948 211 HB3 PRO 26 HB1 PRO 26 12.912 -6.548 0.459 212 HG2 PRO 26 HG2 PRO 26 11.179 -8.503 -0.074 213 HG3 PRO 26 HG1 PRO 26 11.515 -8.004 1.594 214 HD2 PRO 26 HD2 PRO 26 9.141 -7.420 -0.123 215 HD3 PRO 26 HD1 PRO 26 9.229 -7.728 1.625 216 H GLY 27 HN GLY 27 12.868 -3.424 0.420 217 HA2 GLY 27 HA2 GLY 27 11.502 -1.316 -0.557 218 HA3 GLY 27 HA1 GLY 27 13.155 -1.654 -1.021 219 H GLU 28 HN GLU 28 12.835 -3.871 -2.647 220 HA GLU 28 HA GLU 28 12.137 -2.723 -5.097 221 HB2 GLU 28 HB2 GLU 28 13.646 -4.690 -4.756 222 HB3 GLU 28 HB1 GLU 28 12.222 -5.674 -4.448 223 HG2 GLU 28 HG2 GLU 28 13.054 -5.936 -6.729 224 HG3 GLU 28 HG1 GLU 28 11.418 -5.279 -6.689 225 H LYS 29 HN LYS 29 10.349 -5.130 -3.183 226 HA LYS 29 HA LYS 29 8.056 -5.175 -4.853 227 HB2 LYS 29 HB2 LYS 29 8.513 -5.987 -1.984 228 HB3 LYS 29 HB1 LYS 29 7.010 -6.284 -2.847 229 HG2 LYS 29 HG2 LYS 29 9.691 -7.324 -3.728 230 HG3 LYS 29 HG1 LYS 29 8.547 -8.234 -2.742 231 HD2 LYS 29 HD2 LYS 29 6.859 -7.895 -4.568 232 HD3 LYS 29 HD1 LYS 29 8.159 -7.250 -5.567 233 HE2 LYS 29 HE2 LYS 29 7.819 -9.577 -6.096 234 HE3 LYS 29 HE1 LYS 29 9.379 -9.385 -5.303 235 HZ1 LYS 29 HZ1 LYS 29 8.339 -10.109 -3.225 236 HZ2 LYS 29 HZ2 LYS 29 8.222 -11.290 -4.428 237 HZ3 LYS 29 HZ3 LYS 29 6.874 -10.348 -4.037 238 H LEU 30 HN LEU 30 9.034 -3.381 -2.063 239 HA LEU 30 HA LEU 30 6.605 -2.197 -1.307 240 HB2 LEU 30 HB2 LEU 30 8.595 -2.219 0.095 241 HB3 LEU 30 HB1 LEU 30 9.465 -1.240 -1.070 242 HG LEU 30 HG LEU 30 8.250 0.691 -0.517 243 HD11 LEU 30 HD11 LEU 30 6.415 -0.717 1.350 244 HD12 LEU 30 HD12 LEU 30 6.055 -0.734 -0.367 245 HD13 LEU 30 HD13 LEU 30 6.192 0.795 0.485 246 HD21 LEU 30 HD21 LEU 30 8.503 0.818 1.948 247 HD22 LEU 30 HD22 LEU 30 9.910 0.136 1.132 248 HD23 LEU 30 HD23 LEU 30 8.779 -0.923 1.972 249 H GLY 31 HN GLY 31 9.050 -1.160 -3.671 250 HA2 GLY 31 HA2 GLY 31 8.124 1.414 -4.159 251 HA3 GLY 31 HA1 GLY 31 8.931 0.412 -5.354 252 H ARG 32 HN ARG 32 6.714 -1.619 -5.197 253 HA ARG 32 HA ARG 32 5.082 -0.578 -7.253 254 HB2 ARG 32 HB2 ARG 32 5.424 -2.975 -7.051 255 HB3 ARG 32 HB1 ARG 32 4.659 -2.974 -5.472 256 HG2 ARG 32 HG2 ARG 32 3.145 -3.846 -7.173 257 HG3 ARG 32 HG1 ARG 32 2.530 -2.341 -6.496 258 HD2 ARG 32 HD2 ARG 32 2.249 -2.370 -8.921 259 HD3 ARG 32 HD1 ARG 32 3.368 -1.103 -8.423 260 HE ARG 32 HE ARG 32 4.662 -3.568 -9.154 261 HH11 ARG 32 HH11 ARG 32 3.345 -0.553 -10.338 262 HH12 ARG 32 HH12 ARG 32 4.353 -0.512 -11.748 263 HH21 ARG 32 HH21 ARG 32 5.988 -3.531 -11.023 264 HH22 ARG 32 HH22 ARG 32 5.856 -2.209 -12.139 265 H VAL 33 HN VAL 33 4.403 -1.140 -3.789 266 HA VAL 33 HA VAL 33 1.688 -0.324 -3.974 267 HB VAL 33 HB VAL 33 2.468 0.195 -1.330 268 HG11 VAL 33 HG11 VAL 33 1.002 -1.933 -2.820 269 HG12 VAL 33 HG12 VAL 33 0.434 -0.826 -1.569 270 HG13 VAL 33 HG13 VAL 33 1.408 -2.227 -1.133 271 HG21 VAL 33 HG21 VAL 33 3.837 -2.274 -2.397 272 HG22 VAL 33 HG22 VAL 33 3.640 -1.864 -0.698 273 HG23 VAL 33 HG23 VAL 33 4.623 -0.841 -1.742 274 H VAL 34 HN VAL 34 4.587 1.433 -2.855 275 HA VAL 34 HA VAL 34 3.395 3.878 -2.289 276 HB VAL 34 HB VAL 34 5.552 4.360 -1.880 277 HG11 VAL 34 HG11 VAL 34 6.028 1.997 -2.089 278 HG12 VAL 34 HG12 VAL 34 7.392 2.989 -2.602 279 HG13 VAL 34 HG13 VAL 34 6.359 2.215 -3.804 280 HG21 VAL 34 HG21 VAL 34 5.410 5.806 -3.848 281 HG22 VAL 34 HG22 VAL 34 5.913 4.468 -4.875 282 HG23 VAL 34 HG23 VAL 34 7.031 5.133 -3.686 283 H HIS 35 HN HIS 35 4.406 2.527 -5.369 284 HA HIS 35 HA HIS 35 3.720 4.771 -6.965 285 HB2 HIS 35 HB2 HIS 35 5.310 2.939 -7.613 286 HB3 HIS 35 HB1 HIS 35 3.915 1.897 -7.851 287 HD1 HIS 35 HD1 HIS 35 5.550 4.986 -9.269 288 HD2 HIS 35 HD2 HIS 35 2.619 2.215 -10.270 289 HE1 HIS 35 HE1 HIS 35 4.989 5.438 -11.675 290 HE2 HIS 35 HE2 HIS 35 3.331 3.649 -12.300 291 H ILE 36 HN ILE 36 2.003 1.781 -6.113 292 HA ILE 36 HA ILE 36 -0.227 2.064 -7.743 293 HB ILE 36 HB ILE 36 -0.192 0.913 -4.944 294 HG12 ILE 36 HG12 ILE 36 0.236 -0.311 -7.664 295 HG13 ILE 36 HG11 ILE 36 1.341 -0.304 -6.301 296 HG21 ILE 36 HG21 ILE 36 -2.409 0.789 -5.148 297 HG22 ILE 36 HG22 ILE 36 -2.152 -0.344 -6.474 298 HG23 ILE 36 HG23 ILE 36 -2.340 1.374 -6.811 299 HD11 ILE 36 HD11 ILE 36 -0.274 -1.747 -5.078 300 HD12 ILE 36 HD12 ILE 36 0.420 -2.488 -6.518 301 HD13 ILE 36 HD13 ILE 36 -1.220 -1.847 -6.560 302 H ILE 37 HN ILE 37 0.171 3.220 -4.384 303 HA ILE 37 HA ILE 37 -2.360 4.409 -4.214 304 HB ILE 37 HB ILE 37 0.133 5.301 -2.756 305 HG12 ILE 37 HG12 ILE 37 -1.669 3.879 -1.082 306 HG13 ILE 37 HG11 ILE 37 -1.434 2.905 -2.528 307 HG21 ILE 37 HG21 ILE 37 -2.049 6.736 -2.947 308 HG22 ILE 37 HG22 ILE 37 -1.209 6.576 -1.399 309 HG23 ILE 37 HG23 ILE 37 -2.647 5.606 -1.728 310 HD11 ILE 37 HD11 ILE 37 0.906 2.797 -2.172 311 HD12 ILE 37 HD12 ILE 37 0.115 2.411 -0.643 312 HD13 ILE 37 HD13 ILE 37 0.823 4.006 -0.893 313 H GLN 38 HN GLN 38 0.775 5.912 -4.966 314 HA GLN 38 HA GLN 38 -0.147 8.497 -5.419 315 HB2 GLN 38 HB2 GLN 38 2.179 7.001 -6.620 316 HB3 GLN 38 HB1 GLN 38 1.895 8.706 -6.943 317 HG2 GLN 38 HG2 GLN 38 1.839 8.694 -4.222 318 HG3 GLN 38 HG1 GLN 38 2.951 7.362 -4.544 319 HE21 GLN 38 HE21 GLN 38 4.632 8.612 -3.637 320 HE22 GLN 38 HE22 GLN 38 5.397 9.864 -4.549 321 H SER 39 HN SER 39 -0.208 5.704 -7.520 322 HA SER 39 HA SER 39 -0.838 7.197 -9.886 323 HB2 SER 39 HB2 SER 39 0.360 5.081 -10.053 324 HB3 SER 39 HB1 SER 39 -1.000 4.230 -9.319 325 HG SER 39 HG SER 39 -2.007 4.246 -11.172 326 H ARG 40 HN ARG 40 -2.704 5.652 -7.331 327 HA ARG 40 HA ARG 40 -5.132 5.822 -8.946 328 HB2 ARG 40 HB2 ARG 40 -4.834 4.849 -6.110 329 HB3 ARG 40 HB1 ARG 40 -6.233 4.634 -7.151 330 HG2 ARG 40 HG2 ARG 40 -4.524 3.384 -8.694 331 HG3 ARG 40 HG1 ARG 40 -3.599 3.238 -7.197 332 HD2 ARG 40 HD2 ARG 40 -4.943 1.281 -7.504 333 HD3 ARG 40 HD1 ARG 40 -5.514 2.201 -6.123 334 HE ARG 40 HE ARG 40 -7.238 3.090 -7.807 335 HH11 ARG 40 HH11 ARG 40 -5.885 -0.138 -7.852 336 HH12 ARG 40 HH12 ARG 40 -7.296 -0.851 -8.570 337 HH21 ARG 40 HH21 ARG 40 -9.085 2.151 -8.774 338 HH22 ARG 40 HH22 ARG 40 -9.105 0.450 -9.110 339 H GLU 41 HN GLU 41 -3.534 7.263 -6.227 340 HA GLU 41 HA GLU 41 -5.736 9.161 -5.882 341 HB2 GLU 41 HB2 GLU 41 -3.526 8.540 -3.975 342 HB3 GLU 41 HB1 GLU 41 -5.095 9.258 -3.639 343 HG2 GLU 41 HG2 GLU 41 -5.060 6.674 -4.931 344 HG3 GLU 41 HG1 GLU 41 -4.584 6.703 -3.273 345 HA PRO 42 HA PRO 42 -2.452 11.750 -7.854 346 HB2 PRO 42 HB2 PRO 42 -4.789 13.453 -8.434 347 HB3 PRO 42 HB1 PRO 42 -3.556 12.824 -9.529 348 HG2 PRO 42 HG2 PRO 42 -6.053 11.856 -9.543 349 HG3 PRO 42 HG1 PRO 42 -4.649 10.810 -9.822 350 HD2 PRO 42 HD2 PRO 42 -6.295 11.154 -7.345 351 HD3 PRO 42 HD1 PRO 42 -5.625 9.669 -8.059 352 H SER 43 HN SER 43 -4.744 12.313 -5.353 353 HA SER 43 HA SER 43 -4.133 15.034 -4.823 354 HB2 SER 43 HB2 SER 43 -5.242 12.942 -2.940 355 HB3 SER 43 HB1 SER 43 -5.337 14.691 -2.735 356 HG SER 43 HG SER 43 -6.975 13.073 -4.096 357 H LEU 44 HN LEU 44 -2.532 12.068 -4.087 358 HA LEU 44 HA LEU 44 -0.780 13.490 -2.201 359 HB2 LEU 44 HB2 LEU 44 -0.199 11.256 -1.278 360 HB3 LEU 44 HB1 LEU 44 -1.854 11.752 -1.008 361 HG LEU 44 HG LEU 44 -2.274 10.276 -3.188 362 HD11 LEU 44 HD11 LEU 44 0.137 9.798 -3.481 363 HD12 LEU 44 HD12 LEU 44 -0.839 8.349 -3.268 364 HD13 LEU 44 HD13 LEU 44 0.130 8.962 -1.929 365 HD21 LEU 44 HD21 LEU 44 -3.324 9.960 -1.013 366 HD22 LEU 44 HD22 LEU 44 -1.865 9.175 -0.409 367 HD23 LEU 44 HD23 LEU 44 -2.807 8.417 -1.691 368 H LYS 45 HN LYS 45 -0.799 12.901 -5.271 369 HA LYS 45 HA LYS 45 1.654 11.451 -5.631 370 HB2 LYS 45 HB2 LYS 45 1.414 11.821 -7.944 371 HB3 LYS 45 HB1 LYS 45 -0.227 11.648 -7.348 372 HG2 LYS 45 HG2 LYS 45 -0.442 14.104 -7.357 373 HG3 LYS 45 HG1 LYS 45 1.184 14.208 -8.045 374 HD2 LYS 45 HD2 LYS 45 0.270 12.605 -9.848 375 HD3 LYS 45 HD1 LYS 45 -1.317 13.122 -9.274 376 HE2 LYS 45 HE2 LYS 45 -0.738 15.439 -9.707 377 HE3 LYS 45 HE1 LYS 45 0.876 14.947 -10.216 378 HZ1 LYS 45 HZ1 LYS 45 -1.682 14.265 -11.556 379 HZ2 LYS 45 HZ2 LYS 45 -0.170 13.661 -12.012 380 HZ3 LYS 45 HZ3 LYS 45 -0.487 15.316 -12.132 381 H ASN 46 HN ASN 46 0.983 14.468 -4.495 382 HA ASN 46 HA ASN 46 3.261 15.836 -5.641 383 HB2 ASN 46 HB2 ASN 46 1.363 16.677 -3.438 384 HB3 ASN 46 HB1 ASN 46 2.586 17.707 -4.175 385 HD21 ASN 46 HD21 ASN 46 -0.283 18.072 -4.064 386 HD22 ASN 46 HD22 ASN 46 -0.824 18.171 -5.705 387 H SER 47 HN SER 47 2.897 13.518 -3.394 388 HA SER 47 HA SER 47 4.781 14.428 -1.424 389 HB2 SER 47 HB2 SER 47 3.808 11.610 -1.967 390 HB3 SER 47 HB1 SER 47 4.540 12.213 -0.480 391 HG SER 47 HG SER 47 1.953 12.381 -1.364 392 H ASN 48 HN ASN 48 6.963 13.938 -1.322 393 HA ASN 48 HA ASN 48 8.363 13.271 -3.687 394 HB2 ASN 48 HB2 ASN 48 9.325 13.090 -0.814 395 HB3 ASN 48 HB1 ASN 48 10.352 13.085 -2.241 396 HD21 ASN 48 HD21 ASN 48 10.374 14.878 0.009 397 HD22 ASN 48 HD22 ASN 48 10.122 16.468 -0.629 398 HA PRO 49 HA PRO 49 7.542 8.962 -3.766 399 HB2 PRO 49 HB2 PRO 49 9.687 8.147 -5.278 400 HB3 PRO 49 HB1 PRO 49 8.193 8.827 -5.926 401 HG2 PRO 49 HG2 PRO 49 10.830 10.151 -5.420 402 HG3 PRO 49 HG1 PRO 49 9.706 10.378 -6.774 403 HD2 PRO 49 HD2 PRO 49 9.887 12.147 -4.746 404 HD3 PRO 49 HD1 PRO 49 8.349 11.811 -5.567 405 H ASP 50 HN ASP 50 10.599 10.182 -2.611 406 HA ASP 50 HA ASP 50 11.520 7.673 -1.578 407 HB2 ASP 50 HB2 ASP 50 12.358 10.440 -0.711 408 HB3 ASP 50 HB1 ASP 50 13.248 8.950 -0.472 409 H GLU 51 HN GLU 51 9.449 10.209 -0.516 410 HA GLU 51 HA GLU 51 9.139 8.989 2.140 411 HB2 GLU 51 HB2 GLU 51 9.921 11.782 1.448 412 HB3 GLU 51 HB1 GLU 51 8.753 11.599 2.748 413 HG2 GLU 51 HG2 GLU 51 10.297 10.259 4.004 414 HG3 GLU 51 HG1 GLU 51 11.440 10.262 2.670 415 H ILE 52 HN ILE 52 7.340 8.210 0.533 416 HA ILE 52 HA ILE 52 5.478 10.144 -0.379 417 HB ILE 52 HB ILE 52 4.400 8.450 -1.458 418 HG12 ILE 52 HG12 ILE 52 5.129 6.280 0.417 419 HG13 ILE 52 HG11 ILE 52 3.852 7.404 0.892 420 HG21 ILE 52 HG21 ILE 52 6.875 6.909 -0.745 421 HG22 ILE 52 HG22 ILE 52 6.873 8.278 -1.861 422 HG23 ILE 52 HG23 ILE 52 5.937 6.833 -2.239 423 HD11 ILE 52 HD11 ILE 52 2.803 6.907 -1.353 424 HD12 ILE 52 HD12 ILE 52 2.756 5.622 -0.158 425 HD13 ILE 52 HD13 ILE 52 3.932 5.561 -1.470 426 H GLU 53 HN GLU 53 3.376 10.553 0.314 427 HA GLU 53 HA GLU 53 2.954 10.001 3.168 428 HB2 GLU 53 HB2 GLU 53 3.299 12.395 2.050 429 HB3 GLU 53 HB1 GLU 53 1.565 12.240 1.793 430 HG2 GLU 53 HG2 GLU 53 3.061 12.851 4.170 431 HG3 GLU 53 HG1 GLU 53 1.346 13.067 3.848 432 H ILE 54 HN ILE 54 1.362 8.573 3.527 433 HA ILE 54 HA ILE 54 -0.785 8.329 1.510 434 HB ILE 54 HB ILE 54 0.141 6.271 3.522 435 HG12 ILE 54 HG12 ILE 54 0.391 6.280 0.509 436 HG13 ILE 54 HG11 ILE 54 1.716 6.601 1.632 437 HG21 ILE 54 HG21 ILE 54 -1.368 4.776 2.185 438 HG22 ILE 54 HG22 ILE 54 -2.022 6.229 1.436 439 HG23 ILE 54 HG23 ILE 54 -2.185 5.983 3.175 440 HD11 ILE 54 HD11 ILE 54 1.768 4.315 0.787 441 HD12 ILE 54 HD12 ILE 54 0.151 4.039 1.437 442 HD13 ILE 54 HD13 ILE 54 1.497 4.351 2.528 443 H ASP 55 HN ASP 55 -2.858 8.689 2.111 444 HA ASP 55 HA ASP 55 -3.352 9.105 4.993 445 HB2 ASP 55 HB2 ASP 55 -3.658 11.129 3.522 446 HB3 ASP 55 HB1 ASP 55 -4.942 10.259 2.686 447 H PHE 56 HN PHE 56 -3.936 7.039 5.538 448 HA PHE 56 HA PHE 56 -5.169 5.283 3.725 449 HB2 PHE 56 HB2 PHE 56 -4.114 5.141 6.406 450 HB3 PHE 56 HB1 PHE 56 -5.584 4.178 6.245 451 HD1 PHE 56 HD2 PHE 56 -5.698 2.350 4.686 452 HD2 PHE 56 HD1 PHE 56 -2.108 4.555 5.188 453 HE1 PHE 56 HE2 PHE 56 -4.481 0.601 3.500 454 HE2 PHE 56 HE1 PHE 56 -0.868 2.798 3.986 455 HZ PHE 56 HZ PHE 56 -2.063 0.806 3.148 456 H GLU 57 HN GLU 57 -6.619 7.705 5.576 457 HA GLU 57 HA GLU 57 -9.143 6.319 5.775 458 HB2 GLU 57 HB2 GLU 57 -8.194 9.026 6.612 459 HB3 GLU 57 HB1 GLU 57 -9.900 8.601 6.655 460 HG2 GLU 57 HG2 GLU 57 -7.748 7.031 8.040 461 HG3 GLU 57 HG1 GLU 57 -8.688 8.307 8.810 462 H THR 58 HN THR 58 -7.549 8.257 3.510 463 HA THR 58 HA THR 58 -10.110 9.070 2.314 464 HB THR 58 HB THR 58 -8.833 10.800 1.099 465 HG1 THR 58 HG1 THR 58 -6.666 9.958 2.761 466 HG21 THR 58 HG21 THR 58 -8.551 10.739 4.100 467 HG22 THR 58 HG22 THR 58 -9.890 11.419 3.169 468 HG23 THR 58 HG23 THR 58 -8.299 12.182 3.114 469 H LEU 59 HN LEU 59 -7.547 6.903 1.886 470 HA LEU 59 HA LEU 59 -7.362 6.846 -0.934 471 HB2 LEU 59 HB2 LEU 59 -7.178 4.297 0.628 472 HB3 LEU 59 HB1 LEU 59 -6.268 4.813 -0.767 473 HG LEU 59 HG LEU 59 -5.888 5.770 2.060 474 HD11 LEU 59 HD11 LEU 59 -4.310 3.968 0.241 475 HD12 LEU 59 HD12 LEU 59 -4.954 3.630 1.847 476 HD13 LEU 59 HD13 LEU 59 -3.610 4.752 1.658 477 HD21 LEU 59 HD21 LEU 59 -4.707 6.727 -0.525 478 HD22 LEU 59 HD22 LEU 59 -3.848 6.895 0.997 479 HD23 LEU 59 HD23 LEU 59 -5.417 7.665 0.782 480 H LYS 60 HN LYS 60 -8.534 5.818 -2.454 481 HA LYS 60 HA LYS 60 -11.257 5.239 -2.009 482 HB2 LYS 60 HB2 LYS 60 -9.488 4.354 -4.299 483 HB3 LYS 60 HB1 LYS 60 -11.243 4.464 -4.329 484 HG2 LYS 60 HG2 LYS 60 -11.058 6.905 -4.022 485 HG3 LYS 60 HG1 LYS 60 -9.301 6.756 -4.082 486 HD2 LYS 60 HD2 LYS 60 -9.507 5.758 -6.340 487 HD3 LYS 60 HD1 LYS 60 -11.247 6.049 -6.277 488 HE2 LYS 60 HE2 LYS 60 -10.265 7.837 -7.508 489 HE3 LYS 60 HE1 LYS 60 -10.746 8.474 -5.937 490 HZ1 LYS 60 HZ1 LYS 60 -8.410 8.178 -5.208 491 HZ2 LYS 60 HZ2 LYS 60 -8.588 9.289 -6.471 492 HZ3 LYS 60 HZ3 LYS 60 -7.999 7.740 -6.795 493 HA PRO 61 HA PRO 61 -11.274 1.071 -0.496 494 HB2 PRO 61 HB2 PRO 61 -13.434 0.519 -2.441 495 HB3 PRO 61 HB1 PRO 61 -13.443 0.373 -0.684 496 HG2 PRO 61 HG2 PRO 61 -14.737 2.351 -1.990 497 HG3 PRO 61 HG1 PRO 61 -14.051 2.568 -0.374 498 HD2 PRO 61 HD2 PRO 61 -13.078 3.574 -2.995 499 HD3 PRO 61 HD1 PRO 61 -12.883 4.263 -1.370 500 H SER 62 HN SER 62 -11.459 1.618 -3.974 501 HA SER 62 HA SER 62 -10.580 -0.946 -4.796 502 HB2 SER 62 HB2 SER 62 -9.920 0.444 -6.902 503 HB3 SER 62 HB1 SER 62 -11.626 0.315 -6.468 504 HG SER 62 HG SER 62 -10.609 2.504 -6.927 505 H THR 63 HN THR 63 -8.906 2.050 -3.989 506 HA THR 63 HA THR 63 -6.307 1.226 -4.710 507 HB THR 63 HB THR 63 -6.830 3.099 -2.390 508 HG1 THR 63 HG1 THR 63 -7.284 4.736 -3.879 509 HG21 THR 63 HG21 THR 63 -4.505 2.500 -3.130 510 HG22 THR 63 HG22 THR 63 -4.872 4.219 -3.171 511 HG23 THR 63 HG23 THR 63 -4.853 3.284 -4.664 512 H LEU 64 HN LEU 64 -7.958 1.265 -1.550 513 HA LEU 64 HA LEU 64 -5.978 0.011 -0.046 514 HB2 LEU 64 HB2 LEU 64 -8.984 -0.116 0.212 515 HB3 LEU 64 HB1 LEU 64 -7.888 -0.783 1.406 516 HG LEU 64 HG LEU 64 -7.979 2.132 0.634 517 HD11 LEU 64 HD11 LEU 64 -10.052 1.445 1.760 518 HD12 LEU 64 HD12 LEU 64 -9.068 2.482 2.786 519 HD13 LEU 64 HD13 LEU 64 -9.098 0.743 3.064 520 HD21 LEU 64 HD21 LEU 64 -5.820 1.519 1.454 521 HD22 LEU 64 HD22 LEU 64 -6.534 0.619 2.787 522 HD23 LEU 64 HD23 LEU 64 -6.678 2.375 2.732 523 H ARG 65 HN ARG 65 -8.574 -1.401 -1.973 524 HA ARG 65 HA ARG 65 -8.060 -4.065 -1.160 525 HB2 ARG 65 HB2 ARG 65 -10.218 -3.196 -2.082 526 HB3 ARG 65 HB1 ARG 65 -9.457 -3.121 -3.664 527 HG2 ARG 65 HG2 ARG 65 -10.861 -5.122 -3.330 528 HG3 ARG 65 HG1 ARG 65 -9.184 -5.495 -3.715 529 HD2 ARG 65 HD2 ARG 65 -8.719 -5.961 -1.374 530 HD3 ARG 65 HD1 ARG 65 -10.344 -5.462 -0.927 531 HE ARG 65 HE ARG 65 -10.530 -7.528 -2.816 532 HH11 ARG 65 HH11 ARG 65 -9.488 -7.048 0.497 533 HH12 ARG 65 HH12 ARG 65 -9.961 -8.634 1.005 534 HH21 ARG 65 HH21 ARG 65 -11.158 -9.624 -2.136 535 HH22 ARG 65 HH22 ARG 65 -10.904 -10.096 -0.484 536 H GLU 66 HN GLU 66 -6.703 -2.015 -3.644 537 HA GLU 66 HA GLU 66 -5.462 -4.217 -5.032 538 HB2 GLU 66 HB2 GLU 66 -6.058 -2.313 -6.364 539 HB3 GLU 66 HB1 GLU 66 -5.168 -1.223 -5.303 540 HG2 GLU 66 HG2 GLU 66 -3.105 -1.950 -6.088 541 HG3 GLU 66 HG1 GLU 66 -3.768 -3.451 -6.731 542 H LEU 67 HN LEU 67 -4.594 -1.841 -2.624 543 HA LEU 67 HA LEU 67 -1.812 -2.317 -2.583 544 HB2 LEU 67 HB2 LEU 67 -3.644 -1.437 -0.338 545 HB3 LEU 67 HB1 LEU 67 -1.908 -1.221 -0.376 546 HG LEU 67 HG LEU 67 -3.897 0.099 -2.221 547 HD11 LEU 67 HD11 LEU 67 -2.202 1.279 -0.028 548 HD12 LEU 67 HD12 LEU 67 -3.928 0.946 0.090 549 HD13 LEU 67 HD13 LEU 67 -3.336 2.140 -1.064 550 HD21 LEU 67 HD21 LEU 67 -1.688 -0.432 -3.240 551 HD22 LEU 67 HD22 LEU 67 -0.937 0.585 -2.010 552 HD23 LEU 67 HD23 LEU 67 -2.071 1.284 -3.164 553 H GLU 68 HN GLU 68 -4.551 -3.565 -0.720 554 HA GLU 68 HA GLU 68 -3.031 -5.231 1.007 555 HB2 GLU 68 HB2 GLU 68 -5.297 -4.377 1.530 556 HB3 GLU 68 HB1 GLU 68 -5.965 -5.414 0.275 557 HG2 GLU 68 HG2 GLU 68 -4.671 -7.260 1.680 558 HG3 GLU 68 HG1 GLU 68 -4.940 -6.091 2.966 559 H ARG 69 HN ARG 69 -4.965 -5.932 -1.900 560 HA ARG 69 HA ARG 69 -4.658 -8.727 -1.816 561 HB2 ARG 69 HB2 ARG 69 -6.322 -7.473 -3.203 562 HB3 ARG 69 HB1 ARG 69 -5.016 -7.082 -4.315 563 HG2 ARG 69 HG2 ARG 69 -4.643 -9.631 -4.408 564 HG3 ARG 69 HG1 ARG 69 -6.273 -9.730 -3.737 565 HD2 ARG 69 HD2 ARG 69 -6.337 -9.865 -6.166 566 HD3 ARG 69 HD1 ARG 69 -7.128 -8.396 -5.593 567 HE ARG 69 HE ARG 69 -4.339 -8.119 -6.325 568 HH11 ARG 69 HH11 ARG 69 -7.672 -7.841 -7.366 569 HH12 ARG 69 HH12 ARG 69 -7.303 -6.743 -8.657 570 HH21 ARG 69 HH21 ARG 69 -3.858 -6.671 -8.002 571 HH22 ARG 69 HH22 ARG 69 -5.133 -6.060 -9.009 572 H TYR 70 HN TYR 70 -2.638 -6.211 -3.127 573 HA TYR 70 HA TYR 70 -0.967 -7.999 -4.615 574 HB2 TYR 70 HB2 TYR 70 -1.001 -5.826 -5.491 575 HB3 TYR 70 HB1 TYR 70 -0.797 -5.083 -3.907 576 HD1 TYR 70 HD2 TYR 70 0.966 -6.909 -6.609 577 HD2 TYR 70 HD1 TYR 70 1.328 -4.708 -2.996 578 HE1 TYR 70 HE2 TYR 70 3.396 -6.766 -6.954 579 HE2 TYR 70 HE1 TYR 70 3.770 -4.551 -3.326 580 HH TYR 70 HH TYR 70 5.534 -5.638 -4.494 581 H VAL 71 HN VAL 71 -0.603 -6.248 -1.529 582 HA VAL 71 HA VAL 71 2.023 -7.172 -1.050 583 HB VAL 71 HB VAL 71 1.678 -6.503 1.281 584 HG11 VAL 71 HG11 VAL 71 0.500 -4.161 0.375 585 HG12 VAL 71 HG12 VAL 71 1.332 -4.823 -1.026 586 HG13 VAL 71 HG13 VAL 71 2.220 -4.512 0.465 587 HG21 VAL 71 HG21 VAL 71 -0.459 -7.072 1.877 588 HG22 VAL 71 HG22 VAL 71 -1.169 -6.373 0.420 589 HG23 VAL 71 HG23 VAL 71 -0.578 -5.320 1.708 590 H THR 72 HN THR 72 -1.132 -8.393 0.025 591 HA THR 72 HA THR 72 -0.144 -10.423 1.673 592 HB THR 72 HB THR 72 -2.538 -9.539 1.529 593 HG1 THR 72 HG1 THR 72 -3.130 -11.302 2.621 594 HG21 THR 72 HG21 THR 72 -2.777 -10.004 -0.904 595 HG22 THR 72 HG22 THR 72 -4.073 -10.676 0.088 596 HG23 THR 72 HG23 THR 72 -2.795 -11.726 -0.529 597 H SER 73 HN SER 73 -0.516 -10.262 -1.785 598 HA SER 73 HA SER 73 -0.160 -13.013 -2.316 599 HB2 SER 73 HB2 SER 73 -0.008 -12.431 -4.557 600 HB3 SER 73 HB1 SER 73 -0.850 -11.024 -3.908 601 HG SER 73 HG SER 73 1.053 -9.875 -3.936 602 H CYS 74 HN CYS 74 1.985 -10.437 -1.476 603 HA CYS 74 HA CYS 74 4.383 -11.897 -2.206 604 HB2 CYS 74 HB2 CYS 74 4.286 -9.462 -2.560 605 HB3 CYS 74 HB1 CYS 74 4.047 -9.208 -0.831 606 HG CYS 74 HG CYS 74 6.558 -9.873 -0.056 607 H LEU 75 HN LEU 75 2.882 -10.642 0.777 608 HA LEU 75 HA LEU 75 4.675 -11.689 2.629 609 HB2 LEU 75 HB2 LEU 75 1.754 -11.668 3.233 610 HB3 LEU 75 HB1 LEU 75 3.100 -11.212 4.252 611 HG LEU 75 HG LEU 75 2.213 -9.582 1.895 612 HD11 LEU 75 HD11 LEU 75 1.615 -8.965 4.762 613 HD12 LEU 75 HD12 LEU 75 0.511 -9.926 3.778 614 HD13 LEU 75 HD13 LEU 75 0.905 -8.282 3.297 615 HD21 LEU 75 HD21 LEU 75 4.527 -9.314 2.681 616 HD22 LEU 75 HD22 LEU 75 3.913 -8.896 4.278 617 HD23 LEU 75 HD23 LEU 75 3.554 -7.862 2.894 618 H ARG 76 HN ARG 76 2.079 -13.249 0.884 619 HA ARG 76 HA ARG 76 2.223 -15.662 2.486 620 HB2 ARG 76 HB2 ARG 76 0.600 -14.844 0.089 621 HB3 ARG 76 HB1 ARG 76 0.576 -16.493 0.706 622 HG2 ARG 76 HG2 ARG 76 -0.338 -15.775 2.783 623 HG3 ARG 76 HG1 ARG 76 -0.081 -14.079 2.372 624 HD2 ARG 76 HD2 ARG 76 -1.676 -14.307 0.519 625 HD3 ARG 76 HD1 ARG 76 -1.950 -15.987 0.974 626 HE ARG 76 HE ARG 76 -2.488 -14.558 3.244 627 HH11 ARG 76 HH11 ARG 76 -3.672 -14.481 -0.050 628 HH12 ARG 76 HH12 ARG 76 -5.261 -13.955 0.400 629 HH21 ARG 76 HH21 ARG 76 -4.566 -13.825 3.835 630 HH22 ARG 76 HH22 ARG 76 -5.769 -13.576 2.613 631 H LYS 77 HN LYS 77 4.279 -14.437 0.427 632 HA LYS 77 HA LYS 77 5.088 -17.063 -0.613 633 HB2 LYS 77 HB2 LYS 77 5.014 -14.420 -2.027 634 HB3 LYS 77 HB1 LYS 77 6.168 -15.658 -2.507 635 HG2 LYS 77 HG2 LYS 77 4.423 -17.181 -3.046 636 HG3 LYS 77 HG1 LYS 77 3.208 -16.114 -2.344 637 HD2 LYS 77 HD2 LYS 77 3.719 -14.430 -4.061 638 HD3 LYS 77 HD1 LYS 77 4.918 -15.518 -4.761 639 HE2 LYS 77 HE2 LYS 77 1.963 -16.064 -4.520 640 HE3 LYS 77 HE1 LYS 77 2.802 -15.579 -5.992 641 HZ1 LYS 77 HZ1 LYS 77 3.327 -18.074 -4.470 642 HZ2 LYS 77 HZ2 LYS 77 4.071 -17.619 -5.916 643 HZ3 LYS 77 HZ3 LYS 77 2.415 -17.971 -5.891 644 H LYS 78 HN LYS 78 7.557 -16.485 -1.556 645 HA LYS 78 HA LYS 78 8.974 -15.700 0.849 646 HB2 LYS 78 HB2 LYS 78 9.833 -17.023 -1.706 647 HB3 LYS 78 HB1 LYS 78 11.018 -16.338 -0.601 648 HG2 LYS 78 HG2 LYS 78 10.779 -18.707 -0.204 649 HG3 LYS 78 HG1 LYS 78 10.175 -17.802 1.183 650 HD2 LYS 78 HD2 LYS 78 7.884 -18.092 0.347 651 HD3 LYS 78 HD1 LYS 78 8.508 -19.043 -1.004 652 HE2 LYS 78 HE2 LYS 78 9.411 -20.679 0.574 653 HE3 LYS 78 HE1 LYS 78 8.787 -19.731 1.920 654 HZ1 LYS 78 HZ1 LYS 78 7.333 -21.583 1.359 655 HZ2 LYS 78 HZ2 LYS 78 7.138 -20.978 -0.209 656 HZ3 LYS 78 HZ3 LYS 78 6.551 -20.101 1.113 657 H ARG 79 HN ARG 79 10.025 -13.842 1.105 658 HA ARG 79 HA ARG 79 10.091 -12.021 -1.179 659 HB2 ARG 79 HB2 ARG 79 10.664 -10.319 0.730 660 HB3 ARG 79 HB1 ARG 79 9.008 -10.828 0.454 661 HG2 ARG 79 HG2 ARG 79 9.128 -10.992 2.725 662 HG3 ARG 79 HG1 ARG 79 9.591 -12.631 2.272 663 HD2 ARG 79 HD2 ARG 79 11.967 -11.938 2.429 664 HD3 ARG 79 HD1 ARG 79 11.427 -10.367 3.021 665 HE ARG 79 HE ARG 79 10.255 -12.231 4.675 666 HH11 ARG 79 HH11 ARG 79 13.497 -11.271 3.784 667 HH12 ARG 79 HH12 ARG 79 14.196 -11.782 5.287 668 HH21 ARG 79 HH21 ARG 79 11.171 -12.894 6.661 669 HH22 ARG 79 HH22 ARG 79 12.876 -12.704 6.924 670 H LYS 80 HN LYS 80 11.858 -12.714 -2.251 671 HA LYS 80 HA LYS 80 14.422 -12.543 -0.813 672 HB2 LYS 80 HB2 LYS 80 13.677 -14.419 -3.059 673 HB3 LYS 80 HB1 LYS 80 15.290 -14.247 -2.388 674 HG2 LYS 80 HG2 LYS 80 14.447 -15.010 -0.209 675 HG3 LYS 80 HG1 LYS 80 12.848 -15.224 -0.922 676 HD2 LYS 80 HD2 LYS 80 13.989 -17.353 -0.852 677 HD3 LYS 80 HD1 LYS 80 13.821 -16.835 -2.528 678 HE2 LYS 80 HE2 LYS 80 16.146 -15.969 -2.437 679 HE3 LYS 80 HE1 LYS 80 16.291 -16.630 -0.811 680 HZ1 LYS 80 HZ1 LYS 80 15.909 -18.835 -1.712 681 HZ2 LYS 80 HZ2 LYS 80 17.238 -18.111 -2.466 682 HZ3 LYS 80 HZ3 LYS 80 15.752 -18.200 -3.270 683 HA PRO 81 HA PRO 81 14.653 -9.599 -4.372 684 HB2 PRO 81 HB2 PRO 81 15.378 -7.417 -2.966 685 HB3 PRO 81 HB1 PRO 81 13.683 -7.876 -3.169 686 HG2 PRO 81 HG2 PRO 81 15.490 -8.302 -0.832 687 HG3 PRO 81 HG1 PRO 81 13.784 -7.824 -0.854 688 HD2 PRO 81 HD2 PRO 81 14.663 -10.382 -0.363 689 HD3 PRO 81 HD1 PRO 81 13.058 -9.998 -1.020 690 H GLN 82 HN GLN 82 16.548 -9.624 -5.445 691 HA GLN 82 HA GLN 82 18.915 -10.537 -4.036 692 HB2 GLN 82 HB2 GLN 82 18.128 -11.335 -6.338 693 HB3 GLN 82 HB1 GLN 82 18.730 -9.805 -6.957 694 HG2 GLN 82 HG2 GLN 82 20.392 -11.469 -7.314 695 HG3 GLN 82 HG1 GLN 82 20.967 -10.379 -6.056 696 HE21 GLN 82 HE21 GLN 82 22.398 -11.919 -5.259 697 HE22 GLN 82 HE22 GLN 82 21.866 -13.300 -4.363 698 H ALA 83 HN ALA 83 18.461 -8.238 -2.930 699 HA ALA 83 HA ALA 83 20.193 -6.266 -4.261 700 HB1 ALA 83 HB1 ALA 83 17.920 -5.453 -3.890 701 HB2 ALA 83 HB2 ALA 83 19.077 -4.565 -2.898 702 HB3 ALA 83 HB3 ALA 83 18.065 -5.810 -2.168 703 H1 GLU 201 HT1 GLU 201 -6.815 10.557 12.478 704 H2 GLU 201 HT2 GLU 201 -5.160 10.371 12.776 705 H3 GLU 201 HT3 GLU 201 -6.185 9.028 12.834 706 HA GLU 201 HA GLU 201 -6.623 9.158 10.514 707 HB2 GLU 201 HB2 GLU 201 -5.411 10.803 9.114 708 HB3 GLU 201 HB1 GLU 201 -6.542 11.562 10.223 709 HG2 GLU 201 HG2 GLU 201 -4.693 12.134 11.715 710 HG3 GLU 201 HG1 GLU 201 -3.561 11.371 10.599 711 H ILE 202 HN ILE 202 -5.517 7.655 9.410 712 HA ILE 202 HA ILE 202 -2.943 6.849 10.515 713 HB ILE 202 HB ILE 202 -4.800 5.434 8.597 714 HG12 ILE 202 HG12 ILE 202 -4.193 5.061 11.534 715 HG13 ILE 202 HG11 ILE 202 -5.731 5.517 10.813 716 HG21 ILE 202 HG21 ILE 202 -2.569 4.748 8.088 717 HG22 ILE 202 HG22 ILE 202 -3.342 3.455 9.005 718 HG23 ILE 202 HG23 ILE 202 -2.190 4.530 9.797 719 HD11 ILE 202 HD11 ILE 202 -4.369 2.851 10.782 720 HD12 ILE 202 HD12 ILE 202 -5.677 3.249 9.666 721 HD13 ILE 202 HD13 ILE 202 -5.965 3.272 11.406 722 H LYS 203 HN LYS 203 -1.146 7.545 9.612 723 HA LYS 203 HA LYS 203 -1.104 8.083 6.712 724 HB2 LYS 203 HB2 LYS 203 0.755 9.180 8.829 725 HB3 LYS 203 HB1 LYS 203 0.717 9.633 7.133 726 HG2 LYS 203 HG2 LYS 203 -1.500 10.607 7.438 727 HG3 LYS 203 HG1 LYS 203 -1.461 10.151 9.144 728 HD2 LYS 203 HD2 LYS 203 0.558 11.541 9.434 729 HD3 LYS 203 HD1 LYS 203 0.430 12.040 7.747 730 HE2 LYS 203 HE2 LYS 203 -1.808 12.965 8.234 731 HE3 LYS 203 HE1 LYS 203 -1.587 12.541 9.929 732 HZ1 LYS 203 HZ1 LYS 203 0.356 14.002 9.973 733 HZ2 LYS 203 HZ2 LYS 203 -1.055 14.842 9.574 734 HZ3 LYS 203 HZ3 LYS 203 0.062 14.450 8.368 735 H LEU 204 HN LEU 204 0.795 7.425 5.541 736 HA LEU 204 HA LEU 204 2.621 5.649 6.999 737 HB2 LEU 204 HB2 LEU 204 0.697 4.607 5.366 738 HB3 LEU 204 HB1 LEU 204 2.030 4.808 4.245 739 HG LEU 204 HG LEU 204 2.005 3.135 6.757 740 HD11 LEU 204 HD11 LEU 204 2.483 2.322 3.901 741 HD12 LEU 204 HD12 LEU 204 0.918 2.228 4.706 742 HD13 LEU 204 HD13 LEU 204 2.273 1.272 5.303 743 HD21 LEU 204 HD21 LEU 204 4.332 3.394 4.873 744 HD22 LEU 204 HD22 LEU 204 4.276 2.612 6.452 745 HD23 LEU 204 HD23 LEU 204 4.187 4.369 6.335 746 H LYS 205 HN LYS 205 4.352 6.973 6.912 747 HA LYS 205 HA LYS 205 5.230 8.168 4.434 748 HB2 LYS 205 HB2 LYS 205 6.538 7.914 7.150 749 HB3 LYS 205 HB1 LYS 205 7.293 8.716 5.783 750 HG2 LYS 205 HG2 LYS 205 4.653 9.763 6.225 751 HG3 LYS 205 HG1 LYS 205 5.614 9.829 7.700 752 HD2 LYS 205 HD2 LYS 205 5.860 11.869 6.381 753 HD3 LYS 205 HD1 LYS 205 7.390 11.001 6.525 754 HE2 LYS 205 HE2 LYS 205 7.245 11.690 4.284 755 HE3 LYS 205 HE1 LYS 205 6.827 9.978 4.274 756 HZ1 LYS 205 HZ1 LYS 205 4.460 10.664 4.327 757 HZ2 LYS 205 HZ2 LYS 205 5.282 11.143 2.922 758 HZ3 LYS 205 HZ3 LYS 205 4.962 12.273 4.136 759 H ILE 206 HN ILE 206 5.229 6.060 3.246 760 HA ILE 206 HA ILE 206 7.034 4.012 4.035 761 HB ILE 206 HB ILE 206 6.426 4.388 1.121 762 HG12 ILE 206 HG12 ILE 206 4.508 2.911 2.899 763 HG13 ILE 206 HG11 ILE 206 4.248 4.621 2.530 764 HG21 ILE 206 HG21 ILE 206 6.074 1.774 2.309 765 HG22 ILE 206 HG22 ILE 206 7.642 2.482 2.740 766 HG23 ILE 206 HG23 ILE 206 7.196 2.306 1.045 767 HD11 ILE 206 HD11 ILE 206 4.722 2.692 0.303 768 HD12 ILE 206 HD12 ILE 206 3.805 4.193 0.321 769 HD13 ILE 206 HD13 ILE 206 3.143 2.752 1.086 770 H THR 207 HN THR 207 9.152 4.385 4.243 771 HA THR 207 HA THR 207 10.471 6.234 2.412 772 HB THR 207 HB THR 207 12.464 5.818 3.956 773 HG1 THR 207 HG1 THR 207 12.083 4.782 5.857 774 HG21 THR 207 HG21 THR 207 11.569 7.315 5.700 775 HG22 THR 207 HG22 THR 207 9.941 7.031 5.087 776 HG23 THR 207 HG23 THR 207 11.134 7.850 4.078 777 H LYS 208 HN LYS 208 11.541 5.560 0.708 778 HA LYS 208 HA LYS 208 13.213 3.395 0.458 779 HB2 LYS 208 HB2 LYS 208 12.018 1.629 -0.519 780 HB3 LYS 208 HB1 LYS 208 11.003 2.130 0.821 781 HG2 LYS 208 HG2 LYS 208 10.542 3.182 -1.936 782 HG3 LYS 208 HG1 LYS 208 9.917 1.611 -1.451 783 HD2 LYS 208 HD2 LYS 208 8.161 2.621 -0.550 784 HD3 LYS 208 HD1 LYS 208 9.226 3.457 0.577 785 HE2 LYS 208 HE2 LYS 208 8.722 4.450 -2.209 786 HE3 LYS 208 HE1 LYS 208 7.692 4.887 -0.848 787 HZ1 LYS 208 HZ1 LYS 208 9.456 6.510 -1.337 788 HZ2 LYS 208 HZ2 LYS 208 10.616 5.348 -0.940 789 HZ3 LYS 208 HZ3 LYS 208 9.530 5.899 0.242 790 H THR 209 HN THR 209 12.908 2.612 -2.145 791 HA THR 209 HA THR 209 13.296 3.148 -4.280 792 HB THR 209 HB THR 209 12.075 4.981 -5.378 793 HG1 THR 209 HG1 THR 209 12.029 6.083 -3.019 794 HG21 THR 209 HG21 THR 209 10.077 3.712 -3.579 795 HG22 THR 209 HG22 THR 209 11.050 2.689 -4.635 796 HG23 THR 209 HG23 THR 209 10.027 3.949 -5.325 797 H ILE 210 HN ILE 210 14.166 4.783 -5.807 798 HA ILE 210 HA ILE 210 15.927 6.041 -6.454 799 HB ILE 210 HB ILE 210 15.303 7.779 -4.068 800 HG12 ILE 210 HG12 ILE 210 13.224 7.297 -5.295 801 HG13 ILE 210 HG11 ILE 210 13.712 8.974 -5.510 802 HG21 ILE 210 HG21 ILE 210 16.094 9.582 -5.567 803 HG22 ILE 210 HG22 ILE 210 16.510 8.362 -6.770 804 HG23 ILE 210 HG23 ILE 210 17.340 8.384 -5.215 805 HD11 ILE 210 HD11 ILE 210 14.116 6.748 -7.494 806 HD12 ILE 210 HD12 ILE 210 14.603 8.428 -7.713 807 HD13 ILE 210 HD13 ILE 210 12.893 8.015 -7.582 808 H GLN 211 HN GLN 211 17.295 4.233 -5.831 809 HA GLN 211 HA GLN 211 18.764 4.335 -3.381 810 HB2 GLN 211 HB2 GLN 211 19.407 2.868 -5.947 811 HB3 GLN 211 HB1 GLN 211 20.153 2.581 -4.383 812 HG2 GLN 211 HG2 GLN 211 17.254 2.132 -5.063 813 HG3 GLN 211 HG1 GLN 211 18.489 0.885 -4.917 814 HE21 GLN 211 HE21 GLN 211 19.312 0.388 -2.871 815 HE22 GLN 211 HE22 GLN 211 18.460 0.799 -1.423 816 H ASN 212 HN ASN 212 20.408 5.644 -2.931 817 HA ASN 212 HA ASN 212 21.545 7.203 -5.107 818 HB2 ASN 212 HB2 ASN 212 22.593 8.528 -3.156 819 HB3 ASN 212 HB1 ASN 212 20.868 8.675 -3.439 820 HD21 ASN 212 HD21 ASN 212 22.571 6.030 -1.821 821 HD22 ASN 212 HD22 ASN 212 21.833 6.284 -0.271 Start of MODEL 18 1 H1 SER 1 HT1 SER 1 -14.151 -9.150 -12.770 2 H2 SER 1 HT2 SER 1 -15.631 -8.585 -12.193 3 H3 SER 1 HT3 SER 1 -14.192 -8.033 -11.494 4 HA SER 1 HA SER 1 -13.576 -7.080 -13.676 5 HB2 SER 1 HB2 SER 1 -16.493 -7.602 -14.288 6 HB3 SER 1 HB1 SER 1 -15.322 -6.807 -15.338 7 HG SER 1 HG SER 1 -15.689 -9.501 -14.796 8 H GLU 2 HN GLU 2 -16.776 -6.771 -12.083 9 HA GLU 2 HA GLU 2 -16.301 -3.887 -11.879 10 HB2 GLU 2 HB2 GLU 2 -18.826 -5.440 -11.280 11 HB3 GLU 2 HB1 GLU 2 -18.655 -3.694 -11.257 12 HG2 GLU 2 HG2 GLU 2 -18.087 -3.779 -13.678 13 HG3 GLU 2 HG1 GLU 2 -18.467 -5.502 -13.651 14 H GLU 3 HN GLU 3 -16.644 -6.756 -9.889 15 HA GLU 3 HA GLU 3 -17.471 -5.404 -7.545 16 HB2 GLU 3 HB2 GLU 3 -16.264 -8.151 -7.849 17 HB3 GLU 3 HB1 GLU 3 -17.026 -7.540 -6.388 18 HG2 GLU 3 HG2 GLU 3 -19.125 -7.230 -7.742 19 HG3 GLU 3 HG1 GLU 3 -18.321 -8.109 -9.039 20 H GLU 4 HN GLU 4 -14.290 -6.081 -8.826 21 HA GLU 4 HA GLU 4 -13.001 -5.507 -6.305 22 HB2 GLU 4 HB2 GLU 4 -10.886 -5.341 -7.770 23 HB3 GLU 4 HB1 GLU 4 -11.680 -6.906 -7.659 24 HG2 GLU 4 HG2 GLU 4 -12.326 -5.060 -9.915 25 HG3 GLU 4 HG1 GLU 4 -10.866 -6.050 -9.950 26 H ASP 5 HN ASP 5 -14.092 -3.644 -9.032 27 HA ASP 5 HA ASP 5 -12.668 -1.280 -8.098 28 HB2 ASP 5 HB2 ASP 5 -14.614 -1.650 -10.396 29 HB3 ASP 5 HB1 ASP 5 -13.872 -0.108 -9.971 30 H LYS 6 HN LYS 6 -15.574 -2.900 -7.505 31 HA LYS 6 HA LYS 6 -16.736 -0.488 -6.281 32 HB2 LYS 6 HB2 LYS 6 -18.029 -1.557 -8.186 33 HB3 LYS 6 HB1 LYS 6 -18.258 -2.955 -7.147 34 HG2 LYS 6 HG2 LYS 6 -20.224 -1.571 -7.068 35 HG3 LYS 6 HG1 LYS 6 -19.407 -1.481 -5.504 36 HD2 LYS 6 HD2 LYS 6 -18.395 0.654 -6.167 37 HD3 LYS 6 HD1 LYS 6 -19.224 0.565 -7.721 38 HE2 LYS 6 HE2 LYS 6 -21.378 0.616 -6.583 39 HE3 LYS 6 HE1 LYS 6 -20.564 0.671 -5.021 40 HZ1 LYS 6 HZ1 LYS 6 -21.286 2.863 -5.713 41 HZ2 LYS 6 HZ2 LYS 6 -20.384 2.746 -7.136 42 HZ3 LYS 6 HZ3 LYS 6 -19.599 2.798 -5.642 43 H CYS 7 HN CYS 7 -14.726 -2.149 -5.211 44 HA CYS 7 HA CYS 7 -15.796 -4.052 -3.384 45 HB2 CYS 7 HB2 CYS 7 -13.402 -3.935 -4.287 46 HB3 CYS 7 HB1 CYS 7 -13.138 -2.649 -3.113 47 HG CYS 7 HG CYS 7 -14.440 -5.448 -1.806 48 H LYS 8 HN LYS 8 -16.020 -3.882 -1.164 49 HA LYS 8 HA LYS 8 -16.969 -1.310 -0.281 50 HB2 LYS 8 HB2 LYS 8 -17.012 -4.100 0.831 51 HB3 LYS 8 HB1 LYS 8 -17.412 -2.734 1.859 52 HG2 LYS 8 HG2 LYS 8 -19.395 -3.821 0.898 53 HG3 LYS 8 HG1 LYS 8 -19.250 -2.129 0.427 54 HD2 LYS 8 HD2 LYS 8 -18.312 -2.823 -1.734 55 HD3 LYS 8 HD1 LYS 8 -18.478 -4.512 -1.258 56 HE2 LYS 8 HE2 LYS 8 -20.830 -4.388 -1.270 57 HE3 LYS 8 HE1 LYS 8 -20.814 -2.627 -1.334 58 HZ1 LYS 8 HZ1 LYS 8 -21.355 -3.590 -3.479 59 HZ2 LYS 8 HZ2 LYS 8 -19.893 -4.437 -3.504 60 HZ3 LYS 8 HZ3 LYS 8 -19.890 -2.747 -3.558 61 HA PRO 9 HA PRO 9 -13.380 0.063 1.892 62 HB2 PRO 9 HB2 PRO 9 -15.126 0.840 4.125 63 HB3 PRO 9 HB1 PRO 9 -14.064 1.833 3.120 64 HG2 PRO 9 HG2 PRO 9 -16.750 1.929 2.886 65 HG3 PRO 9 HG1 PRO 9 -15.663 2.170 1.506 66 HD2 PRO 9 HD2 PRO 9 -17.305 -0.205 2.236 67 HD3 PRO 9 HD1 PRO 9 -16.874 0.427 0.634 68 H MET 10 HN MET 10 -11.970 -0.993 3.123 69 HA MET 10 HA MET 10 -12.842 -3.147 4.807 70 HB2 MET 10 HB2 MET 10 -10.449 -3.516 5.218 71 HB3 MET 10 HB1 MET 10 -10.808 -3.400 3.505 72 HG2 MET 10 HG2 MET 10 -10.001 -1.111 3.477 73 HG3 MET 10 HG1 MET 10 -9.654 -1.220 5.199 74 HE1 MET 10 HE1 MET 10 -8.884 -2.761 1.688 75 HE2 MET 10 HE2 MET 10 -9.090 -4.211 2.670 76 HE3 MET 10 HE3 MET 10 -7.500 -3.796 2.035 77 H SER 11 HN SER 11 -12.275 -3.337 7.029 78 HA SER 11 HA SER 11 -13.201 -1.095 8.483 79 HB2 SER 11 HB2 SER 11 -12.834 -2.593 10.468 80 HB3 SER 11 HB1 SER 11 -13.831 -3.290 9.194 81 HG SER 11 HG SER 11 -11.944 -4.401 8.450 82 H TYR 12 HN TYR 12 -12.065 -0.602 10.697 83 HA TYR 12 HA TYR 12 -9.789 0.950 10.115 84 HB2 TYR 12 HB2 TYR 12 -11.478 1.267 11.997 85 HB3 TYR 12 HB1 TYR 12 -10.625 -0.003 12.871 86 HD1 TYR 12 HD1 TYR 12 -7.992 0.438 13.101 87 HD2 TYR 12 HD2 TYR 12 -10.931 3.440 12.444 88 HE1 TYR 12 HE1 TYR 12 -6.473 2.123 14.051 89 HE2 TYR 12 HE2 TYR 12 -9.423 5.135 13.380 90 HH TYR 12 HH TYR 12 -7.463 5.132 15.032 91 H GLU 13 HN GLU 13 -10.137 -2.218 11.651 92 HA GLU 13 HA GLU 13 -7.481 -2.595 12.474 93 HB2 GLU 13 HB2 GLU 13 -9.576 -3.932 13.088 94 HB3 GLU 13 HB1 GLU 13 -9.373 -4.770 11.560 95 HG2 GLU 13 HG2 GLU 13 -7.225 -4.695 13.655 96 HG3 GLU 13 HG1 GLU 13 -8.495 -5.913 13.640 97 H GLU 14 HN GLU 14 -9.129 -3.137 9.439 98 HA GLU 14 HA GLU 14 -7.032 -4.691 8.265 99 HB2 GLU 14 HB2 GLU 14 -9.477 -3.373 7.093 100 HB3 GLU 14 HB1 GLU 14 -8.358 -4.352 6.153 101 HG2 GLU 14 HG2 GLU 14 -8.867 -6.301 7.457 102 HG3 GLU 14 HG1 GLU 14 -9.852 -5.344 8.572 103 H LYS 15 HN LYS 15 -8.167 -1.334 7.856 104 HA LYS 15 HA LYS 15 -6.288 -0.524 5.973 105 HB2 LYS 15 HB2 LYS 15 -7.721 0.982 8.146 106 HB3 LYS 15 HB1 LYS 15 -6.621 1.778 7.032 107 HG2 LYS 15 HG2 LYS 15 -7.976 1.241 5.157 108 HG3 LYS 15 HG1 LYS 15 -8.976 0.160 6.139 109 HD2 LYS 15 HD2 LYS 15 -10.232 1.835 6.925 110 HD3 LYS 15 HD1 LYS 15 -8.839 2.889 7.179 111 HE2 LYS 15 HE2 LYS 15 -8.798 3.364 4.762 112 HE3 LYS 15 HE1 LYS 15 -10.235 2.362 4.550 113 HZ1 LYS 15 HZ1 LYS 15 -10.709 4.765 4.707 114 HZ2 LYS 15 HZ2 LYS 15 -10.099 4.772 6.288 115 HZ3 LYS 15 HZ3 LYS 15 -11.481 3.871 5.915 116 H ARG 16 HN ARG 16 -6.064 -0.552 9.513 117 HA ARG 16 HA ARG 16 -3.478 0.562 9.643 118 HB2 ARG 16 HB2 ARG 16 -5.006 0.420 11.598 119 HB3 ARG 16 HB1 ARG 16 -4.806 -1.330 11.608 120 HG2 ARG 16 HG2 ARG 16 -2.353 -0.956 12.004 121 HG3 ARG 16 HG1 ARG 16 -2.718 0.755 12.200 122 HD2 ARG 16 HD2 ARG 16 -4.172 -1.269 13.816 123 HD3 ARG 16 HD1 ARG 16 -2.563 -0.752 14.289 124 HE ARG 16 HE ARG 16 -3.666 1.592 14.120 125 HH11 ARG 16 HH11 ARG 16 -5.216 -1.334 15.255 126 HH12 ARG 16 HH12 ARG 16 -6.253 -0.502 16.368 127 HH21 ARG 16 HH21 ARG 16 -5.014 2.685 15.610 128 HH22 ARG 16 HH22 ARG 16 -6.144 1.776 16.568 129 H GLN 17 HN GLN 17 -4.601 -2.781 9.341 130 HA GLN 17 HA GLN 17 -2.064 -3.974 9.636 131 HB2 GLN 17 HB2 GLN 17 -4.226 -5.181 9.904 132 HB3 GLN 17 HB1 GLN 17 -4.464 -5.056 8.166 133 HG2 GLN 17 HG2 GLN 17 -3.618 -7.241 8.737 134 HG3 GLN 17 HG1 GLN 17 -2.421 -6.345 7.802 135 HE21 GLN 17 HE21 GLN 17 -0.717 -7.575 8.564 136 HE22 GLN 17 HE22 GLN 17 -0.124 -7.417 10.184 137 H LEU 18 HN LEU 18 -3.759 -2.575 6.976 138 HA LEU 18 HA LEU 18 -2.155 -3.641 4.894 139 HB2 LEU 18 HB2 LEU 18 -4.470 -2.195 5.043 140 HB3 LEU 18 HB1 LEU 18 -3.341 -0.978 4.486 141 HG LEU 18 HG LEU 18 -3.729 -3.623 3.093 142 HD11 LEU 18 HD11 LEU 18 -4.988 -0.967 2.479 143 HD12 LEU 18 HD12 LEU 18 -5.825 -2.374 3.126 144 HD13 LEU 18 HD13 LEU 18 -5.125 -2.429 1.508 145 HD21 LEU 18 HD21 LEU 18 -1.684 -2.708 2.410 146 HD22 LEU 18 HD22 LEU 18 -2.318 -1.069 2.402 147 HD23 LEU 18 HD23 LEU 18 -2.827 -2.218 1.170 148 H SER 19 HN SER 19 -2.028 -0.639 6.765 149 HA SER 19 HA SER 19 0.297 0.387 5.573 150 HB2 SER 19 HB2 SER 19 -0.560 0.638 8.469 151 HB3 SER 19 HB1 SER 19 0.571 1.697 7.624 152 HG SER 19 HG SER 19 -1.883 1.381 6.402 153 H LEU 20 HN LEU 20 -0.220 -2.100 7.943 154 HA LEU 20 HA LEU 20 2.534 -2.344 8.676 155 HB2 LEU 20 HB2 LEU 20 0.137 -4.080 9.194 156 HB3 LEU 20 HB1 LEU 20 1.731 -4.418 9.830 157 HG LEU 20 HG LEU 20 0.179 -1.904 10.429 158 HD11 LEU 20 HD11 LEU 20 -0.688 -4.195 11.252 159 HD12 LEU 20 HD12 LEU 20 -0.543 -2.867 12.403 160 HD13 LEU 20 HD13 LEU 20 0.687 -4.133 12.353 161 HD21 LEU 20 HD21 LEU 20 2.700 -1.841 10.551 162 HD22 LEU 20 HD22 LEU 20 2.587 -3.048 11.829 163 HD23 LEU 20 HD23 LEU 20 1.854 -1.459 12.048 164 H ASP 21 HN ASP 21 0.418 -3.861 6.313 165 HA ASP 21 HA ASP 21 2.219 -6.035 5.832 166 HB2 ASP 21 HB2 ASP 21 0.707 -6.676 4.015 167 HB3 ASP 21 HB1 ASP 21 -0.142 -6.411 5.526 168 H ILE 22 HN ILE 22 1.585 -2.939 4.269 169 HA ILE 22 HA ILE 22 3.366 -3.365 2.100 170 HB ILE 22 HB ILE 22 2.391 -0.817 3.400 171 HG12 ILE 22 HG12 ILE 22 1.728 -1.856 0.655 172 HG13 ILE 22 HG11 ILE 22 0.853 -2.442 2.076 173 HG21 ILE 22 HG21 ILE 22 4.441 -0.200 2.425 174 HG22 ILE 22 HG22 ILE 22 3.180 0.293 1.297 175 HG23 ILE 22 HG23 ILE 22 4.126 -1.160 0.985 176 HD11 ILE 22 HD11 ILE 22 0.085 -0.257 2.552 177 HD12 ILE 22 HD12 ILE 22 -0.268 -0.605 0.865 178 HD13 ILE 22 HD13 ILE 22 1.084 0.449 1.289 179 H ASN 23 HN ASN 23 3.744 -2.175 5.366 180 HA ASN 23 HA ASN 23 6.411 -1.326 5.260 181 HB2 ASN 23 HB2 ASN 23 5.026 -0.727 7.114 182 HB3 ASN 23 HB1 ASN 23 4.693 -2.409 7.489 183 HD21 ASN 23 HD21 ASN 23 7.027 0.158 7.646 184 HD22 ASN 23 HD22 ASN 23 8.057 -0.581 8.821 185 H LYS 24 HN LYS 24 5.026 -4.477 5.186 186 HA LYS 24 HA LYS 24 7.347 -5.878 6.163 187 HB2 LYS 24 HB2 LYS 24 4.814 -6.782 4.801 188 HB3 LYS 24 HB1 LYS 24 6.087 -7.899 5.286 189 HG2 LYS 24 HG2 LYS 24 5.784 -7.257 7.605 190 HG3 LYS 24 HG1 LYS 24 4.568 -6.067 7.138 191 HD2 LYS 24 HD2 LYS 24 3.185 -7.900 6.221 192 HD3 LYS 24 HD1 LYS 24 4.382 -9.059 6.797 193 HE2 LYS 24 HE2 LYS 24 2.837 -7.135 8.531 194 HE3 LYS 24 HE1 LYS 24 2.474 -8.848 8.334 195 HZ1 LYS 24 HZ1 LYS 24 4.645 -9.371 9.268 196 HZ2 LYS 24 HZ2 LYS 24 3.731 -8.449 10.348 197 HZ3 LYS 24 HZ3 LYS 24 4.980 -7.725 9.469 198 H LEU 25 HN LEU 25 6.003 -5.004 3.046 199 HA LEU 25 HA LEU 25 7.352 -6.757 1.367 200 HB2 LEU 25 HB2 LEU 25 6.596 -3.897 0.849 201 HB3 LEU 25 HB1 LEU 25 7.014 -5.051 -0.385 202 HG LEU 25 HG LEU 25 4.561 -4.969 1.330 203 HD11 LEU 25 HD11 LEU 25 5.110 -4.952 -1.615 204 HD12 LEU 25 HD12 LEU 25 4.449 -3.641 -0.643 205 HD13 LEU 25 HD13 LEU 25 3.503 -5.102 -0.921 206 HD21 LEU 25 HD21 LEU 25 5.603 -7.221 -0.326 207 HD22 LEU 25 HD22 LEU 25 3.932 -7.100 0.207 208 HD23 LEU 25 HD23 LEU 25 5.233 -7.254 1.392 209 HA PRO 26 HA PRO 26 11.652 -5.355 1.540 210 HB2 PRO 26 HB2 PRO 26 11.676 -6.760 -1.087 211 HB3 PRO 26 HB1 PRO 26 12.767 -6.941 0.297 212 HG2 PRO 26 HG2 PRO 26 10.944 -8.804 -0.242 213 HG3 PRO 26 HG1 PRO 26 11.299 -8.340 1.433 214 HD2 PRO 26 HD2 PRO 26 8.972 -7.585 -0.294 215 HD3 PRO 26 HD1 PRO 26 9.010 -7.986 1.438 216 H GLY 27 HN GLY 27 12.847 -3.787 0.380 217 HA2 GLY 27 HA2 GLY 27 11.445 -1.616 -0.456 218 HA3 GLY 27 HA1 GLY 27 13.113 -1.901 -0.904 219 H GLU 28 HN GLU 28 12.814 -4.059 -2.648 220 HA GLU 28 HA GLU 28 12.185 -2.871 -5.075 221 HB2 GLU 28 HB2 GLU 28 13.530 -4.903 -4.923 222 HB3 GLU 28 HB1 GLU 28 12.152 -5.803 -4.323 223 HG2 GLU 28 HG2 GLU 28 11.245 -4.773 -6.707 224 HG3 GLU 28 HG1 GLU 28 12.925 -5.192 -7.028 225 H LYS 29 HN LYS 29 10.253 -5.243 -3.291 226 HA LYS 29 HA LYS 29 7.969 -5.103 -4.940 227 HB2 LYS 29 HB2 LYS 29 8.431 -6.045 -2.114 228 HB3 LYS 29 HB1 LYS 29 6.887 -6.235 -2.945 229 HG2 LYS 29 HG2 LYS 29 9.493 -7.350 -3.952 230 HG3 LYS 29 HG1 LYS 29 8.345 -8.253 -2.968 231 HD2 LYS 29 HD2 LYS 29 6.614 -7.800 -4.712 232 HD3 LYS 29 HD1 LYS 29 7.886 -7.123 -5.725 233 HE2 LYS 29 HE2 LYS 29 7.451 -9.426 -6.344 234 HE3 LYS 29 HE1 LYS 29 9.070 -9.270 -5.671 235 HZ1 LYS 29 HZ1 LYS 29 8.235 -10.118 -3.568 236 HZ2 LYS 29 HZ2 LYS 29 7.931 -11.216 -4.815 237 HZ3 LYS 29 HZ3 LYS 29 6.677 -10.257 -4.215 238 H LEU 30 HN LEU 30 9.003 -3.414 -2.097 239 HA LEU 30 HA LEU 30 6.612 -2.150 -1.356 240 HB2 LEU 30 HB2 LEU 30 8.594 -2.220 0.066 241 HB3 LEU 30 HB1 LEU 30 9.490 -1.255 -1.088 242 HG LEU 30 HG LEU 30 8.309 0.702 -0.540 243 HD11 LEU 30 HD11 LEU 30 6.419 -0.725 1.274 244 HD12 LEU 30 HD12 LEU 30 6.080 -0.630 -0.446 245 HD13 LEU 30 HD13 LEU 30 6.254 0.841 0.496 246 HD21 LEU 30 HD21 LEU 30 8.527 0.818 1.932 247 HD22 LEU 30 HD22 LEU 30 9.936 0.121 1.131 248 HD23 LEU 30 HD23 LEU 30 8.779 -0.929 1.951 249 H GLY 31 HN GLY 31 9.055 -1.222 -3.756 250 HA2 GLY 31 HA2 GLY 31 8.165 1.404 -4.201 251 HA3 GLY 31 HA1 GLY 31 9.036 0.428 -5.364 252 H ARG 32 HN ARG 32 6.698 -1.584 -5.139 253 HA ARG 32 HA ARG 32 5.174 -0.549 -7.313 254 HB2 ARG 32 HB2 ARG 32 5.477 -2.940 -7.124 255 HB3 ARG 32 HB1 ARG 32 4.728 -2.940 -5.537 256 HG2 ARG 32 HG2 ARG 32 3.150 -3.806 -7.131 257 HG3 ARG 32 HG1 ARG 32 2.600 -2.225 -6.588 258 HD2 ARG 32 HD2 ARG 32 2.277 -2.355 -8.954 259 HD3 ARG 32 HD1 ARG 32 3.593 -1.227 -8.634 260 HE ARG 32 HE ARG 32 4.707 -3.754 -9.080 261 HH11 ARG 32 HH11 ARG 32 2.912 -1.301 -10.819 262 HH12 ARG 32 HH12 ARG 32 3.619 -1.684 -12.356 263 HH21 ARG 32 HH21 ARG 32 5.617 -4.291 -11.115 264 HH22 ARG 32 HH22 ARG 32 5.152 -3.397 -12.526 265 H VAL 33 HN VAL 33 4.460 -1.068 -3.860 266 HA VAL 33 HA VAL 33 1.743 -0.255 -4.067 267 HB VAL 33 HB VAL 33 2.491 0.249 -1.418 268 HG11 VAL 33 HG11 VAL 33 1.098 -1.937 -2.908 269 HG12 VAL 33 HG12 VAL 33 0.465 -0.789 -1.730 270 HG13 VAL 33 HG13 VAL 33 1.443 -2.150 -1.195 271 HG21 VAL 33 HG21 VAL 33 3.905 -2.201 -2.469 272 HG22 VAL 33 HG22 VAL 33 3.680 -1.795 -0.773 273 HG23 VAL 33 HG23 VAL 33 4.663 -0.758 -1.804 274 H VAL 34 HN VAL 34 4.640 1.494 -2.904 275 HA VAL 34 HA VAL 34 3.463 3.946 -2.353 276 HB VAL 34 HB VAL 34 5.627 4.407 -1.950 277 HG11 VAL 34 HG11 VAL 34 6.159 2.086 -2.145 278 HG12 VAL 34 HG12 VAL 34 7.478 3.064 -2.783 279 HG13 VAL 34 HG13 VAL 34 6.370 2.247 -3.886 280 HG21 VAL 34 HG21 VAL 34 5.476 5.879 -3.881 281 HG22 VAL 34 HG22 VAL 34 5.952 4.561 -4.945 282 HG23 VAL 34 HG23 VAL 34 7.093 5.196 -3.761 283 H HIS 35 HN HIS 35 4.481 2.599 -5.433 284 HA HIS 35 HA HIS 35 3.766 4.798 -7.058 285 HB2 HIS 35 HB2 HIS 35 5.311 3.033 -7.792 286 HB3 HIS 35 HB1 HIS 35 3.981 1.884 -7.792 287 HD1 HIS 35 HD1 HIS 35 5.175 4.969 -9.639 288 HD2 HIS 35 HD2 HIS 35 2.520 1.808 -10.115 289 HE1 HIS 35 HE1 HIS 35 4.358 5.121 -12.009 290 HE2 HIS 35 HE2 HIS 35 2.889 3.100 -12.320 291 H ILE 36 HN ILE 36 2.003 1.870 -6.115 292 HA ILE 36 HA ILE 36 -0.235 2.190 -7.739 293 HB ILE 36 HB ILE 36 -0.186 0.977 -4.973 294 HG12 ILE 36 HG12 ILE 36 0.241 -0.189 -7.723 295 HG13 ILE 36 HG11 ILE 36 1.360 -0.200 -6.370 296 HG21 ILE 36 HG21 ILE 36 -2.398 0.835 -5.190 297 HG22 ILE 36 HG22 ILE 36 -2.133 -0.246 -6.557 298 HG23 ILE 36 HG23 ILE 36 -2.329 1.483 -6.827 299 HD11 ILE 36 HD11 ILE 36 -0.258 -1.661 -5.157 300 HD12 ILE 36 HD12 ILE 36 0.466 -2.382 -6.591 301 HD13 ILE 36 HD13 ILE 36 -1.183 -1.766 -6.652 302 H ILE 37 HN ILE 37 0.167 3.266 -4.347 303 HA ILE 37 HA ILE 37 -2.353 4.460 -4.141 304 HB ILE 37 HB ILE 37 0.147 5.331 -2.685 305 HG12 ILE 37 HG12 ILE 37 -1.595 3.902 -0.994 306 HG13 ILE 37 HG11 ILE 37 -1.477 2.954 -2.469 307 HG21 ILE 37 HG21 ILE 37 -2.101 6.726 -2.841 308 HG22 ILE 37 HG22 ILE 37 -1.157 6.637 -1.352 309 HG23 ILE 37 HG23 ILE 37 -2.581 5.615 -1.556 310 HD11 ILE 37 HD11 ILE 37 0.888 2.802 -2.263 311 HD12 ILE 37 HD12 ILE 37 0.162 2.340 -0.723 312 HD13 ILE 37 HD13 ILE 37 0.890 3.934 -0.915 313 H GLN 38 HN GLN 38 0.767 5.961 -4.927 314 HA GLN 38 HA GLN 38 -0.132 8.564 -5.327 315 HB2 GLN 38 HB2 GLN 38 2.148 7.090 -6.646 316 HB3 GLN 38 HB1 GLN 38 1.902 8.824 -6.818 317 HG2 GLN 38 HG2 GLN 38 1.949 8.773 -4.186 318 HG3 GLN 38 HG1 GLN 38 2.769 7.228 -4.438 319 HE21 GLN 38 HE21 GLN 38 4.042 9.634 -3.289 320 HE22 GLN 38 HE22 GLN 38 5.305 10.068 -4.377 321 H SER 39 HN SER 39 -0.264 5.807 -7.474 322 HA SER 39 HA SER 39 -0.942 7.335 -9.801 323 HB2 SER 39 HB2 SER 39 0.138 5.205 -10.114 324 HB3 SER 39 HB1 SER 39 -1.117 4.375 -9.195 325 HG SER 39 HG SER 39 -1.400 5.666 -11.712 326 H ARG 40 HN ARG 40 -2.762 5.334 -7.496 327 HA ARG 40 HA ARG 40 -5.257 5.776 -8.837 328 HB2 ARG 40 HB2 ARG 40 -4.821 4.743 -6.040 329 HB3 ARG 40 HB1 ARG 40 -6.251 4.520 -7.032 330 HG2 ARG 40 HG2 ARG 40 -4.652 3.324 -8.669 331 HG3 ARG 40 HG1 ARG 40 -3.568 3.228 -7.279 332 HD2 ARG 40 HD2 ARG 40 -4.913 1.218 -7.517 333 HD3 ARG 40 HD1 ARG 40 -5.236 2.068 -6.015 334 HE ARG 40 HE ARG 40 -7.261 2.970 -7.194 335 HH11 ARG 40 HH11 ARG 40 -5.800 -0.068 -8.124 336 HH12 ARG 40 HH12 ARG 40 -7.292 -0.746 -8.709 337 HH21 ARG 40 HH21 ARG 40 -9.216 2.082 -7.969 338 HH22 ARG 40 HH22 ARG 40 -9.225 0.473 -8.618 339 H GLU 41 HN GLU 41 -3.609 7.150 -6.059 340 HA GLU 41 HA GLU 41 -5.757 9.152 -5.798 341 HB2 GLU 41 HB2 GLU 41 -3.601 8.588 -3.779 342 HB3 GLU 41 HB1 GLU 41 -5.080 9.497 -3.537 343 HG2 GLU 41 HG2 GLU 41 -4.802 6.525 -3.902 344 HG3 GLU 41 HG1 GLU 41 -5.239 7.382 -2.429 345 HA PRO 42 HA PRO 42 -2.195 11.202 -7.993 346 HB2 PRO 42 HB2 PRO 42 -4.398 13.063 -8.691 347 HB3 PRO 42 HB1 PRO 42 -3.183 12.315 -9.731 348 HG2 PRO 42 HG2 PRO 42 -5.713 11.475 -9.755 349 HG3 PRO 42 HG1 PRO 42 -4.368 10.330 -9.908 350 HD2 PRO 42 HD2 PRO 42 -6.083 10.936 -7.540 351 HD3 PRO 42 HD1 PRO 42 -5.442 9.379 -8.095 352 H SER 43 HN SER 43 -4.573 12.476 -5.774 353 HA SER 43 HA SER 43 -3.643 15.079 -5.459 354 HB2 SER 43 HB2 SER 43 -4.951 13.261 -3.427 355 HB3 SER 43 HB1 SER 43 -4.779 15.007 -3.254 356 HG SER 43 HG SER 43 -6.685 14.944 -4.187 357 H LEU 44 HN LEU 44 -2.408 12.081 -4.126 358 HA LEU 44 HA LEU 44 -0.601 13.604 -2.397 359 HB2 LEU 44 HB2 LEU 44 -0.144 11.425 -1.289 360 HB3 LEU 44 HB1 LEU 44 -1.796 11.974 -1.159 361 HG LEU 44 HG LEU 44 -2.146 10.390 -3.241 362 HD11 LEU 44 HD11 LEU 44 0.262 9.858 -3.422 363 HD12 LEU 44 HD12 LEU 44 -0.752 8.435 -3.188 364 HD13 LEU 44 HD13 LEU 44 0.180 9.086 -1.839 365 HD21 LEU 44 HD21 LEU 44 -3.285 10.191 -1.107 366 HD22 LEU 44 HD22 LEU 44 -1.860 9.433 -0.396 367 HD23 LEU 44 HD23 LEU 44 -2.755 8.606 -1.671 368 H LYS 45 HN LYS 45 -0.385 13.050 -5.383 369 HA LYS 45 HA LYS 45 2.070 11.483 -5.430 370 HB2 LYS 45 HB2 LYS 45 0.670 10.953 -7.292 371 HB3 LYS 45 HB1 LYS 45 0.469 12.641 -7.731 372 HG2 LYS 45 HG2 LYS 45 2.869 12.711 -8.316 373 HG3 LYS 45 HG1 LYS 45 2.977 10.984 -7.960 374 HD2 LYS 45 HD2 LYS 45 2.667 11.033 -10.260 375 HD3 LYS 45 HD1 LYS 45 1.021 10.798 -9.661 376 HE2 LYS 45 HE2 LYS 45 0.754 12.509 -11.207 377 HE3 LYS 45 HE1 LYS 45 0.909 13.367 -9.674 378 HZ1 LYS 45 HZ1 LYS 45 3.107 12.948 -11.621 379 HZ2 LYS 45 HZ2 LYS 45 3.224 13.791 -10.162 380 HZ3 LYS 45 HZ3 LYS 45 2.250 14.389 -11.405 381 H ASN 46 HN ASN 46 1.413 14.461 -4.448 382 HA ASN 46 HA ASN 46 3.664 15.803 -5.736 383 HB2 ASN 46 HB2 ASN 46 1.744 16.773 -3.602 384 HB3 ASN 46 HB1 ASN 46 2.980 17.755 -4.377 385 HD21 ASN 46 HD21 ASN 46 0.102 18.117 -4.287 386 HD22 ASN 46 HD22 ASN 46 -0.433 18.154 -5.932 387 H SER 47 HN SER 47 2.990 13.799 -3.165 388 HA SER 47 HA SER 47 4.822 14.693 -1.206 389 HB2 SER 47 HB2 SER 47 3.914 11.846 -1.708 390 HB3 SER 47 HB1 SER 47 4.448 12.551 -0.180 391 HG SER 47 HG SER 47 1.985 12.531 -1.276 392 H ASN 48 HN ASN 48 7.000 14.227 -0.937 393 HA ASN 48 HA ASN 48 8.596 13.571 -3.137 394 HB2 ASN 48 HB2 ASN 48 9.332 13.066 -0.237 395 HB3 ASN 48 HB1 ASN 48 10.443 13.283 -1.583 396 HD21 ASN 48 HD21 ASN 48 10.291 14.712 0.906 397 HD22 ASN 48 HD22 ASN 48 10.053 16.374 0.507 398 HA PRO 49 HA PRO 49 7.436 9.317 -3.487 399 HB2 PRO 49 HB2 PRO 49 9.491 8.542 -5.163 400 HB3 PRO 49 HB1 PRO 49 7.960 9.249 -5.675 401 HG2 PRO 49 HG2 PRO 49 10.635 10.518 -5.359 402 HG3 PRO 49 HG1 PRO 49 9.360 10.862 -6.540 403 HD2 PRO 49 HD2 PRO 49 9.852 12.456 -4.398 404 HD3 PRO 49 HD1 PRO 49 8.237 12.272 -5.109 405 H ASP 50 HN ASP 50 10.462 10.359 -2.198 406 HA ASP 50 HA ASP 50 11.266 7.679 -1.472 407 HB2 ASP 50 HB2 ASP 50 12.465 10.366 -0.810 408 HB3 ASP 50 HB1 ASP 50 13.140 8.830 -0.273 409 H GLU 51 HN GLU 51 9.562 10.317 -0.091 410 HA GLU 51 HA GLU 51 9.167 8.822 2.412 411 HB2 GLU 51 HB2 GLU 51 10.046 11.646 2.017 412 HB3 GLU 51 HB1 GLU 51 8.859 11.373 3.285 413 HG2 GLU 51 HG2 GLU 51 10.348 9.821 4.383 414 HG3 GLU 51 HG1 GLU 51 11.511 9.967 3.070 415 H ILE 52 HN ILE 52 7.335 8.198 0.837 416 HA ILE 52 HA ILE 52 5.648 10.248 -0.160 417 HB ILE 52 HB ILE 52 4.503 8.621 -1.305 418 HG12 ILE 52 HG12 ILE 52 5.192 6.378 0.496 419 HG13 ILE 52 HG11 ILE 52 3.917 7.496 0.992 420 HG21 ILE 52 HG21 ILE 52 6.952 7.035 -0.617 421 HG22 ILE 52 HG22 ILE 52 6.981 8.449 -1.675 422 HG23 ILE 52 HG23 ILE 52 6.039 7.029 -2.128 423 HD11 ILE 52 HD11 ILE 52 2.864 7.093 -1.241 424 HD12 ILE 52 HD12 ILE 52 2.856 5.725 -0.140 425 HD13 ILE 52 HD13 ILE 52 4.016 5.778 -1.466 426 H GLU 53 HN GLU 53 3.460 10.636 0.296 427 HA GLU 53 HA GLU 53 2.824 10.332 3.143 428 HB2 GLU 53 HB2 GLU 53 3.112 12.573 1.606 429 HB3 GLU 53 HB1 GLU 53 1.384 12.306 1.498 430 HG2 GLU 53 HG2 GLU 53 3.040 12.811 3.945 431 HG3 GLU 53 HG1 GLU 53 1.779 13.828 3.262 432 H ILE 54 HN ILE 54 1.410 8.661 3.385 433 HA ILE 54 HA ILE 54 -0.769 8.404 1.404 434 HB ILE 54 HB ILE 54 0.173 6.357 3.422 435 HG12 ILE 54 HG12 ILE 54 0.418 6.356 0.408 436 HG13 ILE 54 HG11 ILE 54 1.744 6.682 1.527 437 HG21 ILE 54 HG21 ILE 54 -1.333 4.850 2.094 438 HG22 ILE 54 HG22 ILE 54 -1.991 6.294 1.333 439 HG23 ILE 54 HG23 ILE 54 -2.157 6.059 3.074 440 HD11 ILE 54 HD11 ILE 54 1.823 4.399 0.711 441 HD12 ILE 54 HD12 ILE 54 0.187 4.117 1.308 442 HD13 ILE 54 HD13 ILE 54 1.497 4.428 2.443 443 H ASP 55 HN ASP 55 -2.855 8.667 2.014 444 HA ASP 55 HA ASP 55 -3.349 9.081 4.899 445 HB2 ASP 55 HB2 ASP 55 -3.589 11.137 3.426 446 HB3 ASP 55 HB1 ASP 55 -4.937 10.322 2.643 447 H PHE 56 HN PHE 56 -3.918 6.984 5.318 448 HA PHE 56 HA PHE 56 -5.273 5.320 3.537 449 HB2 PHE 56 HB2 PHE 56 -4.281 5.148 6.262 450 HB3 PHE 56 HB1 PHE 56 -5.738 4.190 6.002 451 HD1 PHE 56 HD1 PHE 56 -2.226 4.645 5.017 452 HD2 PHE 56 HD2 PHE 56 -5.748 2.325 4.532 453 HE1 PHE 56 HE1 PHE 56 -0.919 2.894 3.875 454 HE2 PHE 56 HE2 PHE 56 -4.466 0.584 3.401 455 HZ PHE 56 HZ PHE 56 -2.046 0.850 3.072 456 H GLU 57 HN GLU 57 -6.551 7.752 5.554 457 HA GLU 57 HA GLU 57 -9.176 6.518 5.691 458 HB2 GLU 57 HB2 GLU 57 -8.037 9.077 6.772 459 HB3 GLU 57 HB1 GLU 57 -9.738 8.650 6.923 460 HG2 GLU 57 HG2 GLU 57 -7.431 7.033 7.970 461 HG3 GLU 57 HG1 GLU 57 -8.455 8.100 8.928 462 H THR 58 HN THR 58 -7.627 7.906 3.266 463 HA THR 58 HA THR 58 -10.095 9.149 2.259 464 HB THR 58 HB THR 58 -8.712 10.784 0.985 465 HG1 THR 58 HG1 THR 58 -6.671 9.519 2.491 466 HG21 THR 58 HG21 THR 58 -8.476 10.831 3.988 467 HG22 THR 58 HG22 THR 58 -9.813 11.470 3.029 468 HG23 THR 58 HG23 THR 58 -8.222 12.225 2.939 469 H LEU 59 HN LEU 59 -7.561 6.934 1.722 470 HA LEU 59 HA LEU 59 -7.378 6.920 -1.087 471 HB2 LEU 59 HB2 LEU 59 -7.295 4.337 0.435 472 HB3 LEU 59 HB1 LEU 59 -6.350 4.838 -0.944 473 HG LEU 59 HG LEU 59 -5.985 5.745 1.905 474 HD11 LEU 59 HD11 LEU 59 -4.424 3.928 0.089 475 HD12 LEU 59 HD12 LEU 59 -5.079 3.601 1.694 476 HD13 LEU 59 HD13 LEU 59 -3.711 4.696 1.508 477 HD21 LEU 59 HD21 LEU 59 -4.723 6.717 -0.635 478 HD22 LEU 59 HD22 LEU 59 -3.909 6.854 0.916 479 HD23 LEU 59 HD23 LEU 59 -5.459 7.650 0.659 480 H LYS 60 HN LYS 60 -8.522 5.779 -2.668 481 HA LYS 60 HA LYS 60 -11.281 5.316 -2.204 482 HB2 LYS 60 HB2 LYS 60 -9.548 4.386 -4.507 483 HB3 LYS 60 HB1 LYS 60 -11.304 4.509 -4.518 484 HG2 LYS 60 HG2 LYS 60 -11.135 6.932 -4.257 485 HG3 LYS 60 HG1 LYS 60 -9.372 6.809 -4.229 486 HD2 LYS 60 HD2 LYS 60 -9.470 5.805 -6.499 487 HD3 LYS 60 HD1 LYS 60 -11.205 6.128 -6.520 488 HE2 LYS 60 HE2 LYS 60 -10.018 7.897 -7.674 489 HE3 LYS 60 HE1 LYS 60 -10.746 8.518 -6.195 490 HZ1 LYS 60 HZ1 LYS 60 -8.548 8.229 -5.114 491 HZ2 LYS 60 HZ2 LYS 60 -8.544 9.365 -6.367 492 HZ3 LYS 60 HZ3 LYS 60 -7.891 7.826 -6.624 493 HA PRO 61 HA PRO 61 -11.442 1.281 -0.469 494 HB2 PRO 61 HB2 PRO 61 -13.473 0.586 -2.520 495 HB3 PRO 61 HB1 PRO 61 -13.588 0.513 -0.760 496 HG2 PRO 61 HG2 PRO 61 -14.807 2.432 -2.231 497 HG3 PRO 61 HG1 PRO 61 -14.229 2.717 -0.583 498 HD2 PRO 61 HD2 PRO 61 -13.126 3.662 -3.164 499 HD3 PRO 61 HD1 PRO 61 -12.977 4.365 -1.543 500 H SER 62 HN SER 62 -11.567 1.397 -4.017 501 HA SER 62 HA SER 62 -10.587 -1.233 -4.392 502 HB2 SER 62 HB2 SER 62 -10.096 -0.249 -6.759 503 HB3 SER 62 HB1 SER 62 -11.770 -0.393 -6.221 504 HG SER 62 HG SER 62 -11.599 1.653 -6.968 505 H THR 63 HN THR 63 -9.039 1.908 -4.046 506 HA THR 63 HA THR 63 -6.430 1.171 -4.791 507 HB THR 63 HB THR 63 -7.078 3.154 -2.573 508 HG1 THR 63 HG1 THR 63 -7.146 4.676 -4.444 509 HG21 THR 63 HG21 THR 63 -4.690 2.530 -3.069 510 HG22 THR 63 HG22 THR 63 -5.072 4.241 -3.217 511 HG23 THR 63 HG23 THR 63 -4.906 3.248 -4.661 512 H LEU 64 HN LEU 64 -8.061 1.144 -1.637 513 HA LEU 64 HA LEU 64 -5.991 0.067 -0.109 514 HB2 LEU 64 HB2 LEU 64 -8.985 -0.199 0.141 515 HB3 LEU 64 HB1 LEU 64 -7.878 -0.855 1.329 516 HG LEU 64 HG LEU 64 -8.051 2.068 0.607 517 HD11 LEU 64 HD11 LEU 64 -10.104 1.255 1.727 518 HD12 LEU 64 HD12 LEU 64 -9.177 2.368 2.726 519 HD13 LEU 64 HD13 LEU 64 -9.106 0.637 3.040 520 HD21 LEU 64 HD21 LEU 64 -5.878 1.497 1.424 521 HD22 LEU 64 HD22 LEU 64 -6.573 0.566 2.744 522 HD23 LEU 64 HD23 LEU 64 -6.762 2.319 2.706 523 H ARG 65 HN ARG 65 -8.411 -1.572 -2.097 524 HA ARG 65 HA ARG 65 -7.550 -4.132 -1.114 525 HB2 ARG 65 HB2 ARG 65 -9.776 -3.144 -2.712 526 HB3 ARG 65 HB1 ARG 65 -9.175 -4.700 -3.236 527 HG2 ARG 65 HG2 ARG 65 -10.126 -3.988 -0.483 528 HG3 ARG 65 HG1 ARG 65 -10.945 -5.047 -1.642 529 HD2 ARG 65 HD2 ARG 65 -8.246 -5.565 -0.380 530 HD3 ARG 65 HD1 ARG 65 -9.758 -6.301 0.080 531 HE ARG 65 HE ARG 65 -9.383 -6.752 -2.645 532 HH11 ARG 65 HH11 ARG 65 -7.916 -7.664 0.411 533 HH12 ARG 65 HH12 ARG 65 -7.414 -9.226 -0.168 534 HH21 ARG 65 HH21 ARG 65 -8.712 -8.788 -3.396 535 HH22 ARG 65 HH22 ARG 65 -7.844 -9.856 -2.335 536 H GLU 66 HN GLU 66 -6.597 -2.053 -3.681 537 HA GLU 66 HA GLU 66 -5.343 -4.197 -5.144 538 HB2 GLU 66 HB2 GLU 66 -6.040 -2.273 -6.410 539 HB3 GLU 66 HB1 GLU 66 -5.124 -1.189 -5.366 540 HG2 GLU 66 HG2 GLU 66 -3.085 -1.862 -6.261 541 HG3 GLU 66 HG1 GLU 66 -3.752 -3.363 -6.901 542 H LEU 67 HN LEU 67 -4.530 -1.829 -2.715 543 HA LEU 67 HA LEU 67 -1.738 -2.253 -2.642 544 HB2 LEU 67 HB2 LEU 67 -3.631 -1.413 -0.426 545 HB3 LEU 67 HB1 LEU 67 -1.891 -1.180 -0.413 546 HG LEU 67 HG LEU 67 -3.857 0.139 -2.289 547 HD11 LEU 67 HD11 LEU 67 -2.160 1.354 -0.122 548 HD12 LEU 67 HD12 LEU 67 -3.866 0.951 0.058 549 HD13 LEU 67 HD13 LEU 67 -3.365 2.164 -1.120 550 HD21 LEU 67 HD21 LEU 67 -1.645 -0.381 -3.298 551 HD22 LEU 67 HD22 LEU 67 -0.898 0.621 -2.054 552 HD23 LEU 67 HD23 LEU 67 -2.021 1.335 -3.210 553 H GLU 68 HN GLU 68 -4.459 -3.504 -0.736 554 HA GLU 68 HA GLU 68 -2.916 -5.253 0.868 555 HB2 GLU 68 HB2 GLU 68 -5.096 -4.533 1.614 556 HB3 GLU 68 HB1 GLU 68 -5.873 -5.292 0.228 557 HG2 GLU 68 HG2 GLU 68 -5.196 -7.513 1.068 558 HG3 GLU 68 HG1 GLU 68 -4.354 -6.741 2.398 559 H ARG 69 HN ARG 69 -4.879 -5.842 -2.084 560 HA ARG 69 HA ARG 69 -4.628 -8.652 -1.973 561 HB2 ARG 69 HB2 ARG 69 -6.238 -7.382 -3.417 562 HB3 ARG 69 HB1 ARG 69 -4.897 -7.040 -4.504 563 HG2 ARG 69 HG2 ARG 69 -4.575 -9.599 -4.529 564 HG3 ARG 69 HG1 ARG 69 -6.222 -9.648 -3.901 565 HD2 ARG 69 HD2 ARG 69 -6.287 -9.845 -6.302 566 HD3 ARG 69 HD1 ARG 69 -6.976 -8.299 -5.813 567 HE ARG 69 HE ARG 69 -4.167 -8.272 -6.543 568 HH11 ARG 69 HH11 ARG 69 -7.475 -7.761 -7.556 569 HH12 ARG 69 HH12 ARG 69 -7.043 -6.770 -8.914 570 HH21 ARG 69 HH21 ARG 69 -3.590 -6.955 -8.327 571 HH22 ARG 69 HH22 ARG 69 -4.832 -6.314 -9.354 572 H TYR 70 HN TYR 70 -2.541 -6.172 -3.173 573 HA TYR 70 HA TYR 70 -0.861 -7.968 -4.662 574 HB2 TYR 70 HB2 TYR 70 -0.918 -5.796 -5.537 575 HB3 TYR 70 HB1 TYR 70 -0.715 -5.056 -3.952 576 HD1 TYR 70 HD2 TYR 70 1.060 -6.920 -6.625 577 HD2 TYR 70 HD1 TYR 70 1.383 -4.616 -3.080 578 HE1 TYR 70 HE2 TYR 70 3.488 -6.746 -6.980 579 HE2 TYR 70 HE1 TYR 70 3.818 -4.420 -3.415 580 HH TYR 70 HH TYR 70 5.607 -5.479 -4.557 581 H VAL 71 HN VAL 71 -0.623 -6.271 -1.550 582 HA VAL 71 HA VAL 71 2.012 -7.167 -1.008 583 HB VAL 71 HB VAL 71 1.618 -6.462 1.302 584 HG11 VAL 71 HG11 VAL 71 0.516 -4.118 0.378 585 HG12 VAL 71 HG12 VAL 71 1.276 -4.812 -1.047 586 HG13 VAL 71 HG13 VAL 71 2.226 -4.521 0.411 587 HG21 VAL 71 HG21 VAL 71 -0.525 -6.980 1.893 588 HG22 VAL 71 HG22 VAL 71 -1.207 -6.380 0.380 589 HG23 VAL 71 HG23 VAL 71 -0.665 -5.244 1.616 590 H THR 72 HN THR 72 -1.177 -8.357 0.036 591 HA THR 72 HA THR 72 -0.221 -10.412 1.679 592 HB THR 72 HB THR 72 -2.589 -9.550 1.577 593 HG1 THR 72 HG1 THR 72 -2.734 -11.268 2.796 594 HG21 THR 72 HG21 THR 72 -2.934 -9.721 -0.814 595 HG22 THR 72 HG22 THR 72 -4.126 -10.690 0.048 596 HG23 THR 72 HG23 THR 72 -2.755 -11.471 -0.742 597 H SER 73 HN SER 73 -0.569 -10.192 -1.756 598 HA SER 73 HA SER 73 -0.195 -12.878 -2.475 599 HB2 SER 73 HB2 SER 73 -0.852 -10.960 -3.977 600 HB3 SER 73 HB1 SER 73 0.820 -10.429 -3.930 601 HG SER 73 HG SER 73 0.004 -13.002 -4.808 602 H CYS 74 HN CYS 74 1.973 -10.365 -1.445 603 HA CYS 74 HA CYS 74 4.364 -11.860 -2.133 604 HB2 CYS 74 HB2 CYS 74 4.275 -9.427 -2.490 605 HB3 CYS 74 HB1 CYS 74 4.027 -9.180 -0.762 606 HG CYS 74 HG CYS 74 6.736 -10.980 -1.180 607 H LEU 75 HN LEU 75 2.817 -10.601 0.831 608 HA LEU 75 HA LEU 75 4.595 -11.621 2.705 609 HB2 LEU 75 HB2 LEU 75 1.662 -11.644 3.264 610 HB3 LEU 75 HB1 LEU 75 2.985 -11.183 4.310 611 HG LEU 75 HG LEU 75 2.117 -9.548 1.949 612 HD11 LEU 75 HD11 LEU 75 1.505 -8.909 4.797 613 HD12 LEU 75 HD12 LEU 75 0.426 -9.937 3.860 614 HD13 LEU 75 HD13 LEU 75 0.755 -8.293 3.324 615 HD21 LEU 75 HD21 LEU 75 4.431 -9.283 2.774 616 HD22 LEU 75 HD22 LEU 75 3.784 -8.850 4.355 617 HD23 LEU 75 HD23 LEU 75 3.450 -7.830 2.954 618 H ARG 76 HN ARG 76 2.171 -13.265 0.835 619 HA ARG 76 HA ARG 76 2.309 -15.643 2.512 620 HB2 ARG 76 HB2 ARG 76 0.565 -14.836 0.199 621 HB3 ARG 76 HB1 ARG 76 0.579 -16.485 0.812 622 HG2 ARG 76 HG2 ARG 76 -0.269 -15.800 2.912 623 HG3 ARG 76 HG1 ARG 76 0.007 -14.096 2.540 624 HD2 ARG 76 HD2 ARG 76 -1.670 -14.167 0.801 625 HD3 ARG 76 HD1 ARG 76 -1.899 -15.898 1.054 626 HE ARG 76 HE ARG 76 -2.418 -14.774 3.492 627 HH11 ARG 76 HH11 ARG 76 -3.678 -14.359 0.254 628 HH12 ARG 76 HH12 ARG 76 -5.259 -13.893 0.793 629 HH21 ARG 76 HH21 ARG 76 -4.499 -14.159 4.203 630 HH22 ARG 76 HH22 ARG 76 -5.730 -13.773 3.040 631 H LYS 77 HN LYS 77 4.245 -14.459 0.237 632 HA LYS 77 HA LYS 77 5.011 -17.131 -0.687 633 HB2 LYS 77 HB2 LYS 77 4.457 -14.756 -2.438 634 HB3 LYS 77 HB1 LYS 77 5.537 -16.044 -2.956 635 HG2 LYS 77 HG2 LYS 77 3.810 -17.650 -2.889 636 HG3 LYS 77 HG1 LYS 77 2.731 -16.550 -2.034 637 HD2 LYS 77 HD2 LYS 77 2.660 -15.098 -4.013 638 HD3 LYS 77 HD1 LYS 77 3.744 -16.205 -4.858 639 HE2 LYS 77 HE2 LYS 77 1.434 -16.573 -5.528 640 HE3 LYS 77 HE1 LYS 77 2.073 -17.979 -4.679 641 HZ1 LYS 77 HZ1 LYS 77 -0.172 -17.421 -3.964 642 HZ2 LYS 77 HZ2 LYS 77 0.339 -15.888 -3.473 643 HZ3 LYS 77 HZ3 LYS 77 0.924 -17.268 -2.688 644 H LYS 78 HN LYS 78 7.024 -17.424 0.043 645 HA LYS 78 HA LYS 78 8.805 -15.103 0.184 646 HB2 LYS 78 HB2 LYS 78 8.571 -17.582 1.822 647 HB3 LYS 78 HB1 LYS 78 10.151 -16.831 1.665 648 HG2 LYS 78 HG2 LYS 78 9.121 -16.040 3.667 649 HG3 LYS 78 HG1 LYS 78 9.179 -14.716 2.505 650 HD2 LYS 78 HD2 LYS 78 6.825 -15.160 1.925 651 HD3 LYS 78 HD1 LYS 78 6.783 -16.431 3.150 652 HE2 LYS 78 HE2 LYS 78 7.283 -13.494 3.618 653 HE3 LYS 78 HE1 LYS 78 5.822 -14.388 4.032 654 HZ1 LYS 78 HZ1 LYS 78 7.144 -15.727 5.567 655 HZ2 LYS 78 HZ2 LYS 78 7.208 -14.089 5.962 656 HZ3 LYS 78 HZ3 LYS 78 8.521 -14.819 5.195 657 H ARG 79 HN ARG 79 11.228 -16.053 0.256 658 HA ARG 79 HA ARG 79 12.990 -16.738 -0.965 659 HB2 ARG 79 HB2 ARG 79 11.045 -18.902 -1.712 660 HB3 ARG 79 HB1 ARG 79 12.655 -18.839 -2.410 661 HG2 ARG 79 HG2 ARG 79 12.767 -20.336 -0.600 662 HG3 ARG 79 HG1 ARG 79 13.557 -18.853 -0.064 663 HD2 ARG 79 HD2 ARG 79 11.426 -18.196 1.033 664 HD3 ARG 79 HD1 ARG 79 10.770 -19.773 0.607 665 HE ARG 79 HE ARG 79 13.219 -20.024 2.023 666 HH11 ARG 79 HH11 ARG 79 9.798 -19.442 2.436 667 HH12 ARG 79 HH12 ARG 79 9.790 -19.899 4.107 668 HH21 ARG 79 HH21 ARG 79 13.224 -20.638 4.210 669 HH22 ARG 79 HH22 ARG 79 11.745 -20.604 5.117 670 H LYS 80 HN LYS 80 11.522 -14.640 -1.963 671 HA LYS 80 HA LYS 80 12.072 -14.926 -4.833 672 HB2 LYS 80 HB2 LYS 80 9.618 -13.637 -3.627 673 HB3 LYS 80 HB1 LYS 80 10.088 -13.474 -5.311 674 HG2 LYS 80 HG2 LYS 80 9.445 -16.085 -3.954 675 HG3 LYS 80 HG1 LYS 80 8.319 -15.150 -4.940 676 HD2 LYS 80 HD2 LYS 80 9.845 -15.368 -6.857 677 HD3 LYS 80 HD1 LYS 80 10.938 -16.335 -5.865 678 HE2 LYS 80 HE2 LYS 80 9.533 -17.740 -7.292 679 HE3 LYS 80 HE1 LYS 80 9.211 -18.026 -5.584 680 HZ1 LYS 80 HZ1 LYS 80 7.187 -17.870 -6.954 681 HZ2 LYS 80 HZ2 LYS 80 7.572 -16.266 -7.322 682 HZ3 LYS 80 HZ3 LYS 80 7.234 -16.711 -5.726 683 HA PRO 81 HA PRO 81 13.968 -11.113 -2.932 684 HB2 PRO 81 HB2 PRO 81 16.545 -11.607 -3.488 685 HB3 PRO 81 HB1 PRO 81 15.752 -12.321 -2.076 686 HG2 PRO 81 HG2 PRO 81 16.320 -13.545 -4.749 687 HG3 PRO 81 HG1 PRO 81 16.528 -14.247 -3.134 688 HD2 PRO 81 HD2 PRO 81 14.374 -14.763 -4.743 689 HD3 PRO 81 HD1 PRO 81 14.315 -14.830 -2.970 690 H GLN 82 HN GLN 82 15.663 -9.600 -4.110 691 HA GLN 82 HA GLN 82 14.592 -8.894 -6.637 692 HB2 GLN 82 HB2 GLN 82 15.735 -7.267 -5.214 693 HB3 GLN 82 HB1 GLN 82 17.246 -8.153 -5.373 694 HG2 GLN 82 HG2 GLN 82 17.271 -7.671 -7.772 695 HG3 GLN 82 HG1 GLN 82 15.767 -6.769 -7.601 696 HE21 GLN 82 HE21 GLN 82 19.179 -6.812 -6.928 697 HE22 GLN 82 HE22 GLN 82 19.321 -5.135 -6.531 698 H ALA 83 HN ALA 83 17.709 -10.357 -5.783 699 HA ALA 83 HA ALA 83 17.727 -11.695 -8.394 700 HB1 ALA 83 HB1 ALA 83 19.238 -9.757 -8.495 701 HB2 ALA 83 HB2 ALA 83 20.109 -11.285 -8.625 702 HB3 ALA 83 HB3 ALA 83 20.123 -10.391 -7.107 703 H1 GLU 201 HT1 GLU 201 -5.363 7.269 14.083 704 H2 GLU 201 HT2 GLU 201 -6.557 6.383 13.280 705 H3 GLU 201 HT3 GLU 201 -6.903 7.933 13.868 706 HA GLU 201 HA GLU 201 -6.586 7.965 11.480 707 HB2 GLU 201 HB2 GLU 201 -4.245 9.277 12.872 708 HB3 GLU 201 HB1 GLU 201 -5.024 9.795 11.384 709 HG2 GLU 201 HG2 GLU 201 -6.092 9.934 14.180 710 HG3 GLU 201 HG1 GLU 201 -5.754 11.261 13.071 711 H ILE 202 HN ILE 202 -5.866 6.561 10.000 712 HA ILE 202 HA ILE 202 -3.290 5.259 10.439 713 HB ILE 202 HB ILE 202 -5.272 4.673 8.235 714 HG12 ILE 202 HG12 ILE 202 -6.437 4.256 10.288 715 HG13 ILE 202 HG11 ILE 202 -5.896 2.696 9.683 716 HG21 ILE 202 HG21 ILE 202 -3.014 3.881 7.812 717 HG22 ILE 202 HG22 ILE 202 -4.097 2.523 8.127 718 HG23 ILE 202 HG23 ILE 202 -2.985 3.075 9.381 719 HD11 ILE 202 HD11 ILE 202 -3.947 2.881 11.254 720 HD12 ILE 202 HD12 ILE 202 -5.526 2.717 12.019 721 HD13 ILE 202 HD13 ILE 202 -4.739 4.292 11.950 722 H LYS 203 HN LYS 203 -1.525 5.716 9.335 723 HA LYS 203 HA LYS 203 -1.622 7.168 6.818 724 HB2 LYS 203 HB2 LYS 203 -1.691 8.974 8.451 725 HB3 LYS 203 HB1 LYS 203 -0.337 8.277 9.322 726 HG2 LYS 203 HG2 LYS 203 1.113 8.703 7.401 727 HG3 LYS 203 HG1 LYS 203 -0.245 9.413 6.540 728 HD2 LYS 203 HD2 LYS 203 0.903 11.254 7.396 729 HD3 LYS 203 HD1 LYS 203 -0.430 11.023 8.523 730 HE2 LYS 203 HE2 LYS 203 2.314 9.880 8.993 731 HE3 LYS 203 HE1 LYS 203 1.861 11.496 9.520 732 HZ1 LYS 203 HZ1 LYS 203 0.687 8.924 10.411 733 HZ2 LYS 203 HZ2 LYS 203 0.018 10.430 10.785 734 HZ3 LYS 203 HZ3 LYS 203 1.566 10.032 11.334 735 H LEU 204 HN LEU 204 0.372 7.000 5.650 736 HA LEU 204 HA LEU 204 2.447 5.372 6.934 737 HB2 LEU 204 HB2 LEU 204 0.655 4.350 5.056 738 HB3 LEU 204 HB1 LEU 204 2.116 4.674 4.146 739 HG LEU 204 HG LEU 204 1.899 2.900 6.579 740 HD11 LEU 204 HD11 LEU 204 2.501 2.216 3.708 741 HD12 LEU 204 HD12 LEU 204 0.937 1.996 4.488 742 HD13 LEU 204 HD13 LEU 204 2.340 1.091 5.056 743 HD21 LEU 204 HD21 LEU 204 4.310 3.297 4.824 744 HD22 LEU 204 HD22 LEU 204 4.201 2.409 6.343 745 HD23 LEU 204 HD23 LEU 204 4.072 4.166 6.340 746 H LYS 205 HN LYS 205 4.186 6.607 6.885 747 HA LYS 205 HA LYS 205 4.879 8.076 4.452 748 HB2 LYS 205 HB2 LYS 205 5.969 8.014 7.252 749 HB3 LYS 205 HB1 LYS 205 6.962 8.624 5.940 750 HG2 LYS 205 HG2 LYS 205 4.253 9.703 6.688 751 HG3 LYS 205 HG1 LYS 205 5.798 10.394 7.190 752 HD2 LYS 205 HD2 LYS 205 6.318 10.459 4.658 753 HD3 LYS 205 HD1 LYS 205 4.575 10.272 4.457 754 HE2 LYS 205 HE2 LYS 205 6.040 12.486 5.870 755 HE3 LYS 205 HE1 LYS 205 5.082 12.603 4.396 756 HZ1 LYS 205 HZ1 LYS 205 3.823 13.432 6.251 757 HZ2 LYS 205 HZ2 LYS 205 4.054 12.001 7.114 758 HZ3 LYS 205 HZ3 LYS 205 3.106 11.993 5.710 759 H ILE 206 HN ILE 206 5.111 6.035 3.224 760 HA ILE 206 HA ILE 206 6.900 4.016 4.090 761 HB ILE 206 HB ILE 206 6.430 4.428 1.152 762 HG12 ILE 206 HG12 ILE 206 4.482 2.878 2.831 763 HG13 ILE 206 HG11 ILE 206 4.202 4.589 2.489 764 HG21 ILE 206 HG21 ILE 206 6.098 1.782 2.275 765 HG22 ILE 206 HG22 ILE 206 7.629 2.516 2.785 766 HG23 ILE 206 HG23 ILE 206 7.255 2.364 1.071 767 HD11 ILE 206 HD11 ILE 206 4.806 2.778 0.213 768 HD12 ILE 206 HD12 ILE 206 3.783 4.204 0.283 769 HD13 ILE 206 HD13 ILE 206 3.215 2.683 0.965 770 H THR 207 HN THR 207 8.986 4.416 4.442 771 HA THR 207 HA THR 207 10.450 6.229 2.705 772 HB THR 207 HB THR 207 12.371 5.617 4.302 773 HG1 THR 207 HG1 THR 207 11.538 4.823 6.358 774 HG21 THR 207 HG21 THR 207 9.911 6.974 5.411 775 HG22 THR 207 HG22 THR 207 11.153 7.738 4.417 776 HG23 THR 207 HG23 THR 207 11.553 7.146 6.030 777 H LYS 208 HN LYS 208 11.470 5.546 0.972 778 HA LYS 208 HA LYS 208 13.130 3.338 0.786 779 HB2 LYS 208 HB2 LYS 208 11.947 1.675 -0.395 780 HB3 LYS 208 HB1 LYS 208 10.879 2.123 0.920 781 HG2 LYS 208 HG2 LYS 208 10.599 3.317 -1.810 782 HG3 LYS 208 HG1 LYS 208 9.867 1.775 -1.394 783 HD2 LYS 208 HD2 LYS 208 8.156 2.822 -0.464 784 HD3 LYS 208 HD1 LYS 208 9.236 3.675 0.637 785 HE2 LYS 208 HE2 LYS 208 8.682 4.552 -2.185 786 HE3 LYS 208 HE1 LYS 208 7.778 5.131 -0.788 787 HZ1 LYS 208 HZ1 LYS 208 9.559 6.634 -1.438 788 HZ2 LYS 208 HZ2 LYS 208 10.707 5.425 -1.177 789 HZ3 LYS 208 HZ3 LYS 208 9.804 6.031 0.126 790 H THR 209 HN THR 209 12.790 2.702 -1.958 791 HA THR 209 HA THR 209 13.432 3.397 -4.000 792 HB THR 209 HB THR 209 12.357 5.461 -4.939 793 HG1 THR 209 HG1 THR 209 12.071 6.716 -3.099 794 HG21 THR 209 HG21 THR 209 10.378 3.637 -3.580 795 HG22 THR 209 HG22 THR 209 11.318 3.182 -5.002 796 HG23 THR 209 HG23 THR 209 10.174 4.521 -5.091 797 H ILE 210 HN ILE 210 15.069 4.209 -1.693 798 HA ILE 210 HA ILE 210 16.205 6.761 -2.444 799 HB ILE 210 HB ILE 210 17.840 6.313 -0.630 800 HG12 ILE 210 HG12 ILE 210 16.185 3.823 -0.161 801 HG13 ILE 210 HG11 ILE 210 17.814 3.834 -0.826 802 HG21 ILE 210 HG21 ILE 210 16.234 6.522 1.208 803 HG22 ILE 210 HG22 ILE 210 14.939 6.006 0.128 804 HG23 ILE 210 HG23 ILE 210 15.786 7.524 -0.172 805 HD11 ILE 210 HD11 ILE 210 17.843 3.250 1.518 806 HD12 ILE 210 HD12 ILE 210 17.012 4.751 1.924 807 HD13 ILE 210 HD13 ILE 210 18.645 4.799 1.261 808 H GLN 211 HN GLN 211 16.273 4.039 -3.967 809 HA GLN 211 HA GLN 211 17.566 3.111 -5.561 810 HB2 GLN 211 HB2 GLN 211 19.347 5.489 -5.014 811 HB3 GLN 211 HB1 GLN 211 19.609 4.339 -6.320 812 HG2 GLN 211 HG2 GLN 211 17.530 4.942 -7.349 813 HG3 GLN 211 HG1 GLN 211 17.102 5.965 -5.981 814 HE21 GLN 211 HE21 GLN 211 17.387 6.573 -8.828 815 HE22 GLN 211 HE22 GLN 211 18.537 7.861 -8.923 816 H ASN 212 HN ASN 212 19.954 2.282 -5.912 817 HA ASN 212 HA ASN 212 20.813 1.179 -3.319 818 HB2 ASN 212 HB2 ASN 212 20.829 -0.077 -6.071 819 HB3 ASN 212 HB1 ASN 212 21.665 -0.770 -4.686 820 HD21 ASN 212 HD21 ASN 212 19.426 -1.776 -6.322 821 HD22 ASN 212 HD22 ASN 212 18.161 -2.126 -5.193 Start of MODEL 19 1 H1 SER 1 HT1 SER 1 -14.436 -7.639 -14.410 2 H2 SER 1 HT2 SER 1 -14.229 -8.248 -12.848 3 H3 SER 1 HT3 SER 1 -13.564 -9.065 -14.167 4 HA SER 1 HA SER 1 -11.856 -7.898 -12.991 5 HB2 SER 1 HB2 SER 1 -12.430 -6.450 -15.582 6 HB3 SER 1 HB1 SER 1 -10.855 -6.818 -14.872 7 HG SER 1 HG SER 1 -12.554 -8.426 -16.354 8 H GLU 2 HN GLU 2 -14.719 -6.015 -13.583 9 HA GLU 2 HA GLU 2 -13.471 -3.547 -12.697 10 HB2 GLU 2 HB2 GLU 2 -15.708 -2.555 -13.066 11 HB3 GLU 2 HB1 GLU 2 -15.080 -3.359 -14.491 12 HG2 GLU 2 HG2 GLU 2 -16.475 -5.316 -13.963 13 HG3 GLU 2 HG1 GLU 2 -17.148 -4.437 -12.593 14 H GLU 3 HN GLU 3 -14.771 -6.200 -11.159 15 HA GLU 3 HA GLU 3 -16.359 -4.883 -9.184 16 HB2 GLU 3 HB2 GLU 3 -15.197 -7.669 -9.236 17 HB3 GLU 3 HB1 GLU 3 -16.312 -7.081 -8.013 18 HG2 GLU 3 HG2 GLU 3 -17.981 -6.671 -9.786 19 HG3 GLU 3 HG1 GLU 3 -16.864 -7.375 -10.953 20 H GLU 4 HN GLU 4 -12.978 -5.504 -9.519 21 HA GLU 4 HA GLU 4 -12.401 -5.158 -6.718 22 HB2 GLU 4 HB2 GLU 4 -10.038 -4.936 -7.411 23 HB3 GLU 4 HB1 GLU 4 -10.793 -6.380 -8.071 24 HG2 GLU 4 HG2 GLU 4 -11.015 -5.324 -10.229 25 HG3 GLU 4 HG1 GLU 4 -10.381 -3.810 -9.582 26 H ASP 5 HN ASP 5 -12.996 -3.090 -9.398 27 HA ASP 5 HA ASP 5 -12.014 -0.738 -8.005 28 HB2 ASP 5 HB2 ASP 5 -13.478 -0.986 -10.651 29 HB3 ASP 5 HB1 ASP 5 -12.892 0.529 -9.968 30 H LYS 6 HN LYS 6 -14.781 -2.648 -8.110 31 HA LYS 6 HA LYS 6 -16.480 -0.469 -7.114 32 HB2 LYS 6 HB2 LYS 6 -17.027 -2.102 -9.161 33 HB3 LYS 6 HB1 LYS 6 -17.701 -3.066 -7.858 34 HG2 LYS 6 HG2 LYS 6 -18.491 -0.307 -8.761 35 HG3 LYS 6 HG1 LYS 6 -19.476 -1.765 -8.713 36 HD2 LYS 6 HD2 LYS 6 -19.362 -1.722 -6.246 37 HD3 LYS 6 HD1 LYS 6 -18.441 -0.218 -6.335 38 HE2 LYS 6 HE2 LYS 6 -20.327 0.844 -7.493 39 HE3 LYS 6 HE1 LYS 6 -21.248 -0.652 -7.339 40 HZ1 LYS 6 HZ1 LYS 6 -21.840 0.903 -5.607 41 HZ2 LYS 6 HZ2 LYS 6 -20.231 1.006 -5.095 42 HZ3 LYS 6 HZ3 LYS 6 -21.079 -0.447 -4.931 43 H CYS 7 HN CYS 7 -14.506 -1.740 -5.546 44 HA CYS 7 HA CYS 7 -15.866 -3.683 -3.865 45 HB2 CYS 7 HB2 CYS 7 -13.420 -3.858 -4.533 46 HB3 CYS 7 HB1 CYS 7 -13.115 -2.508 -3.445 47 HG CYS 7 HG CYS 7 -13.510 -3.784 -1.142 48 H LYS 8 HN LYS 8 -15.956 -3.395 -1.535 49 HA LYS 8 HA LYS 8 -16.670 -0.668 -0.805 50 HB2 LYS 8 HB2 LYS 8 -17.203 -3.376 0.373 51 HB3 LYS 8 HB1 LYS 8 -17.373 -1.943 1.367 52 HG2 LYS 8 HG2 LYS 8 -19.513 -2.553 0.505 53 HG3 LYS 8 HG1 LYS 8 -18.998 -1.048 -0.250 54 HD2 LYS 8 HD2 LYS 8 -18.260 -2.337 -2.226 55 HD3 LYS 8 HD1 LYS 8 -18.879 -3.805 -1.467 56 HE2 LYS 8 HE2 LYS 8 -20.511 -1.370 -2.171 57 HE3 LYS 8 HE1 LYS 8 -20.456 -2.867 -3.097 58 HZ1 LYS 8 HZ1 LYS 8 -21.443 -2.575 -0.312 59 HZ2 LYS 8 HZ2 LYS 8 -21.352 -4.032 -1.164 60 HZ3 LYS 8 HZ3 LYS 8 -22.398 -2.811 -1.688 61 HA PRO 9 HA PRO 9 -13.032 0.157 1.549 62 HB2 PRO 9 HB2 PRO 9 -14.631 1.155 3.785 63 HB3 PRO 9 HB1 PRO 9 -13.501 2.015 2.734 64 HG2 PRO 9 HG2 PRO 9 -16.185 2.383 2.608 65 HG3 PRO 9 HG1 PRO 9 -15.117 2.560 1.207 66 HD2 PRO 9 HD2 PRO 9 -16.958 0.330 1.921 67 HD3 PRO 9 HD1 PRO 9 -16.512 0.964 0.325 68 H MET 10 HN MET 10 -11.810 -0.601 3.237 69 HA MET 10 HA MET 10 -12.984 -2.784 4.769 70 HB2 MET 10 HB2 MET 10 -10.623 -3.379 5.290 71 HB3 MET 10 HB1 MET 10 -10.985 -3.391 3.574 72 HG2 MET 10 HG2 MET 10 -9.947 -1.208 3.330 73 HG3 MET 10 HG1 MET 10 -9.572 -1.206 5.050 74 HE1 MET 10 HE1 MET 10 -9.047 -3.138 1.674 75 HE2 MET 10 HE2 MET 10 -9.403 -4.451 2.796 76 HE3 MET 10 HE3 MET 10 -7.785 -4.288 2.114 77 H SER 11 HN SER 11 -12.230 -3.000 7.041 78 HA SER 11 HA SER 11 -13.099 -0.701 8.450 79 HB2 SER 11 HB2 SER 11 -12.633 -2.092 10.479 80 HB3 SER 11 HB1 SER 11 -13.646 -2.895 9.282 81 HG SER 11 HG SER 11 -11.847 -4.067 8.589 82 H TYR 12 HN TYR 12 -11.903 0.041 10.487 83 HA TYR 12 HA TYR 12 -9.507 1.348 9.790 84 HB2 TYR 12 HB2 TYR 12 -11.087 2.058 11.591 85 HB3 TYR 12 HB1 TYR 12 -10.534 0.703 12.571 86 HD1 TYR 12 HD1 TYR 12 -7.951 0.656 13.046 87 HD2 TYR 12 HD2 TYR 12 -10.100 4.121 11.861 88 HE1 TYR 12 HE1 TYR 12 -6.193 2.069 14.024 89 HE2 TYR 12 HE2 TYR 12 -8.353 5.549 12.832 90 HH TYR 12 HH TYR 12 -6.591 5.491 14.409 91 H GLU 13 HN GLU 13 -10.122 -1.639 11.572 92 HA GLU 13 HA GLU 13 -7.530 -2.290 12.361 93 HB2 GLU 13 HB2 GLU 13 -9.506 -3.567 13.089 94 HB3 GLU 13 HB1 GLU 13 -9.728 -4.168 11.450 95 HG2 GLU 13 HG2 GLU 13 -7.557 -5.293 11.576 96 HG3 GLU 13 HG1 GLU 13 -7.377 -4.731 13.236 97 H GLU 14 HN GLU 14 -9.221 -2.913 9.336 98 HA GLU 14 HA GLU 14 -7.166 -4.540 8.220 99 HB2 GLU 14 HB2 GLU 14 -9.564 -3.171 7.007 100 HB3 GLU 14 HB1 GLU 14 -8.484 -4.212 6.089 101 HG2 GLU 14 HG2 GLU 14 -9.084 -6.116 7.367 102 HG3 GLU 14 HG1 GLU 14 -9.929 -5.126 8.560 103 H LYS 15 HN LYS 15 -8.164 -1.172 7.757 104 HA LYS 15 HA LYS 15 -6.278 -0.461 5.832 105 HB2 LYS 15 HB2 LYS 15 -7.663 1.141 7.974 106 HB3 LYS 15 HB1 LYS 15 -6.593 1.871 6.789 107 HG2 LYS 15 HG2 LYS 15 -8.013 1.344 4.999 108 HG3 LYS 15 HG1 LYS 15 -8.940 0.209 5.985 109 HD2 LYS 15 HD2 LYS 15 -10.218 1.823 6.891 110 HD3 LYS 15 HD1 LYS 15 -8.882 2.973 6.995 111 HE2 LYS 15 HE2 LYS 15 -9.067 3.402 4.600 112 HE3 LYS 15 HE1 LYS 15 -10.387 2.236 4.479 113 HZ1 LYS 15 HZ1 LYS 15 -11.745 3.620 5.844 114 HZ2 LYS 15 HZ2 LYS 15 -11.092 4.602 4.635 115 HZ3 LYS 15 HZ3 LYS 15 -10.457 4.657 6.205 116 H ARG 16 HN ARG 16 -6.078 -0.376 9.369 117 HA ARG 16 HA ARG 16 -3.460 0.665 9.477 118 HB2 ARG 16 HB2 ARG 16 -4.929 0.735 11.426 119 HB3 ARG 16 HB1 ARG 16 -4.967 -1.025 11.490 120 HG2 ARG 16 HG2 ARG 16 -2.561 -1.042 12.013 121 HG3 ARG 16 HG1 ARG 16 -2.558 0.716 11.980 122 HD2 ARG 16 HD2 ARG 16 -4.348 -0.834 13.795 123 HD3 ARG 16 HD1 ARG 16 -2.717 -0.363 14.256 124 HE ARG 16 HE ARG 16 -4.468 1.761 13.326 125 HH11 ARG 16 HH11 ARG 16 -3.134 0.031 16.054 126 HH12 ARG 16 HH12 ARG 16 -3.396 1.331 17.171 127 HH21 ARG 16 HH21 ARG 16 -4.829 3.489 14.802 128 HH22 ARG 16 HH22 ARG 16 -4.361 3.291 16.464 129 H GLN 17 HN GLN 17 -4.674 -2.668 9.383 130 HA GLN 17 HA GLN 17 -2.181 -3.931 9.697 131 HB2 GLN 17 HB2 GLN 17 -4.350 -5.088 9.963 132 HB3 GLN 17 HB1 GLN 17 -4.617 -4.936 8.230 133 HG2 GLN 17 HG2 GLN 17 -3.827 -7.153 8.767 134 HG3 GLN 17 HG1 GLN 17 -2.630 -6.280 7.809 135 HE21 GLN 17 HE21 GLN 17 -0.930 -7.517 8.494 136 HE22 GLN 17 HE22 GLN 17 -0.287 -7.416 10.097 137 H LEU 18 HN LEU 18 -3.840 -2.618 6.952 138 HA LEU 18 HA LEU 18 -2.169 -3.703 4.937 139 HB2 LEU 18 HB2 LEU 18 -4.477 -2.197 5.041 140 HB3 LEU 18 HB1 LEU 18 -3.310 -1.052 4.413 141 HG LEU 18 HG LEU 18 -3.763 -3.756 3.165 142 HD11 LEU 18 HD11 LEU 18 -5.055 -1.123 2.507 143 HD12 LEU 18 HD12 LEU 18 -5.863 -2.555 3.139 144 HD13 LEU 18 HD13 LEU 18 -5.158 -2.580 1.521 145 HD21 LEU 18 HD21 LEU 18 -1.707 -2.820 2.459 146 HD22 LEU 18 HD22 LEU 18 -2.416 -1.223 2.273 147 HD23 LEU 18 HD23 LEU 18 -2.860 -2.522 1.168 148 H SER 19 HN SER 19 -2.096 -0.676 6.770 149 HA SER 19 HA SER 19 0.247 0.375 5.665 150 HB2 SER 19 HB2 SER 19 -1.129 1.681 7.201 151 HB3 SER 19 HB1 SER 19 -0.801 0.547 8.508 152 HG SER 19 HG SER 19 1.541 1.328 7.615 153 H LEU 20 HN LEU 20 -0.276 -2.159 7.992 154 HA LEU 20 HA LEU 20 2.473 -2.380 8.764 155 HB2 LEU 20 HB2 LEU 20 0.057 -4.101 9.238 156 HB3 LEU 20 HB1 LEU 20 1.639 -4.493 9.865 157 HG LEU 20 HG LEU 20 0.145 -1.961 10.525 158 HD11 LEU 20 HD11 LEU 20 -0.791 -4.231 11.285 159 HD12 LEU 20 HD12 LEU 20 -0.579 -2.962 12.489 160 HD13 LEU 20 HD13 LEU 20 0.596 -4.274 12.371 161 HD21 LEU 20 HD21 LEU 20 2.667 -1.955 10.654 162 HD22 LEU 20 HD22 LEU 20 2.527 -3.193 11.898 163 HD23 LEU 20 HD23 LEU 20 1.828 -1.595 12.161 164 H ASP 21 HN ASP 21 0.394 -3.892 6.372 165 HA ASP 21 HA ASP 21 2.204 -6.077 5.935 166 HB2 ASP 21 HB2 ASP 21 0.662 -6.779 4.173 167 HB3 ASP 21 HB1 ASP 21 -0.161 -6.468 5.688 168 H ILE 22 HN ILE 22 1.573 -2.996 4.346 169 HA ILE 22 HA ILE 22 3.342 -3.523 2.157 170 HB ILE 22 HB ILE 22 2.369 -0.901 3.301 171 HG12 ILE 22 HG12 ILE 22 1.525 -2.240 0.732 172 HG13 ILE 22 HG11 ILE 22 0.730 -2.602 2.269 173 HG21 ILE 22 HG21 ILE 22 4.351 -0.376 2.130 174 HG22 ILE 22 HG22 ILE 22 3.015 -0.009 1.034 175 HG23 ILE 22 HG23 ILE 22 3.950 -1.487 0.819 176 HD11 ILE 22 HD11 ILE 22 0.077 -0.337 2.498 177 HD12 ILE 22 HD12 ILE 22 -0.447 -0.920 0.927 178 HD13 ILE 22 HD13 ILE 22 0.961 0.137 1.059 179 H ASN 23 HN ASN 23 3.653 -2.184 5.353 180 HA ASN 23 HA ASN 23 6.284 -1.240 5.217 181 HB2 ASN 23 HB2 ASN 23 4.812 -0.641 7.022 182 HB3 ASN 23 HB1 ASN 23 4.619 -2.320 7.492 183 HD21 ASN 23 HD21 ASN 23 6.637 0.475 7.582 184 HD22 ASN 23 HD22 ASN 23 7.758 -0.109 8.762 185 H LYS 24 HN LYS 24 5.018 -4.424 5.180 186 HA LYS 24 HA LYS 24 7.363 -5.753 6.206 187 HB2 LYS 24 HB2 LYS 24 4.869 -6.730 4.822 188 HB3 LYS 24 HB1 LYS 24 6.175 -7.812 5.289 189 HG2 LYS 24 HG2 LYS 24 5.859 -7.213 7.622 190 HG3 LYS 24 HG1 LYS 24 4.604 -6.055 7.171 191 HD2 LYS 24 HD2 LYS 24 3.284 -7.918 6.219 192 HD3 LYS 24 HD1 LYS 24 4.518 -9.046 6.781 193 HE2 LYS 24 HE2 LYS 24 2.902 -7.205 8.539 194 HE3 LYS 24 HE1 LYS 24 2.591 -8.923 8.305 195 HZ1 LYS 24 HZ1 LYS 24 5.027 -7.730 9.504 196 HZ2 LYS 24 HZ2 LYS 24 4.800 -9.381 9.221 197 HZ3 LYS 24 HZ3 LYS 24 3.812 -8.567 10.326 198 H LEU 25 HN LEU 25 6.072 -4.888 3.070 199 HA LEU 25 HA LEU 25 7.510 -6.674 1.465 200 HB2 LEU 25 HB2 LEU 25 6.569 -3.907 0.787 201 HB3 LEU 25 HB1 LEU 25 7.034 -5.122 -0.372 202 HG LEU 25 HG LEU 25 4.609 -5.069 1.388 203 HD11 LEU 25 HD11 LEU 25 5.056 -5.248 -1.569 204 HD12 LEU 25 HD12 LEU 25 4.446 -3.857 -0.682 205 HD13 LEU 25 HD13 LEU 25 3.485 -5.332 -0.783 206 HD21 LEU 25 HD21 LEU 25 5.744 -7.349 -0.167 207 HD22 LEU 25 HD22 LEU 25 4.084 -7.291 0.406 208 HD23 LEU 25 HD23 LEU 25 5.419 -7.303 1.560 209 HA PRO 26 HA PRO 26 11.719 -5.021 1.596 210 HB2 PRO 26 HB2 PRO 26 11.810 -6.591 -0.938 211 HB3 PRO 26 HB1 PRO 26 12.919 -6.615 0.443 212 HG2 PRO 26 HG2 PRO 26 11.199 -8.607 0.053 213 HG3 PRO 26 HG1 PRO 26 11.532 -8.007 1.688 214 HD2 PRO 26 HD2 PRO 26 9.160 -7.512 -0.069 215 HD3 PRO 26 HD1 PRO 26 9.232 -7.775 1.687 216 H GLY 27 HN GLY 27 12.892 -3.525 0.308 217 HA2 GLY 27 HA2 GLY 27 11.468 -1.427 -0.634 218 HA3 GLY 27 HA1 GLY 27 13.124 -1.733 -1.102 219 H GLU 28 HN GLU 28 12.736 -4.013 -2.743 220 HA GLU 28 HA GLU 28 12.057 -2.732 -5.157 221 HB2 GLU 28 HB2 GLU 28 13.637 -4.607 -5.095 222 HB3 GLU 28 HB1 GLU 28 12.375 -5.682 -4.543 223 HG2 GLU 28 HG2 GLU 28 11.201 -5.091 -6.759 224 HG3 GLU 28 HG1 GLU 28 12.797 -4.541 -7.248 225 H LYS 29 HN LYS 29 10.339 -5.184 -3.264 226 HA LYS 29 HA LYS 29 8.010 -5.279 -4.866 227 HB2 LYS 29 HB2 LYS 29 8.588 -6.012 -1.997 228 HB3 LYS 29 HB1 LYS 29 7.023 -6.290 -2.751 229 HG2 LYS 29 HG2 LYS 29 9.604 -7.423 -3.789 230 HG3 LYS 29 HG1 LYS 29 8.528 -8.267 -2.675 231 HD2 LYS 29 HD2 LYS 29 6.701 -7.952 -4.369 232 HD3 LYS 29 HD1 LYS 29 7.937 -7.389 -5.491 233 HE2 LYS 29 HE2 LYS 29 7.401 -9.780 -5.778 234 HE3 LYS 29 HE1 LYS 29 9.085 -9.496 -5.362 235 HZ1 LYS 29 HZ1 LYS 29 8.474 -10.002 -3.023 236 HZ2 LYS 29 HZ2 LYS 29 8.305 -11.313 -4.071 237 HZ3 LYS 29 HZ3 LYS 29 6.938 -10.462 -3.562 238 H LEU 30 HN LEU 30 9.006 -3.425 -2.107 239 HA LEU 30 HA LEU 30 6.573 -2.213 -1.395 240 HB2 LEU 30 HB2 LEU 30 8.543 -2.272 0.031 241 HB3 LEU 30 HB1 LEU 30 9.436 -1.292 -1.115 242 HG LEU 30 HG LEU 30 8.205 0.639 -0.584 243 HD11 LEU 30 HD11 LEU 30 6.371 -0.780 1.279 244 HD12 LEU 30 HD12 LEU 30 6.013 -0.789 -0.439 245 HD13 LEU 30 HD13 LEU 30 6.148 0.735 0.421 246 HD21 LEU 30 HD21 LEU 30 8.485 0.776 1.871 247 HD22 LEU 30 HD22 LEU 30 9.877 0.063 1.057 248 HD23 LEU 30 HD23 LEU 30 8.730 -0.969 1.911 249 H GLY 31 HN GLY 31 9.075 -1.186 -3.709 250 HA2 GLY 31 HA2 GLY 31 8.211 1.410 -4.187 251 HA3 GLY 31 HA1 GLY 31 9.025 0.408 -5.373 252 H ARG 32 HN ARG 32 6.807 -1.582 -5.305 253 HA ARG 32 HA ARG 32 5.219 -0.543 -7.393 254 HB2 ARG 32 HB2 ARG 32 5.602 -2.937 -7.125 255 HB3 ARG 32 HB1 ARG 32 4.764 -2.909 -5.581 256 HG2 ARG 32 HG2 ARG 32 3.276 -3.830 -7.219 257 HG3 ARG 32 HG1 ARG 32 2.697 -2.228 -6.780 258 HD2 ARG 32 HD2 ARG 32 2.568 -2.533 -9.188 259 HD3 ARG 32 HD1 ARG 32 3.750 -1.290 -8.784 260 HE ARG 32 HE ARG 32 4.914 -3.899 -9.086 261 HH11 ARG 32 HH11 ARG 32 3.824 -1.045 -10.792 262 HH12 ARG 32 HH12 ARG 32 4.900 -1.277 -12.134 263 HH21 ARG 32 HH21 ARG 32 6.307 -4.238 -10.874 264 HH22 ARG 32 HH22 ARG 32 6.304 -3.098 -12.183 265 H VAL 33 HN VAL 33 4.564 -1.012 -3.935 266 HA VAL 33 HA VAL 33 1.804 -0.295 -4.126 267 HB VAL 33 HB VAL 33 3.080 0.113 -1.504 268 HG11 VAL 33 HG11 VAL 33 0.780 -1.561 -2.500 269 HG12 VAL 33 HG12 VAL 33 0.683 0.068 -1.830 270 HG13 VAL 33 HG13 VAL 33 1.187 -1.272 -0.809 271 HG21 VAL 33 HG21 VAL 33 4.529 -1.658 -2.147 272 HG22 VAL 33 HG22 VAL 33 3.211 -2.548 -2.908 273 HG23 VAL 33 HG23 VAL 33 3.261 -2.378 -1.155 274 H VAL 34 HN VAL 34 4.667 1.464 -2.963 275 HA VAL 34 HA VAL 34 3.468 3.902 -2.392 276 HB VAL 34 HB VAL 34 5.620 4.364 -1.939 277 HG11 VAL 34 HG11 VAL 34 6.086 1.994 -2.204 278 HG12 VAL 34 HG12 VAL 34 7.465 3.003 -2.643 279 HG13 VAL 34 HG13 VAL 34 6.470 2.269 -3.901 280 HG21 VAL 34 HG21 VAL 34 5.471 5.820 -3.905 281 HG22 VAL 34 HG22 VAL 34 6.053 4.508 -4.921 282 HG23 VAL 34 HG23 VAL 34 7.103 5.201 -3.688 283 H HIS 35 HN HIS 35 4.443 2.550 -5.469 284 HA HIS 35 HA HIS 35 3.699 4.781 -7.052 285 HB2 HIS 35 HB2 HIS 35 5.274 2.980 -7.761 286 HB3 HIS 35 HB1 HIS 35 3.896 1.894 -7.903 287 HD1 HIS 35 HD1 HIS 35 5.430 4.939 -9.493 288 HD2 HIS 35 HD2 HIS 35 2.417 2.173 -10.238 289 HE1 HIS 35 HE1 HIS 35 4.686 5.367 -11.856 290 HE2 HIS 35 HE2 HIS 35 2.990 3.571 -12.337 291 H ILE 36 HN ILE 36 1.992 1.794 -6.133 292 HA ILE 36 HA ILE 36 -0.272 2.129 -7.735 293 HB ILE 36 HB ILE 36 -0.235 0.846 -4.993 294 HG12 ILE 36 HG12 ILE 36 0.261 -0.298 -7.747 295 HG13 ILE 36 HG11 ILE 36 1.375 -0.276 -6.391 296 HG21 ILE 36 HG21 ILE 36 -2.432 0.568 -5.279 297 HG22 ILE 36 HG22 ILE 36 -2.103 -0.347 -6.752 298 HG23 ILE 36 HG23 ILE 36 -2.348 1.397 -6.834 299 HD11 ILE 36 HD11 ILE 36 -0.206 -1.778 -5.171 300 HD12 ILE 36 HD12 ILE 36 0.529 -2.483 -6.609 301 HD13 ILE 36 HD13 ILE 36 -1.134 -1.902 -6.665 302 H ILE 37 HN ILE 37 0.208 3.128 -4.330 303 HA ILE 37 HA ILE 37 -2.344 4.286 -4.060 304 HB ILE 37 HB ILE 37 0.163 5.058 -2.553 305 HG12 ILE 37 HG12 ILE 37 -1.668 3.612 -0.951 306 HG13 ILE 37 HG11 ILE 37 -1.498 2.713 -2.454 307 HG21 ILE 37 HG21 ILE 37 -2.021 6.532 -2.675 308 HG22 ILE 37 HG22 ILE 37 -1.124 6.334 -1.167 309 HG23 ILE 37 HG23 ILE 37 -2.580 5.380 -1.462 310 HD11 ILE 37 HD11 ILE 37 0.887 2.610 -2.157 311 HD12 ILE 37 HD12 ILE 37 0.064 1.975 -0.731 312 HD13 ILE 37 HD13 ILE 37 0.770 3.588 -0.699 313 H GLN 38 HN GLN 38 0.778 5.789 -4.821 314 HA GLN 38 HA GLN 38 -0.134 8.408 -5.084 315 HB2 GLN 38 HB2 GLN 38 2.165 6.975 -6.411 316 HB3 GLN 38 HB1 GLN 38 1.891 8.700 -6.623 317 HG2 GLN 38 HG2 GLN 38 1.863 8.604 -3.949 318 HG3 GLN 38 HG1 GLN 38 2.861 7.175 -4.259 319 HE21 GLN 38 HE21 GLN 38 3.824 9.707 -3.039 320 HE22 GLN 38 HE22 GLN 38 5.024 10.319 -4.117 321 H SER 39 HN SER 39 -0.125 5.770 -7.420 322 HA SER 39 HA SER 39 -0.878 7.369 -9.642 323 HB2 SER 39 HB2 SER 39 0.195 5.214 -9.975 324 HB3 SER 39 HB1 SER 39 -1.146 4.388 -9.178 325 HG SER 39 HG SER 39 -2.387 4.682 -10.913 326 H ARG 40 HN ARG 40 -2.719 5.410 -7.316 327 HA ARG 40 HA ARG 40 -5.209 5.918 -8.677 328 HB2 ARG 40 HB2 ARG 40 -4.831 4.778 -5.916 329 HB3 ARG 40 HB1 ARG 40 -6.260 4.648 -6.930 330 HG2 ARG 40 HG2 ARG 40 -4.522 3.486 -8.569 331 HG3 ARG 40 HG1 ARG 40 -3.710 3.151 -7.037 332 HD2 ARG 40 HD2 ARG 40 -5.136 1.316 -7.521 333 HD3 ARG 40 HD1 ARG 40 -5.813 2.233 -6.180 334 HE ARG 40 HE ARG 40 -7.144 3.301 -8.210 335 HH11 ARG 40 HH11 ARG 40 -6.470 -0.052 -7.481 336 HH12 ARG 40 HH12 ARG 40 -7.887 -0.647 -8.278 337 HH21 ARG 40 HH21 ARG 40 -9.012 2.531 -9.261 338 HH22 ARG 40 HH22 ARG 40 -9.339 0.821 -9.312 339 H GLU 41 HN GLU 41 -3.524 7.161 -5.868 340 HA GLU 41 HA GLU 41 -5.705 9.086 -5.409 341 HB2 GLU 41 HB2 GLU 41 -3.455 8.342 -3.553 342 HB3 GLU 41 HB1 GLU 41 -4.842 9.344 -3.164 343 HG2 GLU 41 HG2 GLU 41 -4.817 6.394 -3.738 344 HG3 GLU 41 HG1 GLU 41 -5.112 7.182 -2.193 345 HA PRO 42 HA PRO 42 -2.350 11.538 -7.448 346 HB2 PRO 42 HB2 PRO 42 -4.618 13.325 -8.051 347 HB3 PRO 42 HB1 PRO 42 -3.418 12.625 -9.139 348 HG2 PRO 42 HG2 PRO 42 -5.952 11.762 -9.122 349 HG3 PRO 42 HG1 PRO 42 -4.595 10.649 -9.381 350 HD2 PRO 42 HD2 PRO 42 -6.212 11.125 -6.905 351 HD3 PRO 42 HD1 PRO 42 -5.622 9.594 -7.590 352 H SER 43 HN SER 43 -4.681 12.319 -5.019 353 HA SER 43 HA SER 43 -3.945 14.977 -4.456 354 HB2 SER 43 HB2 SER 43 -4.997 12.925 -2.498 355 HB3 SER 43 HB1 SER 43 -5.162 14.680 -2.399 356 HG SER 43 HG SER 43 -6.334 14.481 -4.462 357 H LEU 44 HN LEU 44 -2.554 11.906 -3.575 358 HA LEU 44 HA LEU 44 -0.631 13.287 -1.845 359 HB2 LEU 44 HB2 LEU 44 -0.158 11.063 -0.865 360 HB3 LEU 44 HB1 LEU 44 -1.794 11.614 -0.608 361 HG LEU 44 HG LEU 44 -2.280 10.140 -2.742 362 HD11 LEU 44 HD11 LEU 44 0.111 9.600 -3.081 363 HD12 LEU 44 HD12 LEU 44 -0.905 8.176 -2.864 364 HD13 LEU 44 HD13 LEU 44 0.106 8.749 -1.536 365 HD21 LEU 44 HD21 LEU 44 -3.302 9.851 -0.562 366 HD22 LEU 44 HD22 LEU 44 -1.850 9.048 0.033 367 HD23 LEU 44 HD23 LEU 44 -2.822 8.290 -1.227 368 H LYS 45 HN LYS 45 -0.783 12.777 -4.869 369 HA LYS 45 HA LYS 45 1.709 11.303 -5.174 370 HB2 LYS 45 HB2 LYS 45 0.094 10.660 -6.847 371 HB3 LYS 45 HB1 LYS 45 -0.146 12.327 -7.347 372 HG2 LYS 45 HG2 LYS 45 2.096 12.406 -8.226 373 HG3 LYS 45 HG1 LYS 45 2.417 10.770 -7.638 374 HD2 LYS 45 HD2 LYS 45 1.893 10.368 -9.841 375 HD3 LYS 45 HD1 LYS 45 0.299 10.211 -9.094 376 HE2 LYS 45 HE2 LYS 45 -0.048 11.600 -10.953 377 HE3 LYS 45 HE1 LYS 45 0.020 12.683 -9.561 378 HZ1 LYS 45 HZ1 LYS 45 1.303 13.529 -11.433 379 HZ2 LYS 45 HZ2 LYS 45 2.283 12.151 -11.404 380 HZ3 LYS 45 HZ3 LYS 45 2.293 13.222 -10.096 381 H ASN 46 HN ASN 46 0.975 14.207 -4.159 382 HA ASN 46 HA ASN 46 3.021 15.680 -5.624 383 HB2 ASN 46 HB2 ASN 46 1.248 16.496 -3.301 384 HB3 ASN 46 HB1 ASN 46 2.356 17.564 -4.154 385 HD21 ASN 46 HD21 ASN 46 -0.587 17.614 -3.805 386 HD22 ASN 46 HD22 ASN 46 -1.225 17.716 -5.411 387 H SER 47 HN SER 47 2.694 13.573 -3.050 388 HA SER 47 HA SER 47 4.739 14.527 -1.316 389 HB2 SER 47 HB2 SER 47 3.716 11.682 -1.657 390 HB3 SER 47 HB1 SER 47 4.567 12.342 -0.258 391 HG SER 47 HG SER 47 2.490 13.911 -0.700 392 H ASN 48 HN ASN 48 6.913 13.988 -1.261 393 HA ASN 48 HA ASN 48 8.210 13.345 -3.679 394 HB2 ASN 48 HB2 ASN 48 9.335 13.014 -0.882 395 HB3 ASN 48 HB1 ASN 48 10.259 13.175 -2.371 396 HD21 ASN 48 HD21 ASN 48 10.372 14.751 0.032 397 HD22 ASN 48 HD22 ASN 48 10.033 16.380 -0.434 398 HA PRO 49 HA PRO 49 7.296 9.061 -3.860 399 HB2 PRO 49 HB2 PRO 49 9.360 8.271 -5.501 400 HB3 PRO 49 HB1 PRO 49 7.849 8.990 -6.054 401 HG2 PRO 49 HG2 PRO 49 10.519 10.257 -5.640 402 HG3 PRO 49 HG1 PRO 49 9.326 10.549 -6.919 403 HD2 PRO 49 HD2 PRO 49 9.648 12.238 -4.844 404 HD3 PRO 49 HD1 PRO 49 8.062 11.957 -5.589 405 H ASP 50 HN ASP 50 10.400 10.183 -2.746 406 HA ASP 50 HA ASP 50 11.248 7.567 -1.891 407 HB2 ASP 50 HB2 ASP 50 12.428 10.236 -1.095 408 HB3 ASP 50 HB1 ASP 50 13.189 8.660 -0.951 409 H GLU 51 HN GLU 51 9.599 10.313 -0.525 410 HA GLU 51 HA GLU 51 9.290 8.889 2.034 411 HB2 GLU 51 HB2 GLU 51 10.149 11.716 1.523 412 HB3 GLU 51 HB1 GLU 51 9.133 11.410 2.926 413 HG2 GLU 51 HG2 GLU 51 10.796 9.746 3.698 414 HG3 GLU 51 HG1 GLU 51 11.814 10.184 2.333 415 H ILE 52 HN ILE 52 7.237 8.210 0.939 416 HA ILE 52 HA ILE 52 5.534 10.342 0.012 417 HB ILE 52 HB ILE 52 4.231 8.745 -1.077 418 HG12 ILE 52 HG12 ILE 52 5.457 6.479 0.413 419 HG13 ILE 52 HG11 ILE 52 4.054 7.332 1.061 420 HG21 ILE 52 HG21 ILE 52 6.882 7.350 -0.993 421 HG22 ILE 52 HG22 ILE 52 6.643 8.895 -1.825 422 HG23 ILE 52 HG23 ILE 52 5.744 7.467 -2.345 423 HD11 ILE 52 HD11 ILE 52 2.861 6.855 -1.046 424 HD12 ILE 52 HD12 ILE 52 3.314 5.401 -0.151 425 HD13 ILE 52 HD13 ILE 52 4.242 5.888 -1.569 426 H GLU 53 HN GLU 53 3.465 10.766 0.697 427 HA GLU 53 HA GLU 53 3.006 10.114 3.521 428 HB2 GLU 53 HB2 GLU 53 3.271 12.527 2.255 429 HB3 GLU 53 HB1 GLU 53 1.533 12.322 2.217 430 HG2 GLU 53 HG2 GLU 53 3.343 12.539 4.588 431 HG3 GLU 53 HG1 GLU 53 2.019 13.594 4.124 432 H ILE 54 HN ILE 54 1.496 8.476 3.646 433 HA ILE 54 HA ILE 54 -0.657 8.415 1.624 434 HB ILE 54 HB ILE 54 0.282 6.234 3.487 435 HG12 ILE 54 HG12 ILE 54 0.454 6.440 0.478 436 HG13 ILE 54 HG11 ILE 54 1.798 6.749 1.579 437 HG21 ILE 54 HG21 ILE 54 -1.239 4.814 2.086 438 HG22 ILE 54 HG22 ILE 54 -1.923 6.304 1.443 439 HG23 ILE 54 HG23 ILE 54 -2.053 5.943 3.165 440 HD11 ILE 54 HD11 ILE 54 1.780 4.498 0.532 441 HD12 ILE 54 HD12 ILE 54 0.316 4.141 1.440 442 HD13 ILE 54 HD13 ILE 54 1.823 4.484 2.288 443 H ASP 55 HN ASP 55 -2.796 8.505 2.194 444 HA ASP 55 HA ASP 55 -3.338 8.838 5.071 445 HB2 ASP 55 HB2 ASP 55 -3.541 10.966 3.726 446 HB3 ASP 55 HB1 ASP 55 -4.857 10.199 2.841 447 H PHE 56 HN PHE 56 -4.004 6.780 5.486 448 HA PHE 56 HA PHE 56 -5.260 5.166 3.573 449 HB2 PHE 56 HB2 PHE 56 -4.357 4.889 6.313 450 HB3 PHE 56 HB1 PHE 56 -5.808 3.943 5.980 451 HD1 PHE 56 HD1 PHE 56 -2.283 4.466 5.038 452 HD2 PHE 56 HD2 PHE 56 -5.768 2.106 4.489 453 HE1 PHE 56 HE1 PHE 56 -0.957 2.771 3.840 454 HE2 PHE 56 HE2 PHE 56 -4.463 0.421 3.308 455 HZ PHE 56 HZ PHE 56 -2.054 0.731 2.982 456 H GLU 57 HN GLU 57 -6.641 7.544 5.556 457 HA GLU 57 HA GLU 57 -9.242 6.283 5.620 458 HB2 GLU 57 HB2 GLU 57 -8.159 8.866 6.684 459 HB3 GLU 57 HB1 GLU 57 -9.883 8.515 6.696 460 HG2 GLU 57 HG2 GLU 57 -7.837 6.693 7.915 461 HG3 GLU 57 HG1 GLU 57 -8.622 7.988 8.816 462 H THR 58 HN THR 58 -7.540 8.007 3.352 463 HA THR 58 HA THR 58 -10.034 9.050 2.178 464 HB THR 58 HB THR 58 -8.626 10.759 1.026 465 HG1 THR 58 HG1 THR 58 -6.627 9.960 2.897 466 HG21 THR 58 HG21 THR 58 -8.550 10.696 4.035 467 HG22 THR 58 HG22 THR 58 -9.847 11.351 3.032 468 HG23 THR 58 HG23 THR 58 -8.267 12.136 3.056 469 H LEU 59 HN LEU 59 -7.557 6.808 1.779 470 HA LEU 59 HA LEU 59 -7.295 6.788 -1.049 471 HB2 LEU 59 HB2 LEU 59 -7.257 4.216 0.489 472 HB3 LEU 59 HB1 LEU 59 -6.279 4.713 -0.869 473 HG LEU 59 HG LEU 59 -5.973 5.607 1.987 474 HD11 LEU 59 HD11 LEU 59 -4.379 3.807 0.185 475 HD12 LEU 59 HD12 LEU 59 -5.067 3.460 1.772 476 HD13 LEU 59 HD13 LEU 59 -3.692 4.556 1.628 477 HD21 LEU 59 HD21 LEU 59 -4.621 6.578 -0.507 478 HD22 LEU 59 HD22 LEU 59 -3.890 6.735 1.080 479 HD23 LEU 59 HD23 LEU 59 -5.431 7.516 0.737 480 H LYS 60 HN LYS 60 -8.485 5.709 -2.622 481 HA LYS 60 HA LYS 60 -11.235 5.208 -2.177 482 HB2 LYS 60 HB2 LYS 60 -9.449 4.231 -4.421 483 HB3 LYS 60 HB1 LYS 60 -11.207 4.297 -4.465 484 HG2 LYS 60 HG2 LYS 60 -11.128 6.726 -4.334 485 HG3 LYS 60 HG1 LYS 60 -9.366 6.677 -4.226 486 HD2 LYS 60 HD2 LYS 60 -9.316 5.571 -6.445 487 HD3 LYS 60 HD1 LYS 60 -11.064 5.794 -6.555 488 HE2 LYS 60 HE2 LYS 60 -9.855 7.559 -7.744 489 HE3 LYS 60 HE1 LYS 60 -10.785 8.204 -6.393 490 HZ1 LYS 60 HZ1 LYS 60 -8.686 8.138 -5.077 491 HZ2 LYS 60 HZ2 LYS 60 -8.661 9.226 -6.369 492 HZ3 LYS 60 HZ3 LYS 60 -7.852 7.746 -6.499 493 HA PRO 61 HA PRO 61 -11.390 1.109 -0.508 494 HB2 PRO 61 HB2 PRO 61 -13.522 0.507 -2.466 495 HB3 PRO 61 HB1 PRO 61 -13.578 0.471 -0.704 496 HG2 PRO 61 HG2 PRO 61 -14.790 2.395 -2.160 497 HG3 PRO 61 HG1 PRO 61 -14.129 2.699 -0.545 498 HD2 PRO 61 HD2 PRO 61 -13.066 3.481 -3.209 499 HD3 PRO 61 HD1 PRO 61 -12.908 4.299 -1.642 500 H SER 62 HN SER 62 -11.478 1.529 -3.991 501 HA SER 62 HA SER 62 -10.684 -1.115 -4.653 502 HB2 SER 62 HB2 SER 62 -10.084 0.077 -6.877 503 HB3 SER 62 HB1 SER 62 -11.773 0.056 -6.367 504 HG SER 62 HG SER 62 -10.634 2.157 -7.051 505 H THR 63 HN THR 63 -8.979 1.901 -4.040 506 HA THR 63 HA THR 63 -6.405 1.074 -4.779 507 HB THR 63 HB THR 63 -6.939 2.972 -2.473 508 HG1 THR 63 HG1 THR 63 -7.197 4.595 -4.108 509 HG21 THR 63 HG21 THR 63 -4.599 2.336 -3.054 510 HG22 THR 63 HG22 THR 63 -4.930 4.054 -3.232 511 HG23 THR 63 HG23 THR 63 -4.848 3.019 -4.655 512 H LEU 64 HN LEU 64 -8.075 0.973 -1.645 513 HA LEU 64 HA LEU 64 -6.034 -0.195 -0.145 514 HB2 LEU 64 HB2 LEU 64 -9.031 -0.389 0.126 515 HB3 LEU 64 HB1 LEU 64 -7.915 -1.018 1.324 516 HG LEU 64 HG LEU 64 -8.044 1.881 0.498 517 HD11 LEU 64 HD11 LEU 64 -10.111 1.212 1.645 518 HD12 LEU 64 HD12 LEU 64 -9.126 2.275 2.644 519 HD13 LEU 64 HD13 LEU 64 -9.151 0.542 2.960 520 HD21 LEU 64 HD21 LEU 64 -5.885 1.318 1.319 521 HD22 LEU 64 HD22 LEU 64 -6.576 0.422 2.667 522 HD23 LEU 64 HD23 LEU 64 -6.747 2.175 2.593 523 H ARG 65 HN ARG 65 -8.464 -1.717 -2.188 524 HA ARG 65 HA ARG 65 -7.720 -4.360 -1.319 525 HB2 ARG 65 HB2 ARG 65 -9.783 -3.194 -3.050 526 HB3 ARG 65 HB1 ARG 65 -9.242 -4.777 -3.543 527 HG2 ARG 65 HG2 ARG 65 -10.356 -4.035 -0.855 528 HG3 ARG 65 HG1 ARG 65 -11.207 -4.959 -2.105 529 HD2 ARG 65 HD2 ARG 65 -9.528 -6.735 -1.886 530 HD3 ARG 65 HD1 ARG 65 -8.710 -5.810 -0.628 531 HE ARG 65 HE ARG 65 -11.519 -6.476 -0.202 532 HH11 ARG 65 HH11 ARG 65 -8.169 -7.170 0.459 533 HH12 ARG 65 HH12 ARG 65 -8.482 -7.967 1.970 534 HH21 ARG 65 HH21 ARG 65 -11.968 -7.559 1.767 535 HH22 ARG 65 HH22 ARG 65 -10.656 -8.192 2.708 536 H GLU 66 HN GLU 66 -6.648 -2.151 -3.712 537 HA GLU 66 HA GLU 66 -5.374 -4.170 -5.314 538 HB2 GLU 66 HB2 GLU 66 -6.080 -2.111 -6.362 539 HB3 GLU 66 HB1 GLU 66 -5.135 -1.157 -5.230 540 HG2 GLU 66 HG2 GLU 66 -3.956 -1.160 -7.260 541 HG3 GLU 66 HG1 GLU 66 -3.082 -2.265 -6.194 542 H LEU 67 HN LEU 67 -4.628 -2.018 -2.673 543 HA LEU 67 HA LEU 67 -1.818 -2.411 -2.675 544 HB2 LEU 67 HB2 LEU 67 -3.635 -1.559 -0.410 545 HB3 LEU 67 HB1 LEU 67 -1.901 -1.301 -0.485 546 HG LEU 67 HG LEU 67 -3.975 -0.020 -2.274 547 HD11 LEU 67 HD11 LEU 67 -2.187 1.222 -0.192 548 HD12 LEU 67 HD12 LEU 67 -3.878 0.796 0.075 549 HD13 LEU 67 HD13 LEU 67 -3.454 2.014 -1.128 550 HD21 LEU 67 HD21 LEU 67 -1.753 -0.539 -3.335 551 HD22 LEU 67 HD22 LEU 67 -1.042 0.581 -2.175 552 HD23 LEU 67 HD23 LEU 67 -2.239 1.154 -3.331 553 H GLU 68 HN GLU 68 -4.498 -3.640 -0.669 554 HA GLU 68 HA GLU 68 -2.864 -5.336 0.888 555 HB2 GLU 68 HB2 GLU 68 -5.082 -4.703 1.687 556 HB3 GLU 68 HB1 GLU 68 -5.841 -5.598 0.370 557 HG2 GLU 68 HG2 GLU 68 -4.879 -7.696 1.252 558 HG3 GLU 68 HG1 GLU 68 -4.078 -6.787 2.515 559 H ARG 69 HN ARG 69 -4.926 -6.013 -1.971 560 HA ARG 69 HA ARG 69 -4.459 -8.771 -2.032 561 HB2 ARG 69 HB2 ARG 69 -6.094 -7.724 -3.504 562 HB3 ARG 69 HB1 ARG 69 -4.804 -6.929 -4.397 563 HG2 ARG 69 HG2 ARG 69 -3.952 -9.075 -5.132 564 HG3 ARG 69 HG1 ARG 69 -5.191 -9.910 -4.203 565 HD2 ARG 69 HD2 ARG 69 -5.788 -9.697 -6.592 566 HD3 ARG 69 HD1 ARG 69 -6.905 -8.821 -5.552 567 HE ARG 69 HE ARG 69 -4.822 -7.124 -6.436 568 HH11 ARG 69 HH11 ARG 69 -7.752 -8.669 -7.559 569 HH12 ARG 69 HH12 ARG 69 -8.156 -7.389 -8.669 570 HH21 ARG 69 HH21 ARG 69 -5.362 -5.411 -7.853 571 HH22 ARG 69 HH22 ARG 69 -6.809 -5.530 -8.820 572 H TYR 70 HN TYR 70 -2.463 -6.140 -3.122 573 HA TYR 70 HA TYR 70 -0.709 -7.824 -4.646 574 HB2 TYR 70 HB2 TYR 70 -0.835 -5.583 -5.392 575 HB3 TYR 70 HB1 TYR 70 -0.574 -4.944 -3.771 576 HD1 TYR 70 HD2 TYR 70 1.085 -6.750 -6.556 577 HD2 TYR 70 HD1 TYR 70 1.555 -4.518 -2.974 578 HE1 TYR 70 HE2 TYR 70 3.503 -6.616 -6.976 579 HE2 TYR 70 HE1 TYR 70 3.974 -4.361 -3.379 580 HH TYR 70 HH TYR 70 5.703 -5.294 -4.595 581 H VAL 71 HN VAL 71 -0.626 -6.316 -1.445 582 HA VAL 71 HA VAL 71 2.024 -7.221 -0.917 583 HB VAL 71 HB VAL 71 1.633 -6.546 1.386 584 HG11 VAL 71 HG11 VAL 71 0.534 -4.170 0.440 585 HG12 VAL 71 HG12 VAL 71 1.368 -4.876 -0.938 586 HG13 VAL 71 HG13 VAL 71 2.241 -4.574 0.565 587 HG21 VAL 71 HG21 VAL 71 -0.500 -7.017 2.010 588 HG22 VAL 71 HG22 VAL 71 -1.192 -6.454 0.487 589 HG23 VAL 71 HG23 VAL 71 -0.648 -5.287 1.694 590 H THR 72 HN THR 72 -1.205 -8.373 0.058 591 HA THR 72 HA THR 72 -0.298 -10.497 1.634 592 HB THR 72 HB THR 72 -2.662 -9.613 1.540 593 HG1 THR 72 HG1 THR 72 -2.786 -11.383 2.699 594 HG21 THR 72 HG21 THR 72 -2.973 -9.680 -0.859 595 HG22 THR 72 HG22 THR 72 -4.195 -10.659 -0.050 596 HG23 THR 72 HG23 THR 72 -2.830 -11.436 -0.856 597 H SER 73 HN SER 73 -0.661 -10.179 -1.832 598 HA SER 73 HA SER 73 -0.260 -12.893 -2.497 599 HB2 SER 73 HB2 SER 73 -0.082 -12.180 -4.705 600 HB3 SER 73 HB1 SER 73 -0.966 -10.842 -3.973 601 HG SER 73 HG SER 73 0.989 -9.699 -3.811 602 H CYS 74 HN CYS 74 1.889 -10.371 -1.495 603 HA CYS 74 HA CYS 74 4.272 -11.831 -2.299 604 HB2 CYS 74 HB2 CYS 74 4.239 -9.410 -2.611 605 HB3 CYS 74 HB1 CYS 74 3.958 -9.172 -0.889 606 HG CYS 74 HG CYS 74 6.560 -10.813 -0.642 607 H LEU 75 HN LEU 75 2.905 -10.551 0.743 608 HA LEU 75 HA LEU 75 4.715 -11.576 2.550 609 HB2 LEU 75 HB2 LEU 75 1.791 -11.622 3.172 610 HB3 LEU 75 HB1 LEU 75 3.128 -11.186 4.210 611 HG LEU 75 HG LEU 75 2.256 -9.501 1.887 612 HD11 LEU 75 HD11 LEU 75 1.621 -8.928 4.744 613 HD12 LEU 75 HD12 LEU 75 0.547 -9.922 3.765 614 HD13 LEU 75 HD13 LEU 75 0.895 -8.268 3.278 615 HD21 LEU 75 HD21 LEU 75 4.560 -9.244 2.728 616 HD22 LEU 75 HD22 LEU 75 3.910 -8.869 4.322 617 HD23 LEU 75 HD23 LEU 75 3.574 -7.802 2.955 618 H ARG 76 HN ARG 76 2.019 -13.211 0.991 619 HA ARG 76 HA ARG 76 2.397 -15.575 2.645 620 HB2 ARG 76 HB2 ARG 76 0.306 -14.785 0.632 621 HB3 ARG 76 HB1 ARG 76 0.364 -16.382 1.369 622 HG2 ARG 76 HG2 ARG 76 -0.188 -15.585 3.460 623 HG3 ARG 76 HG1 ARG 76 0.364 -13.949 3.095 624 HD2 ARG 76 HD2 ARG 76 -2.060 -14.052 3.219 625 HD3 ARG 76 HD1 ARG 76 -1.524 -13.638 1.592 626 HE ARG 76 HE ARG 76 -1.995 -16.448 1.972 627 HH11 ARG 76 HH11 ARG 76 -3.457 -13.361 1.210 628 HH12 ARG 76 HH12 ARG 76 -4.787 -14.060 0.337 629 HH21 ARG 76 HH21 ARG 76 -3.740 -17.376 0.805 630 HH22 ARG 76 HH22 ARG 76 -4.929 -16.342 0.081 631 H LYS 77 HN LYS 77 3.929 -14.454 0.088 632 HA LYS 77 HA LYS 77 4.518 -17.148 -0.887 633 HB2 LYS 77 HB2 LYS 77 3.890 -14.737 -2.573 634 HB3 LYS 77 HB1 LYS 77 4.861 -16.066 -3.195 635 HG2 LYS 77 HG2 LYS 77 3.080 -17.594 -2.998 636 HG3 LYS 77 HG1 LYS 77 2.139 -16.479 -2.013 637 HD2 LYS 77 HD2 LYS 77 1.905 -14.979 -3.925 638 HD3 LYS 77 HD1 LYS 77 2.887 -16.063 -4.907 639 HE2 LYS 77 HE2 LYS 77 0.249 -16.791 -3.640 640 HE3 LYS 77 HE1 LYS 77 0.457 -16.291 -5.317 641 HZ1 LYS 77 HZ1 LYS 77 1.592 -18.718 -4.038 642 HZ2 LYS 77 HZ2 LYS 77 1.951 -18.214 -5.612 643 HZ3 LYS 77 HZ3 LYS 77 0.372 -18.663 -5.209 644 H LYS 78 HN LYS 78 6.571 -16.403 -2.686 645 HA LYS 78 HA LYS 78 8.416 -15.076 -0.840 646 HB2 LYS 78 HB2 LYS 78 8.818 -17.418 -2.642 647 HB3 LYS 78 HB1 LYS 78 10.185 -16.373 -2.293 648 HG2 LYS 78 HG2 LYS 78 10.210 -18.221 -0.772 649 HG3 LYS 78 HG1 LYS 78 9.816 -16.756 0.123 650 HD2 LYS 78 HD2 LYS 78 7.436 -17.366 0.043 651 HD3 LYS 78 HD1 LYS 78 7.855 -18.849 -0.818 652 HE2 LYS 78 HE2 LYS 78 7.513 -19.309 1.541 653 HE3 LYS 78 HE1 LYS 78 9.198 -19.576 1.101 654 HZ1 LYS 78 HZ1 LYS 78 9.755 -17.431 2.049 655 HZ2 LYS 78 HZ2 LYS 78 8.984 -18.396 3.203 656 HZ3 LYS 78 HZ3 LYS 78 8.135 -17.147 2.445 657 H ARG 79 HN ARG 79 9.426 -15.841 -4.065 658 HA ARG 79 HA ARG 79 10.280 -14.549 -5.723 659 HB2 ARG 79 HB2 ARG 79 7.885 -12.927 -4.943 660 HB3 ARG 79 HB1 ARG 79 9.040 -12.290 -6.100 661 HG2 ARG 79 HG2 ARG 79 7.435 -13.231 -7.457 662 HG3 ARG 79 HG1 ARG 79 8.654 -14.496 -7.377 663 HD2 ARG 79 HD2 ARG 79 6.249 -14.456 -5.561 664 HD3 ARG 79 HD1 ARG 79 6.220 -15.201 -7.155 665 HE ARG 79 HE ARG 79 8.404 -16.205 -5.689 666 HH11 ARG 79 HH11 ARG 79 4.920 -16.372 -5.865 667 HH12 ARG 79 HH12 ARG 79 4.828 -17.948 -5.148 668 HH21 ARG 79 HH21 ARG 79 8.294 -18.276 -4.715 669 HH22 ARG 79 HH22 ARG 79 6.745 -19.024 -4.480 670 H LYS 80 HN LYS 80 12.294 -14.136 -4.875 671 HA LYS 80 HA LYS 80 12.822 -11.461 -3.994 672 HB2 LYS 80 HB2 LYS 80 13.874 -12.120 -1.831 673 HB3 LYS 80 HB1 LYS 80 12.126 -12.282 -1.855 674 HG2 LYS 80 HG2 LYS 80 12.240 -14.632 -1.956 675 HG3 LYS 80 HG1 LYS 80 13.959 -14.607 -2.360 676 HD2 LYS 80 HD2 LYS 80 14.407 -13.605 -0.132 677 HD3 LYS 80 HD1 LYS 80 12.700 -13.806 0.260 678 HE2 LYS 80 HE2 LYS 80 12.874 -16.188 0.075 679 HE3 LYS 80 HE1 LYS 80 14.519 -16.066 -0.547 680 HZ1 LYS 80 HZ1 LYS 80 15.216 -15.156 1.580 681 HZ2 LYS 80 HZ2 LYS 80 14.505 -16.674 1.785 682 HZ3 LYS 80 HZ3 LYS 80 13.639 -15.279 2.176 683 HA PRO 81 HA PRO 81 16.362 -13.602 -6.089 684 HB2 PRO 81 HB2 PRO 81 16.585 -11.965 -8.195 685 HB3 PRO 81 HB1 PRO 81 15.398 -13.275 -8.166 686 HG2 PRO 81 HG2 PRO 81 15.006 -10.357 -7.618 687 HG3 PRO 81 HG1 PRO 81 14.004 -11.455 -8.586 688 HD2 PRO 81 HD2 PRO 81 13.426 -10.760 -6.008 689 HD3 PRO 81 HD1 PRO 81 12.933 -12.305 -6.736 690 H GLN 82 HN GLN 82 15.786 -10.909 -4.363 691 HA GLN 82 HA GLN 82 18.505 -9.842 -4.709 692 HB2 GLN 82 HB2 GLN 82 16.781 -8.164 -5.096 693 HB3 GLN 82 HB1 GLN 82 16.032 -8.537 -3.549 694 HG2 GLN 82 HG2 GLN 82 17.320 -6.478 -3.443 695 HG3 GLN 82 HG1 GLN 82 17.991 -7.710 -2.376 696 HE21 GLN 82 HE21 GLN 82 18.423 -7.701 -5.847 697 HE22 GLN 82 HE22 GLN 82 20.115 -7.351 -5.826 698 H ALA 83 HN ALA 83 19.905 -9.976 -3.073 699 HA ALA 83 HA ALA 83 18.937 -10.491 -0.363 700 HB1 ALA 83 HB1 ALA 83 20.594 -12.259 -0.018 701 HB2 ALA 83 HB2 ALA 83 21.078 -12.141 -1.711 702 HB3 ALA 83 HB3 ALA 83 19.456 -12.693 -1.294 703 H1 GLU 201 HT1 GLU 201 -6.485 9.877 9.809 704 H2 GLU 201 HT2 GLU 201 -4.991 10.304 10.466 705 H3 GLU 201 HT3 GLU 201 -6.395 10.461 11.393 706 HA GLU 201 HA GLU 201 -5.114 8.532 12.055 707 HB2 GLU 201 HB2 GLU 201 -7.790 8.067 10.748 708 HB3 GLU 201 HB1 GLU 201 -6.973 6.828 11.689 709 HG2 GLU 201 HG2 GLU 201 -7.708 9.543 12.746 710 HG3 GLU 201 HG1 GLU 201 -8.696 8.096 12.939 711 H ILE 202 HN ILE 202 -3.733 7.026 11.496 712 HA ILE 202 HA ILE 202 -2.525 5.511 10.338 713 HB ILE 202 HB ILE 202 -4.872 5.217 8.465 714 HG12 ILE 202 HG12 ILE 202 -5.720 4.992 10.727 715 HG13 ILE 202 HG11 ILE 202 -5.620 3.396 9.990 716 HG21 ILE 202 HG21 ILE 202 -2.819 4.126 7.742 717 HG22 ILE 202 HG22 ILE 202 -4.024 2.929 8.215 718 HG23 ILE 202 HG23 ILE 202 -2.686 3.309 9.299 719 HD11 ILE 202 HD11 ILE 202 -3.517 2.992 11.194 720 HD12 ILE 202 HD12 ILE 202 -4.869 3.311 12.280 721 HD13 ILE 202 HD13 ILE 202 -3.676 4.570 11.964 722 H LYS 203 HN LYS 203 -1.116 7.227 9.690 723 HA LYS 203 HA LYS 203 -1.249 7.744 6.793 724 HB2 LYS 203 HB2 LYS 203 0.469 9.233 8.778 725 HB3 LYS 203 HB1 LYS 203 0.136 9.670 7.110 726 HG2 LYS 203 HG2 LYS 203 -2.345 9.761 7.997 727 HG3 LYS 203 HG1 LYS 203 -1.538 10.006 9.535 728 HD2 LYS 203 HD2 LYS 203 -0.991 11.656 7.072 729 HD3 LYS 203 HD1 LYS 203 -2.145 12.111 8.321 730 HE2 LYS 203 HE2 LYS 203 -0.123 13.283 8.753 731 HE3 LYS 203 HE1 LYS 203 -0.275 12.025 9.973 732 HZ1 LYS 203 HZ1 LYS 203 1.378 10.749 8.944 733 HZ2 LYS 203 HZ2 LYS 203 1.983 12.325 8.929 734 HZ3 LYS 203 HZ3 LYS 203 1.337 11.654 7.514 735 H LEU 204 HN LEU 204 0.094 6.530 5.622 736 HA LEU 204 HA LEU 204 2.261 5.140 7.012 737 HB2 LEU 204 HB2 LEU 204 0.425 4.186 5.260 738 HB3 LEU 204 HB1 LEU 204 1.739 4.558 4.164 739 HG LEU 204 HG LEU 204 1.771 2.619 6.473 740 HD11 LEU 204 HD11 LEU 204 2.333 2.185 3.550 741 HD12 LEU 204 HD12 LEU 204 0.775 1.890 4.319 742 HD13 LEU 204 HD13 LEU 204 2.190 0.959 4.809 743 HD21 LEU 204 HD21 LEU 204 4.109 3.346 4.720 744 HD22 LEU 204 HD22 LEU 204 4.088 2.188 6.047 745 HD23 LEU 204 HD23 LEU 204 3.894 3.908 6.377 746 H LYS 205 HN LYS 205 4.087 6.298 7.052 747 HA LYS 205 HA LYS 205 4.967 7.754 4.696 748 HB2 LYS 205 HB2 LYS 205 5.994 7.437 7.489 749 HB3 LYS 205 HB1 LYS 205 7.099 7.957 6.229 750 HG2 LYS 205 HG2 LYS 205 4.567 9.343 7.069 751 HG3 LYS 205 HG1 LYS 205 6.220 9.856 7.419 752 HD2 LYS 205 HD2 LYS 205 6.513 9.850 4.847 753 HD3 LYS 205 HD1 LYS 205 4.750 9.852 4.804 754 HE2 LYS 205 HE2 LYS 205 6.569 11.911 6.025 755 HE3 LYS 205 HE1 LYS 205 5.481 12.111 4.654 756 HZ1 LYS 205 HZ1 LYS 205 4.478 13.092 6.568 757 HZ2 LYS 205 HZ2 LYS 205 4.710 11.695 7.488 758 HZ3 LYS 205 HZ3 LYS 205 3.607 11.681 6.205 759 H ILE 206 HN ILE 206 5.066 5.817 3.297 760 HA ILE 206 HA ILE 206 7.047 3.847 3.946 761 HB ILE 206 HB ILE 206 6.369 4.270 1.078 762 HG12 ILE 206 HG12 ILE 206 4.490 2.822 2.943 763 HG13 ILE 206 HG11 ILE 206 4.149 4.427 2.286 764 HG21 ILE 206 HG21 ILE 206 6.124 1.625 2.215 765 HG22 ILE 206 HG22 ILE 206 7.657 2.398 2.668 766 HG23 ILE 206 HG23 ILE 206 7.228 2.230 0.965 767 HD11 ILE 206 HD11 ILE 206 4.819 2.860 0.081 768 HD12 ILE 206 HD12 ILE 206 3.203 3.371 0.567 769 HD13 ILE 206 HD13 ILE 206 3.829 1.815 1.100 770 H THR 207 HN THR 207 9.131 4.256 3.967 771 HA THR 207 HA THR 207 10.171 6.384 2.222 772 HB THR 207 HB THR 207 11.689 5.251 4.552 773 HG1 THR 207 HG1 THR 207 9.275 6.259 4.804 774 HG21 THR 207 HG21 THR 207 12.166 7.849 4.622 775 HG22 THR 207 HG22 THR 207 11.669 7.753 2.932 776 HG23 THR 207 HG23 THR 207 13.034 6.792 3.507 777 H LYS 208 HN LYS 208 11.184 5.643 0.441 778 HA LYS 208 HA LYS 208 13.148 3.661 0.444 779 HB2 LYS 208 HB2 LYS 208 12.124 1.747 -0.507 780 HB3 LYS 208 HB1 LYS 208 11.138 2.201 0.868 781 HG2 LYS 208 HG2 LYS 208 10.487 2.745 -2.027 782 HG3 LYS 208 HG1 LYS 208 9.787 1.481 -1.027 783 HD2 LYS 208 HD2 LYS 208 8.153 3.005 -0.727 784 HD3 LYS 208 HD1 LYS 208 9.262 3.666 0.478 785 HE2 LYS 208 HE2 LYS 208 10.203 5.146 -1.260 786 HE3 LYS 208 HE1 LYS 208 9.006 4.533 -2.397 787 HZ1 LYS 208 HZ1 LYS 208 8.351 6.632 -1.433 788 HZ2 LYS 208 HZ2 LYS 208 8.402 5.967 0.128 789 HZ3 LYS 208 HZ3 LYS 208 7.269 5.406 -0.998 790 H THR 209 HN THR 209 12.676 2.578 -2.167 791 HA THR 209 HA THR 209 13.152 2.964 -4.321 792 HB THR 209 HB THR 209 12.047 4.850 -5.510 793 HG1 THR 209 HG1 THR 209 11.965 5.994 -3.182 794 HG21 THR 209 HG21 THR 209 10.102 3.462 -3.697 795 HG22 THR 209 HG22 THR 209 10.945 2.628 -5.000 796 HG23 THR 209 HG23 THR 209 9.860 3.970 -5.367 797 H ILE 210 HN ILE 210 15.207 3.592 -2.713 798 HA ILE 210 HA ILE 210 16.291 6.179 -3.302 799 HB ILE 210 HB ILE 210 17.784 3.710 -2.391 800 HG12 ILE 210 HG12 ILE 210 15.960 4.160 -0.838 801 HG13 ILE 210 HG11 ILE 210 17.495 4.600 -0.097 802 HG21 ILE 210 HG21 ILE 210 19.397 5.319 -1.479 803 HG22 ILE 210 HG22 ILE 210 18.451 6.643 -2.162 804 HG23 ILE 210 HG23 ILE 210 19.230 5.475 -3.229 805 HD11 ILE 210 HD11 ILE 210 15.747 6.229 0.378 806 HD12 ILE 210 HD12 ILE 210 15.545 6.518 -1.349 807 HD13 ILE 210 HD13 ILE 210 17.060 6.942 -0.556 808 H GLN 211 HN GLN 211 16.362 6.501 -5.490 809 HA GLN 211 HA GLN 211 17.214 4.448 -7.301 810 HB2 GLN 211 HB2 GLN 211 15.509 6.250 -7.794 811 HB3 GLN 211 HB1 GLN 211 16.850 7.380 -7.907 812 HG2 GLN 211 HG2 GLN 211 17.802 6.037 -9.729 813 HG3 GLN 211 HG1 GLN 211 16.416 4.953 -9.633 814 HE21 GLN 211 HE21 GLN 211 15.697 5.363 -11.691 815 HE22 GLN 211 HE22 GLN 211 15.026 6.884 -12.166 816 H ASN 212 HN ASN 212 18.699 7.169 -5.716 817 HA ASN 212 HA ASN 212 21.255 6.357 -6.906 818 HB2 ASN 212 HB2 ASN 212 20.459 8.434 -8.017 819 HB3 ASN 212 HB1 ASN 212 20.409 9.226 -6.446 820 HD21 ASN 212 HD21 ASN 212 21.899 10.771 -7.068 821 HD22 ASN 212 HD22 ASN 212 23.578 10.413 -7.263 Start of MODEL 20 1 H1 SER 1 HT1 SER 1 -11.102 -4.325 -14.922 2 H2 SER 1 HT2 SER 1 -12.710 -3.820 -14.848 3 H3 SER 1 HT3 SER 1 -11.950 -4.423 -13.464 4 HA SER 1 HA SER 1 -10.434 -2.573 -13.433 5 HB2 SER 1 HB2 SER 1 -12.050 -1.549 -15.778 6 HB3 SER 1 HB1 SER 1 -10.686 -0.737 -15.009 7 HG SER 1 HG SER 1 -10.095 -1.875 -16.925 8 H GLU 2 HN GLU 2 -13.904 -2.784 -13.904 9 HA GLU 2 HA GLU 2 -14.344 -0.413 -12.255 10 HB2 GLU 2 HB2 GLU 2 -16.312 -2.181 -13.726 11 HB3 GLU 2 HB1 GLU 2 -16.748 -0.769 -12.780 12 HG2 GLU 2 HG2 GLU 2 -14.922 -0.706 -15.166 13 HG3 GLU 2 HG1 GLU 2 -16.649 -0.350 -15.210 14 H GLU 3 HN GLU 3 -14.364 -3.842 -11.985 15 HA GLU 3 HA GLU 3 -16.265 -4.170 -9.941 16 HB2 GLU 3 HB2 GLU 3 -13.837 -5.831 -10.620 17 HB3 GLU 3 HB1 GLU 3 -15.114 -6.333 -9.521 18 HG2 GLU 3 HG2 GLU 3 -16.729 -6.251 -11.329 19 HG3 GLU 3 HG1 GLU 3 -15.477 -5.694 -12.438 20 H GLU 4 HN GLU 4 -12.901 -3.255 -9.877 21 HA GLU 4 HA GLU 4 -12.531 -3.766 -7.085 22 HB2 GLU 4 HB2 GLU 4 -10.404 -2.498 -7.346 23 HB3 GLU 4 HB1 GLU 4 -10.585 -3.794 -8.523 24 HG2 GLU 4 HG2 GLU 4 -11.507 -1.943 -10.071 25 HG3 GLU 4 HG1 GLU 4 -10.742 -0.838 -8.929 26 H ASP 5 HN ASP 5 -13.588 -0.974 -8.945 27 HA ASP 5 HA ASP 5 -13.412 0.835 -6.719 28 HB2 ASP 5 HB2 ASP 5 -14.869 1.082 -9.366 29 HB3 ASP 5 HB1 ASP 5 -14.826 2.356 -8.147 30 H LYS 6 HN LYS 6 -15.512 -1.651 -7.590 31 HA LYS 6 HA LYS 6 -17.777 -0.528 -6.129 32 HB2 LYS 6 HB2 LYS 6 -18.081 -1.806 -8.286 33 HB3 LYS 6 HB1 LYS 6 -17.577 -3.256 -7.429 34 HG2 LYS 6 HG2 LYS 6 -19.977 -3.188 -7.551 35 HG3 LYS 6 HG1 LYS 6 -19.487 -2.942 -5.872 36 HD2 LYS 6 HD2 LYS 6 -19.731 -0.501 -6.211 37 HD3 LYS 6 HD1 LYS 6 -20.336 -0.815 -7.837 38 HE2 LYS 6 HE2 LYS 6 -22.221 -2.025 -6.943 39 HE3 LYS 6 HE1 LYS 6 -21.586 -1.871 -5.306 40 HZ1 LYS 6 HZ1 LYS 6 -22.481 0.362 -7.043 41 HZ2 LYS 6 HZ2 LYS 6 -21.835 0.535 -5.491 42 HZ3 LYS 6 HZ3 LYS 6 -23.314 -0.253 -5.706 43 H CYS 7 HN CYS 7 -14.975 -1.954 -5.380 44 HA CYS 7 HA CYS 7 -15.719 -3.965 -3.521 45 HB2 CYS 7 HB2 CYS 7 -13.410 -3.577 -4.556 46 HB3 CYS 7 HB1 CYS 7 -13.213 -2.285 -3.377 47 HG CYS 7 HG CYS 7 -13.468 -5.632 -2.769 48 H LYS 8 HN LYS 8 -15.923 -3.866 -1.297 49 HA LYS 8 HA LYS 8 -16.926 -1.368 -0.279 50 HB2 LYS 8 HB2 LYS 8 -16.750 -4.169 0.790 51 HB3 LYS 8 HB1 LYS 8 -17.131 -2.834 1.861 52 HG2 LYS 8 HG2 LYS 8 -19.156 -3.899 1.148 53 HG3 LYS 8 HG1 LYS 8 -19.063 -2.279 0.461 54 HD2 LYS 8 HD2 LYS 8 -18.302 -3.233 -1.665 55 HD3 LYS 8 HD1 LYS 8 -18.400 -4.851 -0.971 56 HE2 LYS 8 HE2 LYS 8 -20.714 -2.943 -1.281 57 HE3 LYS 8 HE1 LYS 8 -20.359 -4.293 -2.354 58 HZ1 LYS 8 HZ1 LYS 8 -22.046 -4.889 -0.750 59 HZ2 LYS 8 HZ2 LYS 8 -21.020 -4.494 0.532 60 HZ3 LYS 8 HZ3 LYS 8 -20.648 -5.799 -0.476 61 HA PRO 9 HA PRO 9 -13.197 0.056 1.645 62 HB2 PRO 9 HB2 PRO 9 -14.809 1.013 3.885 63 HB3 PRO 9 HB1 PRO 9 -13.829 1.928 2.733 64 HG2 PRO 9 HG2 PRO 9 -16.545 1.975 2.715 65 HG3 PRO 9 HG1 PRO 9 -15.559 2.200 1.260 66 HD2 PRO 9 HD2 PRO 9 -17.113 -0.176 2.149 67 HD3 PRO 9 HD1 PRO 9 -16.765 0.403 0.510 68 H MET 10 HN MET 10 -11.857 -1.247 2.713 69 HA MET 10 HA MET 10 -12.753 -3.142 4.618 70 HB2 MET 10 HB2 MET 10 -10.362 -3.564 5.029 71 HB3 MET 10 HB1 MET 10 -10.765 -3.578 3.324 72 HG2 MET 10 HG2 MET 10 -9.901 -1.283 3.135 73 HG3 MET 10 HG1 MET 10 -9.420 -1.374 4.828 74 HE1 MET 10 HE1 MET 10 -9.029 -3.165 1.327 75 HE2 MET 10 HE2 MET 10 -9.236 -4.510 2.447 76 HE3 MET 10 HE3 MET 10 -7.682 -4.251 1.659 77 H SER 11 HN SER 11 -12.033 -3.234 6.839 78 HA SER 11 HA SER 11 -13.033 -0.919 8.153 79 HB2 SER 11 HB2 SER 11 -12.668 -2.315 10.228 80 HB3 SER 11 HB1 SER 11 -13.693 -3.050 8.995 81 HG SER 11 HG SER 11 -12.254 -4.603 9.605 82 H TYR 12 HN TYR 12 -11.962 -0.234 10.301 83 HA TYR 12 HA TYR 12 -9.598 1.161 9.689 84 HB2 TYR 12 HB2 TYR 12 -11.267 1.830 11.413 85 HB3 TYR 12 HB1 TYR 12 -10.716 0.503 12.430 86 HD1 TYR 12 HD1 TYR 12 -8.153 0.534 13.007 87 HD2 TYR 12 HD2 TYR 12 -10.360 3.931 11.719 88 HE1 TYR 12 HE1 TYR 12 -6.480 2.002 14.042 89 HE2 TYR 12 HE2 TYR 12 -8.691 5.412 12.750 90 HH TYR 12 HH TYR 12 -7.000 5.342 14.504 91 H GLU 13 HN GLU 13 -10.132 -1.836 11.519 92 HA GLU 13 HA GLU 13 -7.501 -2.263 12.381 93 HB2 GLU 13 HB2 GLU 13 -9.480 -3.542 13.183 94 HB3 GLU 13 HB1 GLU 13 -9.546 -4.372 11.633 95 HG2 GLU 13 HG2 GLU 13 -7.361 -5.343 12.033 96 HG3 GLU 13 HG1 GLU 13 -7.239 -4.478 13.563 97 H GLU 14 HN GLU 14 -9.125 -3.111 9.373 98 HA GLU 14 HA GLU 14 -6.937 -4.661 8.369 99 HB2 GLU 14 HB2 GLU 14 -9.330 -5.119 7.897 100 HB3 GLU 14 HB1 GLU 14 -9.389 -3.647 6.936 101 HG2 GLU 14 HG2 GLU 14 -7.939 -4.527 5.337 102 HG3 GLU 14 HG1 GLU 14 -7.472 -5.877 6.360 103 H LYS 15 HN LYS 15 -8.227 -1.383 7.750 104 HA LYS 15 HA LYS 15 -6.397 -0.594 5.811 105 HB2 LYS 15 HB2 LYS 15 -7.823 0.927 7.983 106 HB3 LYS 15 HB1 LYS 15 -6.740 1.727 6.856 107 HG2 LYS 15 HG2 LYS 15 -8.110 1.236 5.016 108 HG3 LYS 15 HG1 LYS 15 -9.044 0.055 5.946 109 HD2 LYS 15 HD2 LYS 15 -10.360 1.630 6.877 110 HD3 LYS 15 HD1 LYS 15 -9.039 2.785 7.055 111 HE2 LYS 15 HE2 LYS 15 -9.181 3.324 4.684 112 HE3 LYS 15 HE1 LYS 15 -10.468 2.137 4.473 113 HZ1 LYS 15 HZ1 LYS 15 -11.877 3.432 5.914 114 HZ2 LYS 15 HZ2 LYS 15 -11.286 4.436 4.689 115 HZ3 LYS 15 HZ3 LYS 15 -10.623 4.523 6.249 116 H ARG 16 HN ARG 16 -6.130 -0.367 9.352 117 HA ARG 16 HA ARG 16 -3.582 0.813 9.390 118 HB2 ARG 16 HB2 ARG 16 -5.081 0.821 11.343 119 HB3 ARG 16 HB1 ARG 16 -4.916 -0.927 11.485 120 HG2 ARG 16 HG2 ARG 16 -2.491 -0.608 11.930 121 HG3 ARG 16 HG1 ARG 16 -2.758 1.130 11.915 122 HD2 ARG 16 HD2 ARG 16 -4.285 -0.672 13.736 123 HD3 ARG 16 HD1 ARG 16 -2.712 -0.031 14.177 124 HE ARG 16 HE ARG 16 -4.479 2.035 13.343 125 HH11 ARG 16 HH11 ARG 16 -3.749 -0.086 16.025 126 HH12 ARG 16 HH12 ARG 16 -4.357 1.006 17.227 127 HH21 ARG 16 HH21 ARG 16 -5.275 3.499 14.941 128 HH22 ARG 16 HH22 ARG 16 -5.209 3.042 16.614 129 H GLN 17 HN GLN 17 -4.589 -2.581 9.368 130 HA GLN 17 HA GLN 17 -1.988 -3.636 9.733 131 HB2 GLN 17 HB2 GLN 17 -4.175 -4.855 10.136 132 HB3 GLN 17 HB1 GLN 17 -4.310 -5.017 8.391 133 HG2 GLN 17 HG2 GLN 17 -3.419 -7.041 9.346 134 HG3 GLN 17 HG1 GLN 17 -2.196 -6.250 8.354 135 HE21 GLN 17 HE21 GLN 17 -0.503 -7.273 9.410 136 HE22 GLN 17 HE22 GLN 17 -0.029 -6.849 11.018 137 H LEU 18 HN LEU 18 -3.774 -2.484 7.029 138 HA LEU 18 HA LEU 18 -2.190 -3.660 4.975 139 HB2 LEU 18 HB2 LEU 18 -4.548 -2.314 5.045 140 HB3 LEU 18 HB1 LEU 18 -3.482 -1.039 4.500 141 HG LEU 18 HG LEU 18 -3.785 -3.701 3.106 142 HD11 LEU 18 HD11 LEU 18 -5.006 -1.037 2.434 143 HD12 LEU 18 HD12 LEU 18 -5.870 -2.446 3.042 144 HD13 LEU 18 HD13 LEU 18 -5.103 -2.495 1.454 145 HD21 LEU 18 HD21 LEU 18 -1.701 -2.779 2.522 146 HD22 LEU 18 HD22 LEU 18 -2.364 -1.157 2.397 147 HD23 LEU 18 HD23 LEU 18 -2.791 -2.382 1.206 148 H SER 19 HN SER 19 -2.113 -0.581 6.715 149 HA SER 19 HA SER 19 0.127 0.508 5.434 150 HB2 SER 19 HB2 SER 19 -0.525 0.759 8.383 151 HB3 SER 19 HB1 SER 19 0.373 1.908 7.391 152 HG SER 19 HG SER 19 -2.036 1.422 6.298 153 H LEU 20 HN LEU 20 -0.207 -1.892 7.940 154 HA LEU 20 HA LEU 20 2.583 -2.048 8.531 155 HB2 LEU 20 HB2 LEU 20 0.225 -3.749 9.266 156 HB3 LEU 20 HB1 LEU 20 1.848 -4.120 9.787 157 HG LEU 20 HG LEU 20 0.421 -1.549 10.436 158 HD11 LEU 20 HD11 LEU 20 -0.469 -3.765 11.376 159 HD12 LEU 20 HD12 LEU 20 -0.146 -2.446 12.500 160 HD13 LEU 20 HD13 LEU 20 1.003 -3.778 12.347 161 HD21 LEU 20 HD21 LEU 20 2.946 -1.551 10.368 162 HD22 LEU 20 HD22 LEU 20 2.900 -2.732 11.675 163 HD23 LEU 20 HD23 LEU 20 2.228 -1.120 11.919 164 H ASP 21 HN ASP 21 0.432 -3.681 6.293 165 HA ASP 21 HA ASP 21 2.264 -5.869 5.907 166 HB2 ASP 21 HB2 ASP 21 0.677 -6.695 4.236 167 HB3 ASP 21 HB1 ASP 21 -0.095 -6.333 5.768 168 H ILE 22 HN ILE 22 1.532 -2.862 4.228 169 HA ILE 22 HA ILE 22 3.217 -3.435 1.988 170 HB ILE 22 HB ILE 22 2.336 -0.769 3.104 171 HG12 ILE 22 HG12 ILE 22 1.305 -2.189 0.649 172 HG13 ILE 22 HG11 ILE 22 0.591 -2.458 2.242 173 HG21 ILE 22 HG21 ILE 22 4.240 -0.309 1.797 174 HG22 ILE 22 HG22 ILE 22 2.848 0.014 0.757 175 HG23 ILE 22 HG23 ILE 22 3.761 -1.480 0.564 176 HD11 ILE 22 HD11 ILE 22 0.102 -0.105 2.400 177 HD12 ILE 22 HD12 ILE 22 -0.652 -0.813 0.981 178 HD13 ILE 22 HD13 ILE 22 0.800 0.178 0.814 179 H ASN 23 HN ASN 23 3.666 -1.959 5.121 180 HA ASN 23 HA ASN 23 6.286 -1.029 4.807 181 HB2 ASN 23 HB2 ASN 23 5.056 -0.262 6.672 182 HB3 ASN 23 HB1 ASN 23 4.659 -1.891 7.187 183 HD21 ASN 23 HD21 ASN 23 7.014 0.624 7.188 184 HD22 ASN 23 HD22 ASN 23 8.098 -0.093 8.331 185 H LYS 24 HN LYS 24 5.009 -4.214 5.138 186 HA LYS 24 HA LYS 24 7.419 -5.459 6.085 187 HB2 LYS 24 HB2 LYS 24 4.829 -6.525 4.983 188 HB3 LYS 24 HB1 LYS 24 6.178 -7.584 5.378 189 HG2 LYS 24 HG2 LYS 24 6.106 -6.857 7.686 190 HG3 LYS 24 HG1 LYS 24 4.818 -5.711 7.305 191 HD2 LYS 24 HD2 LYS 24 3.379 -7.585 6.631 192 HD3 LYS 24 HD1 LYS 24 4.662 -8.714 7.071 193 HE2 LYS 24 HE2 LYS 24 3.299 -6.789 8.950 194 HE3 LYS 24 HE1 LYS 24 2.976 -8.517 8.839 195 HZ1 LYS 24 HZ1 LYS 24 4.480 -7.953 10.664 196 HZ2 LYS 24 HZ2 LYS 24 5.594 -7.326 9.562 197 HZ3 LYS 24 HZ3 LYS 24 5.220 -8.974 9.537 198 H LEU 25 HN LEU 25 6.058 -4.690 2.980 199 HA LEU 25 HA LEU 25 7.459 -6.565 1.405 200 HB2 LEU 25 HB2 LEU 25 6.502 -3.824 0.650 201 HB3 LEU 25 HB1 LEU 25 6.945 -5.078 -0.471 202 HG LEU 25 HG LEU 25 4.553 -4.967 1.331 203 HD11 LEU 25 HD11 LEU 25 4.946 -5.250 -1.626 204 HD12 LEU 25 HD12 LEU 25 4.353 -3.827 -0.779 205 HD13 LEU 25 HD13 LEU 25 3.390 -5.305 -0.809 206 HD21 LEU 25 HD21 LEU 25 5.714 -7.282 -0.142 207 HD22 LEU 25 HD22 LEU 25 4.035 -7.226 0.381 208 HD23 LEU 25 HD23 LEU 25 5.337 -7.188 1.573 209 HA PRO 26 HA PRO 26 11.653 -4.872 1.491 210 HB2 PRO 26 HB2 PRO 26 11.789 -6.488 -1.011 211 HB3 PRO 26 HB1 PRO 26 12.872 -6.486 0.389 212 HG2 PRO 26 HG2 PRO 26 11.170 -8.491 -0.001 213 HG3 PRO 26 HG1 PRO 26 11.474 -7.865 1.631 214 HD2 PRO 26 HD2 PRO 26 9.128 -7.403 -0.175 215 HD3 PRO 26 HD1 PRO 26 9.171 -7.650 1.585 216 H GLY 27 HN GLY 27 12.818 -3.373 0.179 217 HA2 GLY 27 HA2 GLY 27 11.374 -1.328 -0.852 218 HA3 GLY 27 HA1 GLY 27 13.036 -1.627 -1.307 219 H GLU 28 HN GLU 28 12.715 -3.967 -2.829 220 HA GLU 28 HA GLU 28 12.001 -3.007 -5.345 221 HB2 GLU 28 HB2 GLU 28 13.407 -4.998 -4.981 222 HB3 GLU 28 HB1 GLU 28 12.008 -5.873 -4.378 223 HG2 GLU 28 HG2 GLU 28 12.378 -6.557 -6.619 224 HG3 GLU 28 HG1 GLU 28 10.934 -5.544 -6.602 225 H LYS 29 HN LYS 29 10.205 -5.329 -3.358 226 HA LYS 29 HA LYS 29 7.878 -5.375 -4.943 227 HB2 LYS 29 HB2 LYS 29 8.402 -6.062 -2.056 228 HB3 LYS 29 HB1 LYS 29 6.860 -6.354 -2.847 229 HG2 LYS 29 HG2 LYS 29 9.469 -7.499 -3.797 230 HG3 LYS 29 HG1 LYS 29 8.356 -8.336 -2.715 231 HD2 LYS 29 HD2 LYS 29 6.588 -7.957 -4.499 232 HD3 LYS 29 HD1 LYS 29 7.910 -7.510 -5.575 233 HE2 LYS 29 HE2 LYS 29 7.313 -9.853 -5.857 234 HE3 LYS 29 HE1 LYS 29 8.946 -9.695 -5.208 235 HZ1 LYS 29 HZ1 LYS 29 6.550 -10.189 -3.534 236 HZ2 LYS 29 HZ2 LYS 29 8.168 -10.252 -3.045 237 HZ3 LYS 29 HZ3 LYS 29 7.558 -11.415 -4.103 238 H LEU 30 HN LEU 30 8.910 -3.459 -2.254 239 HA LEU 30 HA LEU 30 6.488 -2.248 -1.528 240 HB2 LEU 30 HB2 LEU 30 8.534 -2.227 -0.172 241 HB3 LEU 30 HB1 LEU 30 9.322 -1.206 -1.353 242 HG LEU 30 HG LEU 30 8.057 0.658 -0.751 243 HD11 LEU 30 HD11 LEU 30 6.270 -0.751 1.136 244 HD12 LEU 30 HD12 LEU 30 5.923 -0.930 -0.573 245 HD13 LEU 30 HD13 LEU 30 5.972 0.666 0.146 246 HD21 LEU 30 HD21 LEU 30 8.352 0.813 1.675 247 HD22 LEU 30 HD22 LEU 30 9.740 0.049 0.903 248 HD23 LEU 30 HD23 LEU 30 8.555 -0.936 1.760 249 H GLY 31 HN GLY 31 8.906 -1.327 -3.958 250 HA2 GLY 31 HA2 GLY 31 8.072 1.269 -4.492 251 HA3 GLY 31 HA1 GLY 31 8.828 0.214 -5.669 252 H ARG 32 HN ARG 32 6.611 -1.743 -5.545 253 HA ARG 32 HA ARG 32 4.969 -0.701 -7.578 254 HB2 ARG 32 HB2 ARG 32 5.263 -3.100 -7.332 255 HB3 ARG 32 HB1 ARG 32 4.541 -3.046 -5.731 256 HG2 ARG 32 HG2 ARG 32 2.918 -3.925 -7.272 257 HG3 ARG 32 HG1 ARG 32 2.408 -2.319 -6.766 258 HD2 ARG 32 HD2 ARG 32 2.052 -2.485 -9.123 259 HD3 ARG 32 HD1 ARG 32 3.423 -1.409 -8.858 260 HE ARG 32 HE ARG 32 4.460 -3.958 -9.221 261 HH11 ARG 32 HH11 ARG 32 2.625 -1.628 -11.065 262 HH12 ARG 32 HH12 ARG 32 3.219 -2.178 -12.598 263 HH21 ARG 32 HH21 ARG 32 5.259 -4.682 -11.242 264 HH22 ARG 32 HH22 ARG 32 4.720 -3.913 -12.700 265 H VAL 33 HN VAL 33 4.450 -1.059 -4.090 266 HA VAL 33 HA VAL 33 1.683 -0.309 -4.209 267 HB VAL 33 HB VAL 33 3.075 0.025 -1.634 268 HG11 VAL 33 HG11 VAL 33 0.672 -1.569 -2.509 269 HG12 VAL 33 HG12 VAL 33 0.648 0.100 -1.931 270 HG13 VAL 33 HG13 VAL 33 1.140 -1.195 -0.851 271 HG21 VAL 33 HG21 VAL 33 4.397 -1.806 -2.346 272 HG22 VAL 33 HG22 VAL 33 3.013 -2.604 -3.090 273 HG23 VAL 33 HG23 VAL 33 3.120 -2.482 -1.336 274 H VAL 34 HN VAL 34 4.611 1.391 -3.096 275 HA VAL 34 HA VAL 34 3.479 3.859 -2.507 276 HB VAL 34 HB VAL 34 5.656 4.265 -2.115 277 HG11 VAL 34 HG11 VAL 34 6.149 1.955 -2.307 278 HG12 VAL 34 HG12 VAL 34 7.470 2.891 -3.002 279 HG13 VAL 34 HG13 VAL 34 6.305 2.086 -4.055 280 HG21 VAL 34 HG21 VAL 34 5.482 5.721 -4.067 281 HG22 VAL 34 HG22 VAL 34 6.006 4.405 -5.103 282 HG23 VAL 34 HG23 VAL 34 7.106 5.073 -3.898 283 H HIS 35 HN HIS 35 4.406 2.486 -5.602 284 HA HIS 35 HA HIS 35 3.666 4.712 -7.189 285 HB2 HIS 35 HB2 HIS 35 5.161 2.930 -7.995 286 HB3 HIS 35 HB1 HIS 35 3.813 1.800 -7.967 287 HD1 HIS 35 HD1 HIS 35 4.989 4.898 -9.787 288 HD2 HIS 35 HD2 HIS 35 2.249 1.808 -10.229 289 HE1 HIS 35 HE1 HIS 35 4.081 5.132 -12.118 290 HE2 HIS 35 HE2 HIS 35 2.326 3.334 -12.315 291 H ILE 36 HN ILE 36 1.888 1.768 -6.242 292 HA ILE 36 HA ILE 36 -0.410 2.196 -7.760 293 HB ILE 36 HB ILE 36 -0.337 0.931 -5.007 294 HG12 ILE 36 HG12 ILE 36 -0.002 -0.255 -7.769 295 HG13 ILE 36 HG11 ILE 36 1.174 -0.258 -6.468 296 HG21 ILE 36 HG21 ILE 36 -2.529 0.527 -5.231 297 HG22 ILE 36 HG22 ILE 36 -2.318 -0.055 -6.881 298 HG23 ILE 36 HG23 ILE 36 -2.513 1.668 -6.573 299 HD11 ILE 36 HD11 ILE 36 -0.372 -1.702 -5.157 300 HD12 ILE 36 HD12 ILE 36 0.227 -2.437 -6.643 301 HD13 ILE 36 HD13 ILE 36 -1.407 -1.786 -6.580 302 H ILE 37 HN ILE 37 0.124 3.133 -4.335 303 HA ILE 37 HA ILE 37 -2.351 4.409 -4.043 304 HB ILE 37 HB ILE 37 0.200 5.100 -2.577 305 HG12 ILE 37 HG12 ILE 37 -1.655 3.680 -0.962 306 HG13 ILE 37 HG11 ILE 37 -1.493 2.783 -2.469 307 HG21 ILE 37 HG21 ILE 37 -1.953 6.627 -2.652 308 HG22 ILE 37 HG22 ILE 37 -1.031 6.403 -1.167 309 HG23 ILE 37 HG23 ILE 37 -2.513 5.482 -1.432 310 HD11 ILE 37 HD11 ILE 37 0.900 2.667 -2.165 311 HD12 ILE 37 HD12 ILE 37 0.060 2.010 -0.760 312 HD13 ILE 37 HD13 ILE 37 0.777 3.621 -0.688 313 H GLN 38 HN GLN 38 0.813 5.811 -4.813 314 HA GLN 38 HA GLN 38 0.033 8.463 -5.090 315 HB2 GLN 38 HB2 GLN 38 2.237 6.863 -6.359 316 HB3 GLN 38 HB1 GLN 38 2.031 8.566 -6.739 317 HG2 GLN 38 HG2 GLN 38 1.984 8.551 -3.985 318 HG3 GLN 38 HG1 GLN 38 3.140 7.277 -4.364 319 HE21 GLN 38 HE21 GLN 38 4.826 8.514 -3.513 320 HE22 GLN 38 HE22 GLN 38 5.491 9.863 -4.360 321 H SER 39 HN SER 39 -0.243 5.817 -7.381 322 HA SER 39 HA SER 39 -0.944 7.557 -9.558 323 HB2 SER 39 HB2 SER 39 0.202 5.377 -9.909 324 HB3 SER 39 HB1 SER 39 -1.260 4.554 -9.366 325 HG SER 39 HG SER 39 -1.407 6.434 -11.455 326 H ARG 40 HN ARG 40 -2.705 5.618 -7.189 327 HA ARG 40 HA ARG 40 -5.211 6.023 -8.581 328 HB2 ARG 40 HB2 ARG 40 -4.846 4.882 -5.825 329 HB3 ARG 40 HB1 ARG 40 -6.233 4.694 -6.882 330 HG2 ARG 40 HG2 ARG 40 -4.390 3.612 -8.470 331 HG3 ARG 40 HG1 ARG 40 -3.623 3.299 -6.910 332 HD2 ARG 40 HD2 ARG 40 -4.954 1.411 -7.500 333 HD3 ARG 40 HD1 ARG 40 -5.684 2.250 -6.137 334 HE ARG 40 HE ARG 40 -7.030 3.330 -8.153 335 HH11 ARG 40 HH11 ARG 40 -6.243 -0.010 -7.488 336 HH12 ARG 40 HH12 ARG 40 -7.608 -0.641 -8.359 337 HH21 ARG 40 HH21 ARG 40 -8.836 2.509 -9.274 338 HH22 ARG 40 HH22 ARG 40 -9.084 0.794 -9.363 339 H GLU 41 HN GLU 41 -3.558 7.289 -5.755 340 HA GLU 41 HA GLU 41 -5.793 9.142 -5.284 341 HB2 GLU 41 HB2 GLU 41 -3.469 8.489 -3.490 342 HB3 GLU 41 HB1 GLU 41 -4.822 9.529 -3.083 343 HG2 GLU 41 HG2 GLU 41 -4.812 6.559 -3.489 344 HG3 GLU 41 HG1 GLU 41 -5.196 7.465 -2.029 345 HA PRO 42 HA PRO 42 -2.895 12.012 -7.370 346 HB2 PRO 42 HB2 PRO 42 -5.310 13.715 -7.247 347 HB3 PRO 42 HB1 PRO 42 -4.282 13.320 -8.628 348 HG2 PRO 42 HG2 PRO 42 -6.720 12.261 -8.369 349 HG3 PRO 42 HG1 PRO 42 -5.372 11.326 -9.039 350 HD2 PRO 42 HD2 PRO 42 -6.589 11.210 -6.310 351 HD3 PRO 42 HD1 PRO 42 -5.994 9.891 -7.341 352 H SER 43 HN SER 43 -4.835 12.310 -4.517 353 HA SER 43 HA SER 43 -4.224 14.921 -3.722 354 HB2 SER 43 HB2 SER 43 -4.781 12.556 -1.923 355 HB3 SER 43 HB1 SER 43 -5.029 14.260 -1.540 356 HG SER 43 HG SER 43 -6.835 12.736 -2.432 357 H LEU 44 HN LEU 44 -2.322 12.026 -3.583 358 HA LEU 44 HA LEU 44 -0.378 13.418 -1.872 359 HB2 LEU 44 HB2 LEU 44 0.249 11.207 -0.950 360 HB3 LEU 44 HB1 LEU 44 -1.388 11.689 -0.564 361 HG LEU 44 HG LEU 44 -1.936 10.218 -2.709 362 HD11 LEU 44 HD11 LEU 44 0.432 9.715 -3.154 363 HD12 LEU 44 HD12 LEU 44 -0.524 8.266 -2.843 364 HD13 LEU 44 HD13 LEU 44 0.536 8.909 -1.589 365 HD21 LEU 44 HD21 LEU 44 -2.877 9.910 -0.493 366 HD22 LEU 44 HD22 LEU 44 -1.389 9.137 0.051 367 HD23 LEU 44 HD23 LEU 44 -2.389 8.360 -1.176 368 H LYS 45 HN LYS 45 -0.786 12.849 -4.893 369 HA LYS 45 HA LYS 45 1.433 11.199 -5.613 370 HB2 LYS 45 HB2 LYS 45 0.959 11.723 -7.869 371 HB3 LYS 45 HB1 LYS 45 -0.596 11.617 -7.061 372 HG2 LYS 45 HG2 LYS 45 -0.655 14.070 -6.931 373 HG3 LYS 45 HG1 LYS 45 0.884 14.127 -7.808 374 HD2 LYS 45 HD2 LYS 45 -0.292 12.701 -9.558 375 HD3 LYS 45 HD1 LYS 45 -1.794 13.195 -8.774 376 HE2 LYS 45 HE2 LYS 45 -1.213 15.531 -9.119 377 HE3 LYS 45 HE1 LYS 45 0.311 15.043 -9.858 378 HZ1 LYS 45 HZ1 LYS 45 -1.337 15.600 -11.525 379 HZ2 LYS 45 HZ2 LYS 45 -2.397 14.436 -10.914 380 HZ3 LYS 45 HZ3 LYS 45 -0.937 13.959 -11.624 381 H ASN 46 HN ASN 46 1.291 14.289 -4.433 382 HA ASN 46 HA ASN 46 3.627 15.222 -5.906 383 HB2 ASN 46 HB2 ASN 46 3.235 17.360 -4.792 384 HB3 ASN 46 HB1 ASN 46 1.750 16.784 -5.539 385 HD21 ASN 46 HD21 ASN 46 3.421 17.395 -2.605 386 HD22 ASN 46 HD22 ASN 46 2.067 17.249 -1.537 387 H SER 47 HN SER 47 2.948 13.424 -3.183 388 HA SER 47 HA SER 47 4.943 14.341 -1.392 389 HB2 SER 47 HB2 SER 47 3.794 11.536 -1.627 390 HB3 SER 47 HB1 SER 47 4.596 12.243 -0.221 391 HG SER 47 HG SER 47 2.772 13.928 -0.588 392 H ASN 48 HN ASN 48 7.109 13.992 -1.395 393 HA ASN 48 HA ASN 48 8.481 13.107 -3.648 394 HB2 ASN 48 HB2 ASN 48 9.482 13.058 -0.784 395 HB3 ASN 48 HB1 ASN 48 10.486 13.042 -2.227 396 HD21 ASN 48 HD21 ASN 48 10.507 14.896 -0.042 397 HD22 ASN 48 HD22 ASN 48 10.188 16.456 -0.720 398 HA PRO 49 HA PRO 49 7.733 8.787 -3.623 399 HB2 PRO 49 HB2 PRO 49 10.010 7.992 -4.992 400 HB3 PRO 49 HB1 PRO 49 8.509 8.546 -5.731 401 HG2 PRO 49 HG2 PRO 49 11.042 10.029 -5.239 402 HG3 PRO 49 HG1 PRO 49 9.915 10.148 -6.601 403 HD2 PRO 49 HD2 PRO 49 10.009 11.997 -4.648 404 HD3 PRO 49 HD1 PRO 49 8.495 11.571 -5.465 405 H ASP 50 HN ASP 50 10.696 10.066 -2.316 406 HA ASP 50 HA ASP 50 11.479 7.549 -1.138 407 HB2 ASP 50 HB2 ASP 50 12.569 10.321 -0.646 408 HB3 ASP 50 HB1 ASP 50 13.309 8.816 -0.127 409 H GLU 51 HN GLU 51 9.601 10.299 -0.297 410 HA GLU 51 HA GLU 51 9.273 9.365 2.479 411 HB2 GLU 51 HB2 GLU 51 10.144 12.008 1.460 412 HB3 GLU 51 HB1 GLU 51 8.872 12.079 2.669 413 HG2 GLU 51 HG2 GLU 51 11.410 10.548 3.098 414 HG3 GLU 51 HG1 GLU 51 11.267 12.261 3.473 415 H ILE 52 HN ILE 52 7.406 8.384 1.052 416 HA ILE 52 HA ILE 52 5.515 10.338 0.091 417 HB ILE 52 HB ILE 52 4.399 8.638 -1.027 418 HG12 ILE 52 HG12 ILE 52 5.717 6.504 0.572 419 HG13 ILE 52 HG11 ILE 52 4.193 7.235 1.084 420 HG21 ILE 52 HG21 ILE 52 7.117 7.405 -0.834 421 HG22 ILE 52 HG22 ILE 52 6.839 8.941 -1.669 422 HG23 ILE 52 HG23 ILE 52 6.034 7.473 -2.232 423 HD11 ILE 52 HD11 ILE 52 3.229 6.634 -1.099 424 HD12 ILE 52 HD12 ILE 52 3.743 5.230 -0.156 425 HD13 ILE 52 HD13 ILE 52 4.730 5.799 -1.499 426 H GLU 53 HN GLU 53 3.326 10.452 0.696 427 HA GLU 53 HA GLU 53 2.945 9.850 3.550 428 HB2 GLU 53 HB2 GLU 53 3.235 12.274 2.374 429 HB3 GLU 53 HB1 GLU 53 1.494 12.087 2.272 430 HG2 GLU 53 HG2 GLU 53 3.204 12.111 4.738 431 HG3 GLU 53 HG1 GLU 53 2.031 13.320 4.236 432 H ILE 54 HN ILE 54 1.479 8.223 3.692 433 HA ILE 54 HA ILE 54 -0.663 8.030 1.671 434 HB ILE 54 HB ILE 54 -0.178 6.044 3.890 435 HG12 ILE 54 HG12 ILE 54 1.895 6.208 2.517 436 HG13 ILE 54 HG11 ILE 54 1.100 4.639 2.389 437 HG21 ILE 54 HG21 ILE 54 -1.366 4.522 2.367 438 HG22 ILE 54 HG22 ILE 54 -1.585 5.858 1.237 439 HG23 ILE 54 HG23 ILE 54 -2.335 5.919 2.833 440 HD11 ILE 54 HD11 ILE 54 1.787 5.148 0.255 441 HD12 ILE 54 HD12 ILE 54 1.242 6.829 0.362 442 HD13 ILE 54 HD13 ILE 54 0.060 5.520 0.261 443 H ASP 55 HN ASP 55 -2.817 8.362 2.197 444 HA ASP 55 HA ASP 55 -3.399 8.783 5.063 445 HB2 ASP 55 HB2 ASP 55 -3.533 10.890 3.681 446 HB3 ASP 55 HB1 ASP 55 -4.838 10.137 2.770 447 H PHE 56 HN PHE 56 -4.170 6.769 5.533 448 HA PHE 56 HA PHE 56 -5.421 5.161 3.593 449 HB2 PHE 56 HB2 PHE 56 -4.561 4.878 6.352 450 HB3 PHE 56 HB1 PHE 56 -5.992 3.923 5.967 451 HD1 PHE 56 HD1 PHE 56 -2.466 4.544 5.047 452 HD2 PHE 56 HD2 PHE 56 -5.867 2.055 4.559 453 HE1 PHE 56 HE1 PHE 56 -1.082 2.870 3.881 454 HE2 PHE 56 HE2 PHE 56 -4.508 0.395 3.408 455 HZ PHE 56 HZ PHE 56 -2.107 0.778 3.069 456 H GLU 57 HN GLU 57 -6.785 7.580 5.545 457 HA GLU 57 HA GLU 57 -9.418 6.368 5.504 458 HB2 GLU 57 HB2 GLU 57 -8.339 8.930 6.620 459 HB3 GLU 57 HB1 GLU 57 -10.065 8.588 6.576 460 HG2 GLU 57 HG2 GLU 57 -8.023 6.821 7.900 461 HG3 GLU 57 HG1 GLU 57 -8.960 8.057 8.734 462 H THR 58 HN THR 58 -7.615 7.974 3.264 463 HA THR 58 HA THR 58 -10.042 9.103 2.025 464 HB THR 58 HB THR 58 -8.569 10.728 0.853 465 HG1 THR 58 HG1 THR 58 -6.599 9.866 2.729 466 HG21 THR 58 HG21 THR 58 -8.531 10.735 3.866 467 HG22 THR 58 HG22 THR 58 -9.767 11.440 2.820 468 HG23 THR 58 HG23 THR 58 -8.146 12.136 2.863 469 H LEU 59 HN LEU 59 -7.496 6.867 1.694 470 HA LEU 59 HA LEU 59 -7.239 6.735 -1.111 471 HB2 LEU 59 HB2 LEU 59 -7.219 4.225 0.522 472 HB3 LEU 59 HB1 LEU 59 -6.233 4.662 -0.850 473 HG LEU 59 HG LEU 59 -5.933 5.686 1.963 474 HD11 LEU 59 HD11 LEU 59 -4.355 3.771 0.267 475 HD12 LEU 59 HD12 LEU 59 -5.088 3.497 1.847 476 HD13 LEU 59 HD13 LEU 59 -3.687 4.557 1.699 477 HD21 LEU 59 HD21 LEU 59 -4.573 6.493 -0.579 478 HD22 LEU 59 HD22 LEU 59 -3.801 6.689 0.985 479 HD23 LEU 59 HD23 LEU 59 -5.320 7.514 0.639 480 H LYS 60 HN LYS 60 -8.510 5.827 -2.662 481 HA LYS 60 HA LYS 60 -11.218 5.247 -2.234 482 HB2 LYS 60 HB2 LYS 60 -9.408 4.268 -4.453 483 HB3 LYS 60 HB1 LYS 60 -11.165 4.312 -4.514 484 HG2 LYS 60 HG2 LYS 60 -11.101 6.750 -4.377 485 HG3 LYS 60 HG1 LYS 60 -9.336 6.701 -4.309 486 HD2 LYS 60 HD2 LYS 60 -9.311 5.604 -6.516 487 HD3 LYS 60 HD1 LYS 60 -11.069 5.751 -6.589 488 HE2 LYS 60 HE2 LYS 60 -9.970 7.542 -7.835 489 HE3 LYS 60 HE1 LYS 60 -10.883 8.174 -6.465 490 HZ1 LYS 60 HZ1 LYS 60 -8.782 9.265 -6.545 491 HZ2 LYS 60 HZ2 LYS 60 -7.941 7.801 -6.631 492 HZ3 LYS 60 HZ3 LYS 60 -8.758 8.223 -5.211 493 HA PRO 61 HA PRO 61 -11.331 1.125 -0.579 494 HB2 PRO 61 HB2 PRO 61 -13.549 0.610 -2.467 495 HB3 PRO 61 HB1 PRO 61 -13.531 0.507 -0.706 496 HG2 PRO 61 HG2 PRO 61 -14.781 2.497 -2.036 497 HG3 PRO 61 HG1 PRO 61 -14.049 2.733 -0.441 498 HD2 PRO 61 HD2 PRO 61 -13.092 3.618 -3.113 499 HD3 PRO 61 HD1 PRO 61 -12.849 4.357 -1.518 500 H SER 62 HN SER 62 -11.374 1.709 -4.040 501 HA SER 62 HA SER 62 -10.646 -0.938 -4.798 502 HB2 SER 62 HB2 SER 62 -9.945 0.287 -6.954 503 HB3 SER 62 HB1 SER 62 -11.645 0.317 -6.506 504 HG SER 62 HG SER 62 -11.136 2.395 -6.992 505 H THR 63 HN THR 63 -8.892 2.031 -4.100 506 HA THR 63 HA THR 63 -6.317 1.164 -4.759 507 HB THR 63 HB THR 63 -6.874 3.041 -2.446 508 HG1 THR 63 HG1 THR 63 -7.138 4.689 -4.025 509 HG21 THR 63 HG21 THR 63 -4.535 2.399 -2.989 510 HG22 THR 63 HG22 THR 63 -4.849 4.120 -3.176 511 HG23 THR 63 HG23 THR 63 -4.753 3.080 -4.596 512 H LEU 64 HN LEU 64 -8.030 1.120 -1.640 513 HA LEU 64 HA LEU 64 -6.066 -0.166 -0.131 514 HB2 LEU 64 HB2 LEU 64 -9.074 -0.247 0.105 515 HB3 LEU 64 HB1 LEU 64 -7.992 -0.924 1.309 516 HG LEU 64 HG LEU 64 -7.999 1.983 0.512 517 HD11 LEU 64 HD11 LEU 64 -10.129 1.334 1.588 518 HD12 LEU 64 HD12 LEU 64 -9.162 2.406 2.593 519 HD13 LEU 64 HD13 LEU 64 -9.214 0.680 2.942 520 HD21 LEU 64 HD21 LEU 64 -5.892 1.299 1.393 521 HD22 LEU 64 HD22 LEU 64 -6.675 0.449 2.720 522 HD23 LEU 64 HD23 LEU 64 -6.751 2.209 2.633 523 H ARG 65 HN ARG 65 -8.717 -1.586 -2.025 524 HA ARG 65 HA ARG 65 -8.191 -4.250 -1.257 525 HB2 ARG 65 HB2 ARG 65 -10.335 -3.422 -2.256 526 HB3 ARG 65 HB1 ARG 65 -9.495 -3.233 -3.779 527 HG2 ARG 65 HG2 ARG 65 -10.939 -5.323 -3.461 528 HG3 ARG 65 HG1 ARG 65 -9.349 -5.497 -4.186 529 HD2 ARG 65 HD2 ARG 65 -8.452 -6.411 -2.150 530 HD3 ARG 65 HD1 ARG 65 -9.932 -6.058 -1.253 531 HE ARG 65 HE ARG 65 -10.718 -7.659 -3.335 532 HH11 ARG 65 HH11 ARG 65 -8.441 -7.947 -0.677 533 HH12 ARG 65 HH12 ARG 65 -8.596 -9.676 -0.589 534 HH21 ARG 65 HH21 ARG 65 -10.903 -9.928 -3.211 535 HH22 ARG 65 HH22 ARG 65 -10.002 -10.797 -2.007 536 H GLU 66 HN GLU 66 -6.780 -2.144 -3.610 537 HA GLU 66 HA GLU 66 -5.516 -4.231 -5.142 538 HB2 GLU 66 HB2 GLU 66 -6.169 -2.161 -6.228 539 HB3 GLU 66 HB1 GLU 66 -5.180 -1.231 -5.116 540 HG2 GLU 66 HG2 GLU 66 -4.078 -1.393 -7.237 541 HG3 GLU 66 HG1 GLU 66 -3.172 -2.318 -6.040 542 H LEU 67 HN LEU 67 -4.641 -1.946 -2.625 543 HA LEU 67 HA LEU 67 -1.860 -2.430 -2.628 544 HB2 LEU 67 HB2 LEU 67 -3.649 -1.552 -0.349 545 HB3 LEU 67 HB1 LEU 67 -1.919 -1.296 -0.448 546 HG LEU 67 HG LEU 67 -4.018 -0.022 -2.208 547 HD11 LEU 67 HD11 LEU 67 -2.192 1.202 -0.151 548 HD12 LEU 67 HD12 LEU 67 -3.891 0.813 0.122 549 HD13 LEU 67 HD13 LEU 67 -3.444 2.021 -1.083 550 HD21 LEU 67 HD21 LEU 67 -1.822 -0.538 -3.318 551 HD22 LEU 67 HD22 LEU 67 -1.083 0.573 -2.167 552 HD23 LEU 67 HD23 LEU 67 -2.301 1.156 -3.295 553 H GLU 68 HN GLU 68 -4.536 -3.588 -0.657 554 HA GLU 68 HA GLU 68 -3.061 -5.287 1.037 555 HB2 GLU 68 HB2 GLU 68 -5.218 -4.509 1.699 556 HB3 GLU 68 HB1 GLU 68 -5.977 -5.182 0.268 557 HG2 GLU 68 HG2 GLU 68 -4.598 -7.106 2.009 558 HG3 GLU 68 HG1 GLU 68 -6.023 -6.329 2.686 559 H ARG 69 HN ARG 69 -5.043 -6.041 -1.835 560 HA ARG 69 HA ARG 69 -4.685 -8.815 -1.796 561 HB2 ARG 69 HB2 ARG 69 -6.345 -7.650 -3.209 562 HB3 ARG 69 HB1 ARG 69 -5.035 -7.076 -4.238 563 HG2 ARG 69 HG2 ARG 69 -4.444 -9.562 -4.486 564 HG3 ARG 69 HG1 ARG 69 -6.080 -9.848 -3.892 565 HD2 ARG 69 HD2 ARG 69 -5.934 -9.788 -6.364 566 HD3 ARG 69 HD1 ARG 69 -7.033 -8.590 -5.691 567 HE ARG 69 HE ARG 69 -5.004 -7.034 -5.967 568 HH11 ARG 69 HH11 ARG 69 -5.711 -9.721 -8.098 569 HH12 ARG 69 HH12 ARG 69 -5.078 -8.931 -9.507 570 HH21 ARG 69 HH21 ARG 69 -4.157 -5.985 -7.812 571 HH22 ARG 69 HH22 ARG 69 -4.191 -6.815 -9.345 572 H TYR 70 HN TYR 70 -2.655 -6.272 -2.992 573 HA TYR 70 HA TYR 70 -0.967 -8.034 -4.520 574 HB2 TYR 70 HB2 TYR 70 -1.064 -5.843 -5.377 575 HB3 TYR 70 HB1 TYR 70 -0.829 -5.116 -3.790 576 HD1 TYR 70 HD2 TYR 70 0.904 -7.058 -6.448 577 HD2 TYR 70 HD1 TYR 70 1.299 -4.577 -3.017 578 HE1 TYR 70 HE2 TYR 70 3.324 -6.907 -6.850 579 HE2 TYR 70 HE1 TYR 70 3.729 -4.422 -3.405 580 HH TYR 70 HH TYR 70 5.470 -5.390 -4.535 581 H VAL 71 HN VAL 71 -0.646 -6.274 -1.444 582 HA VAL 71 HA VAL 71 1.993 -7.149 -0.959 583 HB VAL 71 HB VAL 71 1.656 -6.445 1.346 584 HG11 VAL 71 HG11 VAL 71 0.426 -4.142 0.451 585 HG12 VAL 71 HG12 VAL 71 1.176 -4.816 -0.990 586 HG13 VAL 71 HG13 VAL 71 2.151 -4.477 0.441 587 HG21 VAL 71 HG21 VAL 71 -0.434 -7.018 2.043 588 HG22 VAL 71 HG22 VAL 71 -1.201 -6.490 0.544 589 HG23 VAL 71 HG23 VAL 71 -0.665 -5.298 1.729 590 H THR 72 HN THR 72 -1.143 -8.420 0.076 591 HA THR 72 HA THR 72 -0.191 -10.404 1.786 592 HB THR 72 HB THR 72 -2.592 -9.636 1.543 593 HG1 THR 72 HG1 THR 72 -2.362 -11.380 2.846 594 HG21 THR 72 HG21 THR 72 -2.679 -9.946 -0.919 595 HG22 THR 72 HG22 THR 72 -4.009 -10.714 -0.056 596 HG23 THR 72 HG23 THR 72 -2.671 -11.690 -0.664 597 H SER 73 HN SER 73 -0.446 -10.314 -1.695 598 HA SER 73 HA SER 73 0.020 -13.056 -2.176 599 HB2 SER 73 HB2 SER 73 0.212 -12.484 -4.421 600 HB3 SER 73 HB1 SER 73 -0.688 -11.096 -3.802 601 HG SER 73 HG SER 73 1.127 -9.872 -3.847 602 H CYS 74 HN CYS 74 2.067 -10.413 -1.302 603 HA CYS 74 HA CYS 74 4.521 -11.798 -2.007 604 HB2 CYS 74 HB2 CYS 74 4.366 -9.397 -2.437 605 HB3 CYS 74 HB1 CYS 74 4.054 -9.095 -0.732 606 HG CYS 74 HG CYS 74 6.728 -10.550 -0.337 607 H LEU 75 HN LEU 75 3.010 -10.472 0.944 608 HA LEU 75 HA LEU 75 4.804 -11.400 2.833 609 HB2 LEU 75 HB2 LEU 75 1.869 -11.530 3.384 610 HB3 LEU 75 HB1 LEU 75 3.167 -11.001 4.429 611 HG LEU 75 HG LEU 75 2.253 -9.434 2.038 612 HD11 LEU 75 HD11 LEU 75 1.593 -8.767 4.861 613 HD12 LEU 75 HD12 LEU 75 0.571 -9.879 3.955 614 HD13 LEU 75 HD13 LEU 75 0.814 -8.236 3.371 615 HD21 LEU 75 HD21 LEU 75 4.546 -9.059 2.900 616 HD22 LEU 75 HD22 LEU 75 3.852 -8.634 4.462 617 HD23 LEU 75 HD23 LEU 75 3.498 -7.650 3.041 618 H ARG 76 HN ARG 76 2.400 -13.155 1.028 619 HA ARG 76 HA ARG 76 2.698 -15.522 2.701 620 HB2 ARG 76 HB2 ARG 76 0.866 -14.812 0.424 621 HB3 ARG 76 HB1 ARG 76 0.956 -16.445 1.080 622 HG2 ARG 76 HG2 ARG 76 0.142 -15.754 3.173 623 HG3 ARG 76 HG1 ARG 76 0.404 -14.050 2.801 624 HD2 ARG 76 HD2 ARG 76 -1.953 -14.609 2.673 625 HD3 ARG 76 HD1 ARG 76 -1.330 -14.156 1.088 626 HE ARG 76 HE ARG 76 -1.122 -16.759 0.888 627 HH11 ARG 76 HH11 ARG 76 -3.718 -14.923 2.351 628 HH12 ARG 76 HH12 ARG 76 -4.944 -16.074 1.926 629 HH21 ARG 76 HH21 ARG 76 -2.735 -18.294 0.343 630 HH22 ARG 76 HH22 ARG 76 -4.385 -17.991 0.789 631 H LYS 77 HN LYS 77 4.603 -14.253 0.538 632 HA LYS 77 HA LYS 77 5.495 -16.902 -0.381 633 HB2 LYS 77 HB2 LYS 77 5.328 -14.363 -1.980 634 HB3 LYS 77 HB1 LYS 77 6.452 -15.647 -2.410 635 HG2 LYS 77 HG2 LYS 77 4.703 -17.171 -2.830 636 HG3 LYS 77 HG1 LYS 77 3.510 -16.112 -2.078 637 HD2 LYS 77 HD2 LYS 77 3.917 -14.451 -3.869 638 HD3 LYS 77 HD1 LYS 77 5.036 -15.582 -4.630 639 HE2 LYS 77 HE2 LYS 77 2.122 -16.135 -4.108 640 HE3 LYS 77 HE1 LYS 77 2.772 -15.574 -5.645 641 HZ1 LYS 77 HZ1 LYS 77 4.131 -17.592 -5.733 642 HZ2 LYS 77 HZ2 LYS 77 2.481 -17.948 -5.676 643 HZ3 LYS 77 HZ3 LYS 77 3.429 -18.131 -4.292 644 H LYS 78 HN LYS 78 7.241 -17.233 0.927 645 HA LYS 78 HA LYS 78 9.067 -14.960 1.311 646 HB2 LYS 78 HB2 LYS 78 8.004 -15.586 3.420 647 HB3 LYS 78 HB1 LYS 78 8.544 -17.251 3.205 648 HG2 LYS 78 HG2 LYS 78 10.018 -16.214 4.747 649 HG3 LYS 78 HG1 LYS 78 10.881 -16.388 3.217 650 HD2 LYS 78 HD2 LYS 78 10.403 -14.054 2.672 651 HD3 LYS 78 HD1 LYS 78 9.547 -13.872 4.205 652 HE2 LYS 78 HE2 LYS 78 11.572 -14.293 5.437 653 HE3 LYS 78 HE1 LYS 78 12.447 -14.652 3.951 654 HZ1 LYS 78 HZ1 LYS 78 12.161 -12.379 3.248 655 HZ2 LYS 78 HZ2 LYS 78 12.887 -12.411 4.774 656 HZ3 LYS 78 HZ3 LYS 78 11.250 -12.023 4.627 657 H ARG 79 HN ARG 79 9.007 -18.522 1.219 658 HA ARG 79 HA ARG 79 11.772 -18.451 0.305 659 HB2 ARG 79 HB2 ARG 79 11.495 -21.023 0.428 660 HB3 ARG 79 HB1 ARG 79 11.616 -20.107 1.918 661 HG2 ARG 79 HG2 ARG 79 9.928 -21.736 2.214 662 HG3 ARG 79 HG1 ARG 79 9.125 -20.176 2.071 663 HD2 ARG 79 HD2 ARG 79 7.960 -21.928 0.823 664 HD3 ARG 79 HD1 ARG 79 8.558 -20.656 -0.239 665 HE ARG 79 HE ARG 79 10.542 -22.442 -0.372 666 HH11 ARG 79 HH11 ARG 79 7.069 -22.848 -0.628 667 HH12 ARG 79 HH12 ARG 79 7.183 -24.185 -1.728 668 HH21 ARG 79 HH21 ARG 79 10.692 -24.185 -1.832 669 HH22 ARG 79 HH22 ARG 79 9.245 -24.947 -2.413 670 H LYS 80 HN LYS 80 9.571 -17.527 -1.264 671 HA LYS 80 HA LYS 80 10.331 -18.601 -3.770 672 HB2 LYS 80 HB2 LYS 80 8.068 -19.429 -4.450 673 HB3 LYS 80 HB1 LYS 80 8.873 -20.436 -3.260 674 HG2 LYS 80 HG2 LYS 80 7.507 -19.402 -1.495 675 HG3 LYS 80 HG1 LYS 80 6.672 -18.453 -2.723 676 HD2 LYS 80 HD2 LYS 80 6.769 -21.457 -2.816 677 HD3 LYS 80 HD1 LYS 80 5.535 -20.591 -1.904 678 HE2 LYS 80 HE2 LYS 80 4.547 -21.050 -3.980 679 HE3 LYS 80 HE1 LYS 80 5.018 -19.358 -4.066 680 HZ1 LYS 80 HZ1 LYS 80 5.518 -20.707 -6.078 681 HZ2 LYS 80 HZ2 LYS 80 6.659 -21.564 -5.175 682 HZ3 LYS 80 HZ3 LYS 80 6.855 -19.905 -5.435 683 HA PRO 81 HA PRO 81 8.409 -14.341 -3.555 684 HB2 PRO 81 HB2 PRO 81 10.593 -12.878 -4.099 685 HB3 PRO 81 HB1 PRO 81 10.249 -13.456 -2.463 686 HG2 PRO 81 HG2 PRO 81 12.122 -14.576 -4.508 687 HG3 PRO 81 HG1 PRO 81 12.381 -14.333 -2.772 688 HD2 PRO 81 HD2 PRO 81 11.712 -16.743 -3.869 689 HD3 PRO 81 HD1 PRO 81 11.286 -16.271 -2.211 690 H GLN 82 HN GLN 82 8.212 -12.761 -5.301 691 HA GLN 82 HA GLN 82 8.491 -14.044 -7.916 692 HB2 GLN 82 HB2 GLN 82 6.920 -11.609 -7.041 693 HB3 GLN 82 HB1 GLN 82 7.013 -12.168 -8.704 694 HG2 GLN 82 HG2 GLN 82 5.824 -13.649 -6.369 695 HG3 GLN 82 HG1 GLN 82 4.951 -12.905 -7.710 696 HE21 GLN 82 HE21 GLN 82 5.016 -13.874 -9.737 697 HE22 GLN 82 HE22 GLN 82 5.496 -15.520 -9.948 698 H ALA 83 HN ALA 83 10.882 -13.583 -7.462 699 HA ALA 83 HA ALA 83 11.571 -11.098 -8.848 700 HB1 ALA 83 HB1 ALA 83 11.878 -10.652 -6.457 701 HB2 ALA 83 HB2 ALA 83 13.419 -10.660 -7.314 702 HB3 ALA 83 HB3 ALA 83 12.947 -12.050 -6.334 703 H1 GLU 201 HT1 GLU 201 -7.149 9.939 11.158 704 H2 GLU 201 HT2 GLU 201 -5.624 9.234 11.349 705 H3 GLU 201 HT3 GLU 201 -6.993 8.256 11.161 706 HA GLU 201 HA GLU 201 -7.330 9.102 8.936 707 HB2 GLU 201 HB2 GLU 201 -5.739 10.539 7.873 708 HB3 GLU 201 HB1 GLU 201 -6.217 11.301 9.380 709 HG2 GLU 201 HG2 GLU 201 -3.693 9.710 9.024 710 HG3 GLU 201 HG1 GLU 201 -3.791 11.459 8.848 711 H ILE 202 HN ILE 202 -4.671 7.797 10.742 712 HA ILE 202 HA ILE 202 -3.213 6.102 10.392 713 HB ILE 202 HB ILE 202 -5.265 5.239 8.348 714 HG12 ILE 202 HG12 ILE 202 -6.062 5.341 10.688 715 HG13 ILE 202 HG11 ILE 202 -6.017 3.694 10.069 716 HG21 ILE 202 HG21 ILE 202 -4.218 3.027 8.455 717 HG22 ILE 202 HG22 ILE 202 -2.962 3.673 9.511 718 HG23 ILE 202 HG23 ILE 202 -3.092 4.240 7.847 719 HD11 ILE 202 HD11 ILE 202 -3.909 3.315 11.254 720 HD12 ILE 202 HD12 ILE 202 -5.213 3.781 12.347 721 HD13 ILE 202 HD13 ILE 202 -3.983 4.958 11.892 722 H LYS 203 HN LYS 203 -1.519 7.325 9.691 723 HA LYS 203 HA LYS 203 -1.207 7.769 6.818 724 HB2 LYS 203 HB2 LYS 203 0.392 8.760 9.182 725 HB3 LYS 203 HB1 LYS 203 0.773 9.127 7.505 726 HG2 LYS 203 HG2 LYS 203 -1.359 10.268 7.256 727 HG3 LYS 203 HG1 LYS 203 -1.775 9.869 8.921 728 HD2 LYS 203 HD2 LYS 203 0.600 11.531 8.094 729 HD3 LYS 203 HD1 LYS 203 -0.944 12.185 8.644 730 HE2 LYS 203 HE2 LYS 203 -0.647 10.991 10.784 731 HE3 LYS 203 HE1 LYS 203 0.929 10.430 10.228 732 HZ1 LYS 203 HZ1 LYS 203 1.613 12.758 10.036 733 HZ2 LYS 203 HZ2 LYS 203 1.189 12.352 11.619 734 HZ3 LYS 203 HZ3 LYS 203 0.122 13.251 10.664 735 H LEU 204 HN LEU 204 0.687 7.137 5.721 736 HA LEU 204 HA LEU 204 2.386 5.144 7.048 737 HB2 LEU 204 HB2 LEU 204 0.438 4.240 5.492 738 HB3 LEU 204 HB1 LEU 204 1.540 4.705 4.216 739 HG LEU 204 HG LEU 204 1.894 2.554 6.290 740 HD11 LEU 204 HD11 LEU 204 2.094 2.560 3.281 741 HD12 LEU 204 HD12 LEU 204 0.706 2.009 4.222 742 HD13 LEU 204 HD13 LEU 204 2.243 1.155 4.340 743 HD21 LEU 204 HD21 LEU 204 4.042 3.562 4.434 744 HD22 LEU 204 HD22 LEU 204 4.160 2.207 5.559 745 HD23 LEU 204 HD23 LEU 204 3.996 3.852 6.173 746 H LYS 205 HN LYS 205 4.282 6.216 7.010 747 HA LYS 205 HA LYS 205 5.088 7.694 4.648 748 HB2 LYS 205 HB2 LYS 205 6.370 7.206 7.330 749 HB3 LYS 205 HB1 LYS 205 7.234 7.987 6.014 750 HG2 LYS 205 HG2 LYS 205 4.640 8.983 7.163 751 HG3 LYS 205 HG1 LYS 205 6.238 9.564 7.638 752 HD2 LYS 205 HD2 LYS 205 6.622 10.149 5.227 753 HD3 LYS 205 HD1 LYS 205 4.923 9.767 4.935 754 HE2 LYS 205 HE2 LYS 205 6.042 11.898 6.740 755 HE3 LYS 205 HE1 LYS 205 5.125 12.130 5.253 756 HZ1 LYS 205 HZ1 LYS 205 4.097 10.954 7.779 757 HZ2 LYS 205 HZ2 LYS 205 3.205 11.069 6.345 758 HZ3 LYS 205 HZ3 LYS 205 3.706 12.472 7.149 759 H ILE 206 HN ILE 206 4.993 5.789 3.251 760 HA ILE 206 HA ILE 206 6.757 3.603 3.621 761 HB ILE 206 HB ILE 206 5.889 4.569 0.896 762 HG12 ILE 206 HG12 ILE 206 4.338 2.781 2.772 763 HG13 ILE 206 HG11 ILE 206 3.849 4.394 2.263 764 HG21 ILE 206 HG21 ILE 206 6.020 1.731 1.701 765 HG22 ILE 206 HG22 ILE 206 7.555 2.618 1.572 766 HG23 ILE 206 HG23 ILE 206 6.479 2.517 0.177 767 HD11 ILE 206 HD11 ILE 206 4.399 2.638 0.021 768 HD12 ILE 206 HD12 ILE 206 2.967 3.612 0.375 769 HD13 ILE 206 HD13 ILE 206 3.139 2.012 1.088 770 H THR 207 HN THR 207 8.901 3.822 3.743 771 HA THR 207 HA THR 207 10.195 5.915 2.138 772 HB THR 207 HB THR 207 12.122 5.533 3.766 773 HG1 THR 207 HG1 THR 207 11.615 4.470 5.675 774 HG21 THR 207 HG21 THR 207 11.091 6.915 5.512 775 HG22 THR 207 HG22 THR 207 9.496 6.556 4.853 776 HG23 THR 207 HG23 THR 207 10.656 7.483 3.902 777 H LYS 208 HN LYS 208 11.095 5.189 0.321 778 HA LYS 208 HA LYS 208 13.054 3.193 0.308 779 HB2 LYS 208 HB2 LYS 208 12.070 1.408 -0.920 780 HB3 LYS 208 HB1 LYS 208 11.040 1.716 0.461 781 HG2 LYS 208 HG2 LYS 208 10.490 2.597 -2.368 782 HG3 LYS 208 HG1 LYS 208 9.771 1.208 -1.565 783 HD2 LYS 208 HD2 LYS 208 8.114 2.631 -1.069 784 HD3 LYS 208 HD1 LYS 208 9.210 3.224 0.183 785 HE2 LYS 208 HE2 LYS 208 10.060 4.907 -1.372 786 HE3 LYS 208 HE1 LYS 208 8.956 4.316 -2.610 787 HZ1 LYS 208 HZ1 LYS 208 7.102 4.958 -1.249 788 HZ2 LYS 208 HZ2 LYS 208 8.130 6.282 -1.489 789 HZ3 LYS 208 HZ3 LYS 208 8.135 5.464 -0.004 790 H THR 209 HN THR 209 12.513 2.410 -2.505 791 HA THR 209 HA THR 209 13.166 3.032 -4.561 792 HB THR 209 HB THR 209 12.329 5.126 -5.528 793 HG1 THR 209 HG1 THR 209 12.275 5.947 -2.964 794 HG21 THR 209 HG21 THR 209 10.278 3.744 -3.793 795 HG22 THR 209 HG22 THR 209 10.830 3.204 -5.381 796 HG23 THR 209 HG23 THR 209 9.943 4.718 -5.225 797 H ILE 210 HN ILE 210 15.144 3.111 -2.761 798 HA ILE 210 HA ILE 210 16.631 5.474 -2.554 799 HB ILE 210 HB ILE 210 17.715 2.656 -2.745 800 HG12 ILE 210 HG12 ILE 210 16.922 4.234 -0.286 801 HG13 ILE 210 HG11 ILE 210 15.953 2.951 -1.000 802 HG21 ILE 210 HG21 ILE 210 18.893 5.148 -1.520 803 HG22 ILE 210 HG22 ILE 210 19.436 4.357 -2.999 804 HG23 ILE 210 HG23 ILE 210 19.600 3.535 -1.448 805 HD11 ILE 210 HD11 ILE 210 17.185 2.139 0.914 806 HD12 ILE 210 HD12 ILE 210 18.704 2.650 0.179 807 HD13 ILE 210 HD13 ILE 210 17.758 1.358 -0.560 808 H GLN 211 HN GLN 211 16.575 2.971 -5.032 809 HA GLN 211 HA GLN 211 18.206 4.697 -6.754 810 HB2 GLN 211 HB2 GLN 211 18.384 2.646 -8.208 811 HB3 GLN 211 HB1 GLN 211 19.170 2.527 -6.641 812 HG2 GLN 211 HG2 GLN 211 17.348 1.199 -5.785 813 HG3 GLN 211 HG1 GLN 211 16.455 1.401 -7.291 814 HE21 GLN 211 HE21 GLN 211 17.385 -1.024 -5.940 815 HE22 GLN 211 HE22 GLN 211 18.370 -1.857 -7.089 816 H ASN 212 HN ASN 212 17.004 6.028 -7.913 817 HA ASN 212 HA ASN 212 14.311 5.231 -8.689 818 HB2 ASN 212 HB2 ASN 212 14.097 7.639 -9.416 819 HB3 ASN 212 HB1 ASN 212 14.365 7.394 -7.696 820 HD21 ASN 212 HD21 ASN 212 16.295 8.038 -6.777 821 HD22 ASN 212 HD22 ASN 212 17.416 9.068 -7.596
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